SMILES for Apelin receptor

4285 SMILES Strings for Apelin receptor

Compound Name

SMILES String

COc1cccc(n1)-c1nnc(NS(C)(=O)=O)n1-c1c(OC)cccc1OC |(-8.18,-4.38,;-8.58,-2.89,;-7.49,-1.8,;-7.89,-.31,;-6.8,.78,;-5.31,.38,;-4.91,-1.11,;-6,-2.2,;-3.42,-1.51,;-2.95,-2.97,;-1.41,-2.97,;-.93,-1.51,;.56,-1.11,;1.64,-2.2,;2.73,-1.11,;.56,-3.29,;2.73,-3.29,;-2.18,-.6,;-2.18,1.3,;-3.51,2.07,;-4.85,1.3,;-6.18,2.07,;-3.51,3.61,;-2.18,4.38,;-.84,3.61,;-.84,2.07,;.49,1.3,;1.82,2.07,)|

BDBM269508

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(6.11,-3.4,;4.62,-3,;4.22,-1.51,;2.73,-1.11,;2.33,.38,;1.64,-2.2,;.56,-3.29,;2.73,-3.29,;.56,-1.11,;-.93,-1.51,;-1.41,-2.97,;-2.95,-2.97,;-3.42,-1.51,;-4.91,-1.11,;-5.31,.38,;-6.8,.78,;-7.89,-.31,;-7.49,-1.8,;-8.58,-2.89,;-8.18,-4.38,;-6,-2.2,;-2.18,-.6,;-2.18,1.3,;-3.51,2.07,;-4.85,1.3,;-6.18,2.07,;-3.51,3.61,;-2.18,4.38,;-.84,3.61,;-.84,2.07,;.49,1.3,;1.82,2.07,;5.31,-.42,;6.8,-.82,;7.89,.27,;7.49,1.76,;8.58,2.85,;6,2.16,;4.91,1.07,)|

BDBM269510

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.93,-2.3,;-8.41,-1.9,;-8.81,-.41,;-7.72,.68,;-8.12,2.16,;-6.24,.28,;-3.1,-.7,;-3.1,.84,;-1.77,1.61,;-.44,.84,;.9,1.61,;-1.77,3.15,;-3.1,3.92,;-4.44,3.15,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM269511

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(1.74,-4.79,;3.08,-4.02,;3.08,-2.48,;1.99,-1.39,;2.39,.1,;.5,-1.79,;-.59,-2.88,;.9,-3.28,;-.59,-.7,;-2.07,-1.1,;-2.55,-2.56,;-4.09,-2.56,;-4.57,-1.1,;-6.05,-.7,;-7.14,-1.79,;-8.63,-1.39,;-9.03,.1,;-7.94,1.19,;-8.34,2.67,;-6.45,.79,;-3.32,-.19,;-3.32,1.71,;-4.65,2.48,;-5.99,1.71,;-7.32,2.48,;-4.65,4.02,;-3.32,4.79,;-1.99,4.02,;-1.99,2.48,;-.65,1.71,;.68,2.48,;4.57,-2.08,;5.66,-3.17,;7.14,-2.77,;7.54,-1.28,;9.03,-.88,;6.45,-.19,;4.96,-.59,)|

BDBM269512

CCS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC |(6.57,.28,;6.57,-1.26,;5.23,-2.03,;4.46,-3.36,;6,-3.36,;3.9,-1.26,;2.57,-2.03,;2.09,-3.49,;.55,-3.49,;.07,-2.03,;-1.41,-1.63,;-1.81,-.14,;-3.3,.25,;-4.39,-.83,;-3.99,-2.32,;-5.08,-3.41,;-6.57,-3.01,;-2.5,-2.72,;1.32,-1.13,;1.32,.41,;2.65,1.18,;3.99,.41,;5.32,1.18,;2.65,2.72,;1.32,3.49,;-.01,2.72,;-.01,1.18,;-1.35,.41,;-2.68,1.18,)|

BDBM269513

CCS(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)cccc1OC |(5.82,.28,;5.82,-1.26,;4.49,-2.03,;3.72,-3.36,;5.26,-3.36,;3.16,-1.26,;1.82,-2.03,;1.35,-3.49,;-.19,-3.49,;-.67,-2.03,;-2.16,-1.63,;-2.56,-.14,;-4.04,.25,;-5.13,-.83,;-4.73,-2.32,;-5.82,-3.41,;-3.25,-2.72,;.58,-1.13,;.58,.41,;1.91,1.18,;3.24,.41,;4.58,1.18,;1.91,2.72,;.58,3.49,;-.76,2.72,;-.76,1.18,;-2.09,.41,;-3.43,1.18,)|

BDBM269514

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1ccccc1OC |r,wD:16.17,(-8.76,-4.2,;-9.16,-2.71,;-8.07,-1.62,;-8.47,-.13,;-7.38,.96,;-5.89,.56,;-5.49,-.93,;-6.58,-2.02,;-4,-1.33,;-3.53,-2.79,;-1.99,-2.79,;-1.51,-1.33,;-.18,-.56,;1.15,-1.33,;.38,-2.66,;1.92,-2.66,;2.49,-.56,;2.49,.98,;3.82,-1.33,;5.16,-.56,;6.49,-1.33,;7.82,-.56,;7.82,.98,;9.16,1.75,;6.49,1.75,;5.16,.98,;-2.76,-.42,;-2.76,1.12,;-1.42,1.89,;-1.42,3.43,;-2.76,4.2,;-4.09,3.43,;-4.09,1.89,;-5.43,1.12,;-6.76,1.89,)|

BDBM269515

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(C)noc1C |r,wD:16.17,(-8.76,-3.84,;-9.16,-2.35,;-8.07,-1.27,;-8.47,.22,;-7.38,1.31,;-5.89,.91,;-5.49,-.57,;-6.58,-1.66,;-4,-.97,;-3.53,-2.44,;-1.99,-2.44,;-1.51,-.97,;-.18,-.2,;1.15,-.97,;.38,-2.31,;1.92,-2.31,;2.49,-.2,;2.49,1.34,;3.82,-.97,;5.16,-.2,;6.49,-.97,;7.82,-.2,;7.82,1.34,;9.16,2.11,;6.49,2.11,;5.16,1.34,;-2.76,-.07,;-2.76,1.47,;-1.51,2.38,;-.18,1.61,;-1.99,3.84,;-3.53,3.84,;-4,2.38,;-5.34,1.61,)|

BDBM269516

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccnc1)c1ncc(C)cn1 |r|

BDBM269517

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1)c1ncc(C)cn1 |r|

BDBM269518

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(7.52,-1.62,;5.98,-1.62,;5.21,-.28,;3.67,-.28,;2.9,1.05,;2.9,-1.62,;2.13,-2.95,;4.24,-2.39,;1.57,-.85,;.24,-1.62,;.24,-3.16,;-1.23,-3.63,;-2.13,-2.39,;-3.67,-2.39,;-4.44,-1.05,;-5.98,-1.05,;-6.75,-2.39,;-5.98,-3.72,;-6.75,-5.05,;-8.29,-5.05,;-4.44,-3.72,;-1.23,-1.14,;-1.63,.35,;-.54,1.44,;.95,1.04,;2.04,2.13,;-.94,2.92,;-2.42,3.32,;-3.51,2.23,;-3.11,.75,;-4.2,-.34,;-5.69,.06,;5.98,1.05,;7.52,1.05,;8.29,2.39,;7.52,3.72,;8.29,5.05,;5.98,3.72,;5.21,2.39,)|

BDBM269519

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(7.52,-1.62,;5.98,-1.62,;5.21,-.28,;3.67,-.28,;2.9,1.05,;2.9,-1.62,;2.13,-2.95,;4.24,-2.39,;1.57,-.85,;.24,-1.62,;.24,-3.16,;-1.23,-3.63,;-2.13,-2.39,;-3.67,-2.39,;-4.44,-1.05,;-5.98,-1.05,;-6.75,-2.39,;-5.98,-3.72,;-6.75,-5.05,;-8.29,-5.05,;-4.44,-3.72,;-1.23,-1.14,;-1.63,.35,;-.54,1.44,;.95,1.04,;1.72,2.37,;-.94,2.92,;-2.42,3.32,;-3.51,2.23,;-3.11,.75,;-4.2,-.34,;-5.69,.06,;5.98,1.05,;7.52,1.05,;8.29,2.39,;7.52,3.72,;8.29,5.05,;5.98,3.72,;5.21,2.39,)|

BDBM269520

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(8.29,-.95,;6.75,-.95,;5.98,.38,;4.44,.38,;3.67,1.72,;3.67,-.95,;2.9,-2.28,;5.01,-1.72,;2.34,-.18,;1.01,-.95,;1.01,-2.49,;-.46,-2.96,;-1.36,-1.72,;-2.9,-1.72,;-3.67,-.39,;-5.21,-.39,;-5.98,-1.72,;-5.21,-3.05,;-5.98,-4.39,;-7.52,-4.39,;-3.67,-3.05,;-.46,-.47,;-.86,1.01,;.23,2.1,;1.72,1.71,;2.49,3.04,;-.17,3.59,;-1.65,3.99,;-2.74,2.9,;-2.34,1.41,;-3.43,.32,;-4.92,.72,;6.75,1.72,;8.29,1.72,;9.06,3.05,;8.29,4.39,;9.06,5.72,;6.75,4.39,;5.98,3.05,)|

BDBM269521

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(8.29,-.95,;6.75,-.95,;5.98,.38,;4.44,.38,;3.67,1.72,;3.67,-.95,;2.9,-2.28,;5.01,-1.72,;2.34,-.18,;1.01,-.95,;1.01,-2.49,;-.46,-2.96,;-1.36,-1.72,;-2.9,-1.72,;-3.67,-.39,;-5.21,-.39,;-5.98,-1.72,;-5.21,-3.05,;-5.98,-4.39,;-7.52,-4.39,;-3.67,-3.05,;-.46,-.47,;-.86,1.01,;.23,2.1,;1.72,1.71,;2.81,2.79,;-.17,3.59,;-1.65,3.99,;-2.74,2.9,;-2.34,1.41,;-3.43,.32,;-4.92,.72,;6.75,1.72,;8.29,1.72,;9.06,3.05,;8.29,4.39,;9.06,5.72,;6.75,4.39,;5.98,3.05,)|

BDBM269522

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ncc(C)cn1 |r|

BDBM269523

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cc(C)ccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(7.52,-1.62,;5.98,-1.62,;5.21,-.28,;3.67,-.28,;2.9,1.05,;2.9,-1.62,;2.13,-2.95,;4.24,-2.39,;1.57,-.85,;.24,-1.62,;.24,-3.16,;-1.23,-3.63,;-2.13,-2.39,;-3.67,-2.39,;-4.44,-1.05,;-5.98,-1.05,;-6.75,-2.39,;-5.98,-3.72,;-6.75,-5.05,;-8.29,-5.05,;-4.44,-3.72,;-1.23,-1.14,;-1.63,.35,;-3.11,.75,;-3.51,2.23,;-5,2.63,;-2.42,3.32,;-.94,2.92,;-.54,1.44,;.95,1.04,;2.04,2.13,;5.98,1.05,;7.52,1.05,;8.29,2.39,;7.52,3.72,;8.29,5.05,;5.98,3.72,;5.21,2.39,)|

BDBM269524

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC(F)F)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:3.3,2.1,(7.52,-1.62,;5.98,-1.62,;5.21,-.28,;3.67,-.28,;2.9,1.05,;2.9,-1.62,;2.13,-2.95,;4.24,-2.39,;1.57,-.85,;.24,-1.62,;.24,-3.16,;-1.23,-3.63,;-2.13,-2.39,;-3.67,-2.39,;-4.44,-1.05,;-5.98,-1.05,;-6.75,-2.39,;-5.98,-3.72,;-6.75,-5.05,;-8.29,-5.05,;-4.44,-3.72,;-1.23,-1.14,;-1.63,.35,;-3.11,.75,;-4.2,-.34,;-5.69,.06,;-6.78,-1.03,;-6.09,1.54,;-3.51,2.23,;-2.42,3.32,;-.94,2.92,;-.54,1.44,;.95,1.04,;2.04,2.13,;1.64,3.61,;3.58,2.13,;5.98,1.05,;7.52,1.05,;8.29,2.39,;7.52,3.72,;8.29,5.05,;5.98,3.72,;5.21,2.39,)|

BDBM269525

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccncc1)c1ncc(C)cn1 |r|

BDBM269526

CCOc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r,wU:17.18,19.20,(1.64,3.61,;2.04,2.13,;.95,1.04,;-.54,1.44,;-.94,2.92,;-2.42,3.32,;-3.51,2.23,;-3.11,.75,;-4.2,-.34,;-5.69,.06,;-1.63,.35,;-1.23,-1.14,;.24,-1.62,;1.57,-.85,;2.9,-1.62,;2.13,-2.95,;4.24,-2.39,;3.67,-.28,;2.9,1.05,;5.21,-.28,;5.98,-1.62,;7.52,-1.62,;5.98,1.05,;7.52,1.05,;8.29,2.39,;7.52,3.72,;8.29,5.05,;5.98,3.72,;5.21,2.39,;.24,-3.16,;-1.23,-3.63,;-2.13,-2.39,;-3.67,-2.39,;-4.44,-1.05,;-5.98,-1.05,;-6.75,-2.39,;-5.98,-3.72,;-6.75,-5.05,;-8.29,-5.05,;-4.44,-3.72,)|

BDBM269527

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(6.75,-2.28,;5.21,-2.28,;4.44,-.95,;2.9,-.95,;2.13,.38,;2.13,-2.28,;1.36,-3.62,;3.47,-3.05,;.8,-1.51,;-.53,-2.28,;-.53,-3.82,;-2,-4.3,;-2.9,-3.05,;-4.44,-3.05,;-5.21,-1.72,;-6.75,-1.72,;-7.52,-3.05,;-6.75,-4.39,;-5.21,-4.39,;-2,-1.81,;-2.4,-.32,;-3.88,.08,;-4.97,-1.01,;-6.46,-.61,;-4.28,1.57,;-3.19,2.66,;-1.71,2.26,;-1.31,.77,;.18,.37,;1.27,1.46,;5.21,.39,;4.44,1.72,;5.21,3.05,;6.75,3.05,;7.52,4.39,;7.52,1.72,;6.75,.38,)|

BDBM269528

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:3.3,2.1,(4.99,-8.8,;5.76,-7.47,;4.99,-6.14,;3.45,-6.14,;2.68,-4.8,;2.68,-7.47,;1.91,-8.8,;4.01,-8.24,;1.34,-6.7,;.01,-7.47,;.01,-9.01,;-1.46,-9.49,;-2.36,-8.24,;-3.85,-7.84,;-4.94,-8.93,;-6.42,-8.53,;-6.82,-7.04,;-5.73,-5.96,;-4.25,-6.35,;-1.46,-6.99,;-2.29,-4.55,;-3.77,-4.15,;-4.86,-5.24,;-6.35,-4.84,;-4.17,-2.66,;-3.08,-1.58,;-1.6,-1.97,;-1.2,-3.46,;.29,-3.86,;1.38,-2.77,;5.76,-4.8,;7.3,-4.8,;8.07,-3.47,;7.3,-2.14,;8.07,-.8,;5.76,-2.14,;4.99,-3.47,)|

BDBM269529

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(Cl)cc1)c1ncc(C)cn1 |r|

BDBM269530

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(OC)cc1)c1ncc(C)cn1 |r|

BDBM269531

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(F)c1)c1ncc(C)cn1 |r|

BDBM269532

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:4.4,3.2,(5.9,-4.69,;5.9,-3.15,;4.57,-2.38,;4.57,-.84,;3.23,-.07,;3.23,1.47,;1.9,-.84,;1.13,-2.17,;2.67,-2.17,;.57,-.07,;-.77,-.84,;-1.24,-2.3,;-2.78,-2.3,;-3.26,-.84,;-4.75,-.44,;-5.15,1.05,;-6.63,1.45,;-7.72,.36,;-7.32,-1.13,;-8.41,-2.22,;-9.9,-1.82,;-5.84,-1.53,;-2.01,.07,;-2.01,1.61,;-3.35,2.38,;-4.68,1.61,;-6.02,2.38,;-3.35,3.92,;-2.01,4.69,;-.68,3.92,;-.68,2.38,;.65,1.61,;1.99,2.38,;5.9,-.07,;7.23,-.84,;8.57,-.07,;8.57,1.47,;9.9,2.24,;7.23,2.24,;5.9,1.47,)|

BDBM269533

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(OC)cn1 |r,wU:3.3,2.1,(5.23,-3.92,;3.9,-3.15,;3.9,-1.61,;2.57,-.84,;2.57,.7,;1.23,-1.61,;.46,-2.94,;2,-2.94,;-.1,-.84,;-1.44,-1.61,;-1.91,-3.07,;-3.45,-3.07,;-3.93,-1.61,;-5.41,-1.21,;-5.81,.28,;-7.3,.68,;-8.39,-.41,;-7.99,-1.9,;-9.08,-2.99,;-10.57,-2.59,;-6.5,-2.3,;-2.68,-.7,;-2.68,.84,;-4.02,1.61,;-5.35,.84,;-6.68,1.61,;-4.02,3.15,;-2.68,3.92,;-1.35,3.15,;-1.35,1.61,;-.01,.84,;1.32,1.61,;5.23,-.84,;6.57,-1.61,;7.9,-.84,;7.9,.7,;9.23,1.47,;10.57,.7,;6.57,1.47,;5.23,.7,)|

BDBM269534

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1)c1ncc(F)cn1 |r|

BDBM269535

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:4.4,3.2,(4.81,-4.69,;4.81,-3.15,;3.48,-2.38,;3.48,-.84,;2.14,-.07,;2.14,1.47,;.81,-.84,;.04,-2.17,;1.58,-2.17,;-.52,-.07,;-1.86,-.84,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.24,1.05,;-7.72,1.45,;-8.81,.36,;-8.41,-1.13,;-6.93,-1.53,;-3.1,.07,;-3.1,1.61,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-1.77,3.92,;-3.1,4.69,;-4.44,3.92,;-4.44,2.38,;-5.77,1.61,;-7.1,2.38,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,)|

BDBM269536

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;-.68,1.61,;.65,.84,;1.99,1.61,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269537

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc2ccccc2c1)c1ncc(C)cn1 |r|

BDBM269538

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)C(=O)OC)c1ncc(C)cn1 |r|

BDBM269539

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(Cl)c1C)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;.65,3.92,;-.68,1.61,;.65,.84,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269540

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)[N+]#[C-])c1ncc(C)cn1 |r|

BDBM269541

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(OC)cn1 |r,wU:3.3,2.1,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.85,-.84,;-2.18,-1.61,;-2.66,-3.07,;-4.2,-3.07,;-4.67,-1.61,;-6.16,-1.21,;-6.56,.28,;-8.04,.68,;-9.13,-.41,;-8.73,-1.9,;-9.82,-2.99,;-7.25,-2.3,;-3.43,-.7,;-3.43,.84,;-4.76,1.61,;-6.09,.84,;-7.43,1.61,;-4.76,3.15,;-3.43,3.92,;-2.09,3.15,;-2.09,1.61,;-.76,.84,;.58,1.61,;4.49,-.84,;5.82,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;9.82,.7,;5.82,1.47,;4.49,.7,)|

BDBM269542

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(OC)cn1 |r,wU:3.3,2.1,(4.14,-3.92,;2.81,-3.15,;2.81,-1.61,;1.48,-.84,;1.48,.7,;.14,-1.61,;-.63,-2.94,;.91,-2.94,;-1.19,-.84,;-2.52,-1.61,;-3,-3.07,;-4.54,-3.07,;-5.02,-1.61,;-6.5,-1.21,;-7.59,-2.3,;-9.08,-1.9,;-9.48,-.41,;-8.39,.68,;-6.9,.28,;-3.77,-.7,;-3.77,.84,;-5.1,1.61,;-6.44,.84,;-7.77,1.61,;-5.1,3.15,;-3.77,3.92,;-2.44,3.15,;-2.44,1.61,;-1.1,.84,;.23,1.61,;4.14,-.84,;5.48,-1.61,;6.81,-.84,;6.81,.7,;8.15,1.47,;9.48,.7,;5.48,1.47,;4.14,.7,)|

BDBM269543

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1ccccc1)c1ncc(OC)cn1 |r|

BDBM269544

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(Br)c1)c1ncc(C)cn1 |r|

BDBM269545

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1C)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;-.68,1.61,;.65,.84,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269546

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(C)c1)c1ncc(C)cn1 |r|

BDBM269547

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(F)c(c1)C(F)(F)F)c1ncc(C)cn1 |r|

BDBM269548

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(OC)c1)c1ncc(C)cn1 |r|

BDBM269549

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(F)cc1)c1ncc(C)cn1 |r|

BDBM269550

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(Cl)c1)c1ncc(C)cn1 |r|

BDBM269551

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(F)cc1Cl)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-4.69,;4.57,-3.92,;4.57,-2.38,;3.23,-1.61,;3.23,-.07,;1.9,-2.38,;1.13,-3.71,;2.67,-3.71,;.57,-1.61,;-.77,-2.38,;-1.24,-3.84,;-2.78,-3.84,;-3.26,-2.38,;-4.75,-1.98,;-5.15,-.49,;-6.63,-.09,;-7.72,-1.18,;-7.32,-2.67,;-8.41,-3.76,;-9.9,-3.36,;-5.84,-3.07,;-2.01,-1.47,;-2.01,.07,;-3.35,.84,;-3.35,2.38,;-2.01,3.15,;-2.01,4.69,;-.68,2.38,;-.68,.84,;.65,.07,;5.9,-1.61,;7.23,-2.38,;8.57,-1.61,;8.57,-.07,;9.9,.7,;7.23,.7,;5.9,-.07,)|

BDBM269552

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cc(Cl)cc(Cl)c1)c1ncc(C)cn1 |r|

BDBM269553

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1Cl)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;-.68,1.61,;.65,.84,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269554

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(C)c1C)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;.65,3.92,;-.68,1.61,;.65,.84,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269555

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(F)c(F)c1)c1ncc(C)cn1 |r|

BDBM269556

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)C(C)=O)c1ncc(C)cn1 |r|

BDBM269557

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(Cl)cccc1Cl)c1ncc(C)cn1 |r,wU:3.3,2.1,(7.52,-1.62,;5.98,-1.62,;5.21,-.28,;3.67,-.28,;2.9,1.05,;2.9,-1.62,;2.13,-2.95,;4.24,-2.39,;1.57,-.85,;.24,-1.62,;.24,-3.16,;-1.23,-3.63,;-2.13,-2.39,;-3.67,-2.39,;-4.44,-1.05,;-5.98,-1.05,;-6.75,-2.39,;-5.98,-3.72,;-6.75,-5.05,;-8.29,-5.05,;-4.44,-3.72,;-1.23,-1.14,;-1.63,.35,;-.54,1.44,;.95,1.04,;-.94,2.92,;-2.42,3.32,;-3.51,2.23,;-3.11,.75,;-4.2,-.34,;5.98,1.05,;7.52,1.05,;8.29,2.39,;7.52,3.72,;8.29,5.05,;5.98,3.72,;5.21,2.39,)|

BDBM269558

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1C(F)(F)F)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;-.55,1.55,;.78,.78,;2.12,.02,;1.55,2.12,;.02,-.55,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269559

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)C(F)(F)F)c1ncc(C)cn1 |r|

BDBM269560

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccccc1F)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;-.68,1.61,;.65,.84,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269561

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(cc1)N(C)C)c1ncc(C)cn1 |r|

BDBM269562

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1ccccc1 |r|

BDBM269563

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:4.4,3.2,(5.16,-4.69,;5.16,-3.15,;3.82,-2.38,;3.82,-.84,;2.49,-.07,;2.49,1.47,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;-.18,-.07,;-1.51,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,)|

BDBM269564

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM269565

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wD:3.3,2.1,(3.11,-2.99,;1.58,-2.83,;.67,-4.08,;-.86,-3.92,;-1.76,-5.16,;-1.48,-2.51,;-2.89,-3.14,;-.08,-1.89,;-2.11,-1.1,;-1.2,.14,;.34,.14,;.81,1.61,;-.43,2.51,;-.43,4.05,;-1.77,4.82,;-1.77,6.36,;-.43,7.13,;.9,6.36,;2.23,7.13,;.9,4.82,;-1.68,1.61,;-3.14,2.08,;-4.29,1.05,;-3.97,-.46,;-5.11,-1.49,;-5.75,1.53,;-6.07,3.03,;-4.93,4.06,;-3.47,3.59,;-2.32,4.62,;-2.64,6.12,;1.3,-5.49,;2.83,-5.65,;3.46,-7.05,;2.55,-8.3,;3.18,-9.71,;1.02,-8.14,;.4,-6.73,)|

BDBM269566

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.93,-2.3,;-8.41,-1.9,;-8.81,-.41,;-7.72,.68,;-6.24,.28,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM269567

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wD:3.3,2.1,(3.42,-2.85,;1.89,-2.69,;.98,-3.93,;-.55,-3.77,;-1.46,-5.02,;-1.18,-2.36,;-2.58,-2.99,;.23,-1.74,;-1.8,-.96,;-.9,.29,;.64,.29,;1.12,1.75,;-.13,2.66,;-.13,4.2,;1.21,4.97,;1.21,6.51,;-.13,7.28,;-1.46,6.51,;-1.46,4.97,;-1.37,1.75,;-2.84,2.23,;-3.98,1.2,;-3.66,-.31,;-4.81,-1.34,;-5.45,1.67,;-5.77,3.18,;-4.62,4.21,;-3.16,3.74,;-2.01,4.77,;-2.33,6.27,;1.61,-5.34,;3.14,-5.5,;3.77,-6.91,;2.86,-8.15,;3.49,-9.56,;1.33,-7.99,;.7,-6.59,)|

BDBM269568

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM269569

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)C(=O)N2CCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-9.13,-2.31,;-7.64,-2.71,;-6.56,-1.62,;-6.95,-.13,;-5.87,.96,;-4.38,.56,;-3.98,-.93,;-5.07,-2.02,;-2.49,-1.33,;-2.02,-2.79,;-.48,-2.79,;,-1.33,;1.49,-.93,;2.58,-2.02,;1.49,-3.11,;2.98,-3.51,;4.06,-1.62,;4.46,-.13,;5.15,-2.71,;4.75,-4.2,;6.64,-2.31,;7.12,-.85,;8.66,-.85,;9.13,-2.31,;7.89,-3.22,;-1.25,-.42,;-1.25,1.12,;-2.58,1.89,;-3.91,1.12,;-5.25,1.89,;-2.58,3.43,;-1.25,4.2,;.09,3.43,;.09,1.89,;1.42,1.12,;2.76,1.89,)|

BDBM269570

COc1cc(ccn1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-9.9,-2.97,;-8.41,-3.37,;-7.32,-2.28,;-5.84,-2.68,;-4.75,-1.59,;-5.15,-.11,;-6.63,.29,;-7.72,-.8,;-3.26,-1.99,;-2.78,-3.46,;-1.24,-3.46,;-.77,-1.99,;.57,-1.22,;1.9,-1.99,;1.13,-3.33,;2.67,-3.33,;3.23,-1.22,;3.23,.32,;4.57,-1.99,;4.57,-3.53,;5.9,-1.22,;7.23,-1.99,;8.57,-1.22,;8.57,.32,;9.9,1.09,;7.23,1.09,;5.9,.32,;-2.01,-1.09,;-2.01,.45,;-3.35,1.22,;-4.68,.45,;-6.02,1.22,;-3.35,2.76,;-2.01,3.53,;-.68,2.76,;-.68,1.22,;.65,.45,;1.99,1.22,)|

BDBM269571

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccnc(C)c1 |r,wU:16.17,18.19,(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM269572

COc1cncc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-9.9,-2.97,;-8.41,-3.37,;-7.32,-2.28,;-7.72,-.8,;-6.63,.29,;-5.15,-.11,;-4.75,-1.59,;-5.84,-2.68,;-3.26,-1.99,;-2.78,-3.46,;-1.24,-3.46,;-.77,-1.99,;.57,-1.22,;1.9,-1.99,;1.13,-3.33,;2.67,-3.33,;3.23,-1.22,;3.23,.32,;4.57,-1.99,;4.57,-3.53,;5.9,-1.22,;7.23,-1.99,;8.57,-1.22,;8.57,.32,;9.9,1.09,;7.23,1.09,;5.9,.32,;-2.01,-1.09,;-2.01,.45,;-3.35,1.22,;-4.68,.45,;-6.02,1.22,;-3.35,2.76,;-2.01,3.53,;-.68,2.76,;-.68,1.22,;.65,.45,;1.99,1.22,)|

BDBM269573

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccc(C)n1 |r,wU:16.17,18.19,(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM269574

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(1.75,-6.11,;.85,-4.86,;-.69,-5.02,;-1.59,-3.78,;-3.12,-3.94,;-.96,-2.37,;-2.37,-1.74,;.44,-3,;-.34,-.96,;-1.24,.28,;-2.78,.28,;-3.26,1.75,;-2.01,2.65,;-2.01,4.19,;-3.35,4.96,;-3.35,6.5,;-2.01,7.27,;-.68,6.5,;.65,7.27,;-.68,4.96,;-.77,1.75,;.7,2.22,;1.84,1.19,;1.52,-.31,;2.67,-1.34,;3.31,1.67,;3.63,3.18,;2.48,4.21,;1.02,3.73,;-.13,4.76,;.19,6.27,;-1.31,-6.43,;-2.84,-6.59,;-3.47,-8,;-2.56,-9.24,;-3.19,-10.65,;-1.03,-9.08,;-.41,-7.68,)|

BDBM269575

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.75,-6.11,;.85,-4.86,;-.69,-5.02,;-1.59,-3.78,;-3.12,-3.94,;-.96,-2.37,;-2.37,-1.74,;.44,-3,;-.34,-.96,;-1.24,.28,;-2.78,.28,;-3.26,1.75,;-2.01,2.65,;-2.01,4.19,;-3.35,4.96,;-3.35,6.5,;-2.01,7.27,;-.68,6.5,;.65,7.27,;-.68,4.96,;-.77,1.75,;.7,2.22,;1.84,1.19,;1.52,-.31,;2.67,-1.34,;3.31,1.67,;3.63,3.18,;2.48,4.21,;1.02,3.73,;-.13,4.76,;.19,6.27,;-1.31,-6.43,;-2.84,-6.59,;-3.47,-8,;-2.56,-9.24,;-3.19,-10.65,;-1.03,-9.08,;-.41,-7.68,)|

BDBM269576

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(1.75,-6.11,;.85,-4.86,;-.69,-5.02,;-1.59,-3.78,;-3.12,-3.94,;-.96,-2.37,;-2.37,-1.74,;.44,-3,;-.34,-.96,;-1.24,.28,;-2.78,.28,;-3.26,1.75,;-2.01,2.65,;-2.01,4.19,;-3.35,4.96,;-3.35,6.5,;-2.01,7.27,;-.68,6.5,;.65,7.27,;-.68,4.96,;-.77,1.75,;.7,2.22,;1.84,1.19,;1.52,-.31,;2.67,-1.34,;3.31,1.67,;3.63,3.18,;2.48,4.21,;1.02,3.73,;-.13,4.76,;.19,6.27,;-1.31,-6.43,;-2.84,-6.59,;-3.47,-8,;-2.56,-9.24,;-3.19,-10.65,;-1.03,-9.08,;-.41,-7.68,)|

BDBM269577

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-6.76,2.38,;-5.43,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM269578

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-6.76,2.38,;-5.43,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM269579

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-6.76,2.38,;-5.43,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM269580

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-6.76,2.38,;-5.43,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM269581

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-10.64,-1.82,;-9.16,-2.22,;-8.07,-1.13,;-8.47,.36,;-7.38,1.45,;-5.89,1.05,;-5.49,-.44,;-6.58,-1.53,;-4,-.84,;-3.53,-2.3,;-1.99,-2.3,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,)|

BDBM269582

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-10.64,-1.82,;-9.16,-2.22,;-8.07,-1.13,;-8.47,.36,;-7.38,1.45,;-5.89,1.05,;-5.49,-.44,;-6.58,-1.53,;-4,-.84,;-3.53,-2.3,;-1.99,-2.3,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,)|

BDBM269583

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-10.64,-1.82,;-9.16,-2.22,;-8.07,-1.13,;-8.47,.36,;-7.38,1.45,;-5.89,1.05,;-5.49,-.44,;-6.58,-1.53,;-4,-.84,;-3.53,-2.3,;-1.99,-2.3,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,)|

BDBM269584

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-10.64,-1.82,;-9.16,-2.22,;-8.07,-1.13,;-8.47,.36,;-7.38,1.45,;-5.89,1.05,;-5.49,-.44,;-6.58,-1.53,;-4,-.84,;-3.53,-2.3,;-1.99,-2.3,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,)|

BDBM269585

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1cccc(C)n1 |r,wU:16.17,18.19,(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM269586

COc1cccc(n1)-c1nnc(NS(=O)(=O)C(C)C)n1-c1c(OC)cccc1OC |(-7.23,-3.01,;-5.75,-3.41,;-4.66,-2.32,;-5.06,-.83,;-3.97,.25,;-2.48,-.14,;-2.08,-1.63,;-3.17,-2.72,;-.59,-2.03,;-.12,-3.49,;1.42,-3.49,;1.9,-2.03,;3.23,-1.26,;4.57,-2.03,;3.8,-3.36,;5.34,-3.36,;5.9,-1.26,;7.23,-2.03,;5.9,.28,;.65,-1.13,;.65,.41,;-.68,1.18,;-2.01,.41,;-3.35,1.18,;-.68,2.72,;.65,3.49,;1.99,2.72,;1.99,1.18,;3.32,.41,;4.65,1.18,)|

BDBM269587

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccnc(OC)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.9,-3.92,;4.57,-3.15,;4.57,-1.61,;3.23,-.84,;3.23,.7,;1.9,-1.61,;1.13,-2.94,;2.67,-2.94,;.57,-.84,;-.77,-1.61,;-1.24,-3.07,;-2.78,-3.07,;-3.26,-1.61,;-4.75,-1.21,;-5.15,.28,;-6.63,.68,;-7.72,-.41,;-7.32,-1.9,;-8.41,-2.99,;-9.9,-2.59,;-5.84,-2.3,;-2.01,-.7,;-2.01,.84,;-3.35,1.61,;-4.68,.84,;-6.02,1.61,;-3.35,3.15,;-2.01,3.92,;-.68,3.15,;-.68,1.61,;.65,.84,;1.99,1.61,;5.9,-.84,;7.23,-1.61,;8.57,-.84,;8.57,.7,;9.9,1.47,;7.23,1.47,;5.9,.7,)|

BDBM269588

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccncc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM269589

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM269590

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccnc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM269591

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(OC)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.21,-3.92,;3.88,-3.15,;3.88,-1.61,;2.54,-.84,;2.54,.7,;1.21,-1.61,;.44,-2.94,;1.98,-2.94,;-.13,-.84,;-1.46,-1.61,;-1.93,-3.07,;-3.47,-3.07,;-3.95,-1.61,;-5.44,-1.21,;-6.53,-2.3,;-8.01,-1.9,;-8.41,-.41,;-7.32,.68,;-7.72,2.16,;-9.21,2.56,;-5.84,.28,;-2.7,-.7,;-2.7,.84,;-4.04,1.61,;-5.37,.84,;-6.71,1.61,;-4.04,3.15,;-2.7,3.92,;-1.37,3.15,;-1.37,1.61,;-.04,.84,;1.3,1.61,;5.21,-.84,;6.54,-1.61,;7.88,-.84,;7.88,.7,;9.21,1.47,;6.54,1.47,;5.21,.7,)|

BDBM269592

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:4.4,3.2,(4.86,-4.69,;4.86,-3.15,;3.53,-2.38,;3.53,-.84,;2.2,-.07,;2.2,1.47,;.86,-.84,;.09,-2.17,;1.63,-2.17,;-.47,-.07,;-1.81,-.84,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-8.86,-3.11,;-10.4,-3.11,;-6.55,-1.77,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,)|

BDBM269594

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:4.4,3.2,(4.86,-4.69,;4.86,-3.15,;3.53,-2.38,;3.53,-.84,;2.2,-.07,;2.2,1.47,;.86,-.84,;.09,-2.17,;1.63,-2.17,;-.47,-.07,;-1.81,-.84,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-6.55,-1.77,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,)|

BDBM269595

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(4.86,-4.69,;4.86,-3.15,;3.53,-2.38,;3.53,-.84,;2.2,-.07,;2.2,1.47,;.86,-.84,;.09,-2.17,;1.63,-2.17,;-.47,-.07,;-1.81,-.84,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-6.55,-1.77,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,)|

BDBM269596

CCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,wD:3.2,(4.86,-4.69,;4.86,-3.15,;3.53,-2.38,;3.53,-.84,;2.2,-.07,;2.2,1.47,;.86,-.84,;.09,-2.17,;1.63,-2.17,;-.47,-.07,;-1.81,-.84,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-8.86,-3.11,;-10.4,-3.11,;-6.55,-1.77,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,)|

BDBM269598

COc1cncc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-10.4,-3.11,;-8.86,-3.11,;-8.09,-1.77,;-8.86,-.44,;-8.09,.89,;-6.55,.89,;-5.78,-.44,;-6.55,-1.77,;-4.3,-.84,;-3.82,-2.3,;-2.28,-2.3,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,)|

BDBM269599

COc1cncc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,1.97,;-8.89,.64,;-8.12,-.7,;-8.89,-2.03,;-8.12,-3.36,;-6.58,-3.36,;-5.81,-2.03,;-6.58,-.7,;-4.27,-2.03,;-3.79,-3.49,;-2.25,-3.49,;-1.78,-2.03,;-.45,-1.26,;.89,-2.03,;.12,-3.36,;1.66,-3.36,;2.22,-1.26,;2.22,.28,;3.56,-2.03,;4.89,-1.26,;6.22,-2.03,;7.56,-1.26,;7.56,.28,;8.89,1.05,;6.22,1.05,;4.89,.28,;-3.02,-1.13,;-3.02,.41,;-4.36,1.18,;-5.69,.41,;-7.03,1.18,;-4.36,2.72,;-3.02,3.49,;-1.69,2.72,;-1.69,1.18,;-.36,.41,;.98,1.18,)|

BDBM269601

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,;.98,2.45,)|

BDBM269602

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269604

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccnc(C)c1 |r,wU:16.17,(.98,1.79,;-.36,1.02,;-1.69,1.79,;-1.69,3.33,;-3.02,4.1,;-4.36,3.33,;-4.36,1.79,;-5.69,1.02,;-7.03,1.79,;-3.02,1.02,;-3.02,-.52,;-1.78,-1.43,;-.45,-.66,;.89,-1.43,;.12,-2.76,;1.66,-2.76,;2.22,-.66,;2.22,.88,;3.56,-1.43,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,)|

BDBM269607

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wU:16.17,18.19,(1.27,2.13,;.18,1.04,;-1.31,1.44,;-1.71,2.92,;-3.19,3.32,;-4.28,2.23,;-3.88,.75,;-4.97,-.34,;-6.46,.06,;-2.4,.35,;-2,-1.14,;-.53,-1.62,;.8,-.85,;2.13,-1.62,;1.36,-2.95,;3.47,-2.39,;2.9,-.28,;2.13,1.05,;4.44,-.28,;5.21,-1.62,;5.21,1.05,;6.75,1.05,;7.52,2.39,;6.75,3.72,;7.52,5.05,;5.21,3.72,;4.44,2.39,;-.53,-3.16,;-2,-3.63,;-2.9,-2.39,;-4.44,-2.39,;-5.21,-1.05,;-6.75,-1.05,;-7.52,-2.39,;-6.75,-3.72,;-7.52,-5.05,;-5.21,-3.72,)|

BDBM269610

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.08,2.33,;-.25,1.55,;-1.59,2.32,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;-3.05,1.61,;-3.05,.07,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;3.53,-2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-8.86,-3.11,;-6.55,-1.77,)|

BDBM269611

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.27,1.46,;.18,.37,;-1.31,.77,;-1.71,2.26,;-3.19,2.66,;-4.28,1.57,;-3.88,.08,;-4.97,-1.01,;-6.46,-.61,;-2.4,-.32,;-2,-1.81,;-.53,-2.28,;.8,-1.51,;2.13,-2.28,;1.36,-3.62,;3.47,-3.05,;2.9,-.95,;2.13,.38,;4.44,-.95,;5.21,-2.28,;5.21,.39,;6.75,.38,;7.52,1.72,;6.75,3.05,;7.52,4.39,;5.21,3.05,;4.44,1.72,;-.53,-3.82,;-2,-4.3,;-2.9,-3.05,;-4.44,-3.05,;-5.21,-4.39,;-6.75,-4.39,;-7.52,-3.05,;-6.75,-1.72,;-7.52,-.39,;-5.21,-1.72,)|

BDBM269613

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-6.75,-5.72,;-7.52,-4.39,;-6.75,-3.05,;-7.52,-1.72,;-6.75,-.38,;-5.21,-.38,;-4.44,-1.72,;-5.21,-3.05,;-2.9,-1.72,;-2,-2.96,;-.53,-2.49,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.38,;2.13,1.72,;4.44,.38,;5.21,-.95,;5.21,1.72,;6.75,1.72,;7.52,3.05,;6.75,4.39,;7.52,5.72,;5.21,4.39,;4.44,3.05,;-2,-.47,;-2.4,1.01,;-1.31,2.1,;.18,1.71,;1.27,2.79,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,)|

BDBM269616

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-6.75,-5.72,;-7.52,-4.39,;-6.75,-3.05,;-7.52,-1.72,;-6.75,-.38,;-5.21,-.38,;-4.44,-1.72,;-5.21,-3.05,;-2.9,-1.72,;-2,-2.96,;-.53,-2.49,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.38,;2.13,1.72,;4.44,.38,;5.21,-.95,;5.21,1.72,;6.75,1.72,;7.52,3.05,;6.75,4.39,;7.52,5.72,;5.21,4.39,;4.44,3.05,;-2,-.47,;-2.4,1.01,;-1.31,2.1,;.18,1.71,;1.27,2.79,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,)|

BDBM269619

COc1cc(ccn1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-10.4,-3.11,;-8.86,-3.11,;-8.09,-1.77,;-6.55,-1.77,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-4.3,-.84,;-3.82,-2.3,;-2.28,-2.3,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,)|

BDBM269620

COc1cc(ccn1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-10.4,-3.11,;-8.86,-3.11,;-8.09,-1.77,;-6.55,-1.77,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-4.3,-.84,;-3.82,-2.3,;-2.28,-2.3,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,)|

BDBM269621

COc1cc(ccn1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,1.97,;-8.89,.64,;-8.12,-.7,;-6.58,-.7,;-5.81,-2.03,;-6.58,-3.36,;-8.12,-3.36,;-8.89,-2.03,;-4.27,-2.03,;-3.79,-3.49,;-2.25,-3.49,;-1.78,-2.03,;-.45,-1.26,;.89,-2.03,;.12,-3.36,;1.66,-3.36,;2.22,-1.26,;2.22,.28,;3.56,-2.03,;4.89,-1.26,;6.22,-2.03,;7.56,-1.26,;7.56,.28,;8.89,1.05,;6.22,1.05,;4.89,.28,;-3.02,-1.13,;-3.02,.41,;-1.69,1.18,;-.36,.41,;.98,1.18,;-1.69,2.72,;-3.02,3.49,;-4.36,2.72,;-4.36,1.18,;-5.69,.41,;-7.03,1.18,)|

BDBM269623

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(c1)C(F)(F)F |r,wU:16.17,(1.08,2.33,;-.25,1.55,;-1.59,2.32,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;-3.05,1.61,;-3.05,.07,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-6.55,-1.77,;-8.86,-3.11,;-10.4,-3.11,;-8.09,-4.44,;-7.32,-3.11,)|

BDBM269624

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(c1)C(F)(F)F |r,wD:16.17,(1.08,2.33,;-.25,1.55,;-1.59,2.32,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;-3.05,1.61,;-3.05,.07,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-6.55,-1.77,;-8.86,-3.11,;-10.4,-3.11,;-8.09,-4.44,;-7.32,-3.11,)|

BDBM269625

COc1cccnc1-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-6.58,-4.76,;-5.81,-3.43,;-6.58,-2.1,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269628

CCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-11.2,3.24,;-10.43,1.91,;-8.89,1.91,;-8.12,.57,;-8.89,-.76,;-8.12,-2.1,;-6.58,-2.1,;-5.81,-.76,;-6.58,.57,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269629

CCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.89,-5.43,;-8.12,-4.1,;-8.89,-2.76,;-8.12,-1.43,;-8.89,-.1,;-8.12,1.24,;-6.58,1.24,;-5.81,-.1,;-6.58,-1.43,;-4.27,-.1,;-3.79,-1.56,;-2.25,-1.56,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-3.02,.81,;-3.02,2.35,;-1.69,3.12,;-.36,2.35,;.98,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,)|

BDBM269630

COc1ccnc(c1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-10.43,2.57,;-8.89,2.57,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,;-5.81,-.1,;-6.58,1.24,;-4.27,-.1,;-3.79,-1.56,;-2.25,-1.56,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-3.02,.81,;-3.02,2.35,;-1.69,3.12,;-.36,2.35,;.98,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,)|

BDBM269631

COc1ccnc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-10.43,2.57,;-8.89,2.57,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,;-5.81,-.1,;-6.58,1.24,;-4.27,-.1,;-3.79,-1.56,;-2.25,-1.56,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-3.02,.81,;-3.02,2.35,;-1.69,3.12,;-.36,2.35,;.98,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,)|

BDBM269632

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cc(Br)ccn1 |r,wU:16.17,(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,2.57,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,)|

BDBM269633

CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)|

BDBM269636

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C#N |r,wU:16.17,(1.36,2.45,;.03,1.68,;-1.31,2.45,;-1.31,3.99,;-2.64,4.76,;-3.97,3.99,;-3.97,2.45,;-5.31,1.68,;-6.64,2.45,;-2.64,1.68,;-2.64,.14,;-1.39,-.76,;-.06,.01,;1.27,-.76,;.5,-2.1,;2.04,-2.1,;2.61,.01,;2.61,1.55,;3.94,-.76,;5.27,.01,;6.61,-.76,;7.94,.01,;7.94,1.55,;9.28,2.32,;6.61,2.32,;5.27,1.55,;-1.87,-2.23,;-3.41,-2.23,;-3.89,-.76,;-5.43,-.76,;-6.2,.57,;-7.74,.57,;-8.51,-.76,;-7.75,-2.19,;-6.2,-2.1,;-8.5,-3.54,;-9.25,-4.88,)|

BDBM269637

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C#N |r,wD:16.17,(1.36,2.45,;.03,1.68,;-1.31,2.45,;-1.31,3.99,;-2.64,4.76,;-3.97,3.99,;-3.97,2.45,;-5.31,1.68,;-6.64,2.45,;-2.64,1.68,;-2.64,.14,;-1.39,-.76,;-.06,.01,;1.27,-.76,;.5,-2.1,;2.04,-2.1,;2.61,.01,;2.61,1.55,;3.94,-.76,;5.27,.01,;6.61,-.76,;7.94,.01,;7.94,1.55,;9.28,2.32,;6.61,2.32,;5.27,1.55,;-1.87,-2.23,;-3.41,-2.23,;-3.89,-.76,;-5.43,-.76,;-6.2,.57,;-7.74,.57,;-8.51,-.76,;-7.75,-2.19,;-6.2,-2.1,;-8.5,-3.54,;-9.25,-4.88,)|

BDBM269639

COc1ccc(nc1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-10.84,-2.05,;-10.05,-.73,;-8.51,-.76,;-7.74,.57,;-6.2,.57,;-5.43,-.76,;-6.2,-2.1,;-7.75,-2.19,;-3.89,-.76,;-3.41,-2.23,;-1.87,-2.23,;-1.39,-.76,;-.06,.01,;1.27,-.76,;.5,-2.1,;2.04,-2.1,;2.61,.01,;2.61,1.55,;3.94,-.76,;5.27,.01,;6.61,-.76,;7.94,.01,;7.94,1.55,;9.28,2.32,;6.61,2.32,;5.27,1.55,;-2.64,.14,;-2.64,1.68,;-1.31,2.45,;.03,1.68,;1.36,2.45,;-1.31,3.99,;-2.64,4.76,;-3.97,3.99,;-3.97,2.45,;-5.31,1.68,;-6.64,2.45,)|

BDBM269640

COc1ccc(nc1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-10.43,-.7,;-9.66,-2.03,;-8.12,-2.03,;-7.35,-.7,;-5.81,-.7,;-5.04,-2.03,;-5.81,-3.36,;-7.35,-3.36,;-3.5,-2.03,;-3.02,-3.49,;-1.48,-3.49,;-1.01,-2.03,;.32,-1.26,;1.66,-2.03,;.89,-3.36,;2.43,-3.36,;2.99,-1.26,;2.99,.28,;4.33,-2.03,;5.66,-1.26,;6.99,-2.03,;8.33,-1.26,;8.33,.28,;9.66,1.05,;6.99,1.05,;5.66,.28,;-2.25,-1.13,;-2.25,.41,;-.92,1.18,;.41,.41,;1.75,1.18,;-.92,2.72,;-2.25,3.49,;-3.59,2.72,;-3.59,1.18,;-4.92,.41,;-6.26,1.18,)|

BDBM269641

COc1ccc(nc1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-10.43,-.7,;-9.66,-2.03,;-8.12,-2.03,;-7.35,-.7,;-5.81,-.7,;-5.04,-2.03,;-5.81,-3.36,;-7.35,-3.36,;-3.5,-2.03,;-3.02,-3.49,;-1.48,-3.49,;-1.01,-2.03,;.32,-1.26,;1.66,-2.03,;.89,-3.36,;2.43,-3.36,;2.99,-1.26,;2.99,.28,;4.33,-2.03,;5.66,-1.26,;6.99,-2.03,;8.33,-1.26,;8.33,.28,;9.66,1.05,;6.99,1.05,;5.66,.28,;-2.25,-1.13,;-2.25,.41,;-.92,1.18,;.41,.41,;1.75,1.18,;-.92,2.72,;-2.25,3.49,;-3.59,2.72,;-3.59,1.18,;-4.92,.41,;-6.26,1.18,)|

BDBM269642

CCc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269645

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C(=O)N1CCC1 |r,wU:16.17,(.98,2.45,;-.36,1.68,;-1.69,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,;-3.02,1.68,;-3.02,.14,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-2.25,-2.23,;-3.79,-2.23,;-4.27,-.76,;-5.81,-.76,;-6.58,.57,;-8.12,.57,;-8.89,-.76,;-8.12,-2.1,;-6.58,-2.1,;-8.89,-3.43,;-10.43,-3.43,;-8.12,-4.76,;-8.44,-6.27,;-7.19,-7.17,;-6.87,-5.67,)|

BDBM269646

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C(=O)N1CCC1 |r,wU:16.17,(1.75,3.4,;.41,2.63,;-.92,3.4,;-.92,4.94,;-2.25,5.71,;-3.59,4.94,;-3.59,3.4,;-4.92,2.63,;-6.26,3.4,;-2.25,2.63,;-2.25,1.09,;-1.01,.18,;.32,.95,;1.66,.18,;.89,-1.15,;2.43,-1.15,;2.99,.95,;2.99,2.49,;4.33,.18,;5.66,.95,;6.99,.18,;8.33,.95,;8.33,2.49,;9.66,3.26,;6.99,3.26,;5.66,2.49,;-1.48,-1.28,;-3.02,-1.28,;-3.5,.18,;-5.04,.18,;-5.81,1.51,;-7.35,1.51,;-8.12,.18,;-7.35,-1.15,;-5.81,-1.15,;-8.12,-2.49,;-9.66,-2.49,;-7.35,-3.82,;-7.75,-5.31,;-6.26,-5.71,;-5.86,-4.22,)|

BDBM269647

CCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,19.20,(-8.89,-5.43,;-8.12,-4.1,;-8.89,-2.76,;-8.12,-1.43,;-8.89,-.1,;-8.12,1.24,;-6.58,1.24,;-5.81,-.1,;-6.58,-1.43,;-4.27,-.1,;-3.79,-1.56,;-2.25,-1.56,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-3.02,.81,;-3.02,2.35,;-1.69,3.12,;-.36,2.35,;.98,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,)|

BDBM269648

CCc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269651

CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)|

BDBM269654

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(=O)[nH]1 |r,wU:16.17,18.19,(.98,1.79,;-.36,1.02,;-1.69,1.79,;-1.69,3.33,;-3.02,4.1,;-4.36,3.33,;-4.36,1.79,;-5.69,1.02,;-7.03,1.79,;-3.02,1.02,;-3.02,-.52,;-1.78,-1.43,;-.45,-.66,;.89,-1.43,;.12,-2.76,;1.66,-2.76,;2.22,-.66,;2.22,.88,;3.56,-1.43,;3.56,-2.97,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,)|

BDBM269655

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(OC(F)F)n1 |r,wU:16.17,(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-8.89,-2.76,;-8.12,-4.1,;-8.89,-5.43,;-6.58,-4.1,;-6.58,-1.43,)|

BDBM269658

CCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,19.20,(-8.89,-5.43,;-8.12,-4.1,;-8.89,-2.76,;-8.12,-1.43,;-8.89,-.1,;-8.12,1.24,;-6.58,1.24,;-5.81,-.1,;-6.58,-1.43,;-4.27,-.1,;-3.79,-1.56,;-2.25,-1.56,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;2.22,-2.41,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-3.02,.81,;-3.02,2.35,;-1.69,3.12,;-.36,2.35,;.98,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,)|

BDBM269659

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.22,-3.92,;3.56,-3.15,;3.56,-1.61,;2.22,-.84,;2.22,.7,;.89,-1.61,;.12,-2.94,;1.66,-2.94,;-.45,-.84,;-1.78,-1.61,;-2.25,-3.07,;-3.79,-3.07,;-4.27,-1.61,;-5.81,-1.61,;-6.58,-.27,;-8.12,-.27,;-8.89,-1.61,;-8.12,-2.94,;-6.58,-2.94,;-3.02,-.7,;-3.02,.84,;-1.69,1.61,;-.36,.84,;.98,1.61,;-1.69,3.15,;-3.02,3.92,;-4.36,3.15,;-4.36,1.61,;-5.69,.84,;-7.03,1.61,;4.89,-.84,;6.22,-1.61,;7.56,-.84,;7.56,.7,;8.89,1.47,;6.22,1.47,;4.89,.7,)|

BDBM269660

CCc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;2.22,-3.07,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269661

CCc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269662

CCc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269663

COc1cc(C)cc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,19.20,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-8.89,1.91,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269664

COc1cc(C)cc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,19.20,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-8.89,1.91,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM269665

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)cc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.22,-3.07,;3.56,-2.3,;3.56,-.76,;2.22,.01,;2.22,1.55,;.89,-.76,;.12,-2.1,;1.66,-2.1,;-.45,.01,;-1.78,-.76,;-2.25,-2.23,;-3.79,-2.23,;-4.27,-.76,;-5.81,-.76,;-6.58,.57,;-8.12,.57,;-8.89,1.91,;-8.89,-.76,;-8.12,-2.1,;-8.89,-3.43,;-8.12,-4.76,;-6.58,-2.1,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,)|

BDBM269666

CCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,19.20,(-8.89,-5.43,;-8.12,-4.1,;-8.89,-2.76,;-8.12,-1.43,;-8.89,-.1,;-8.12,1.24,;-6.58,1.24,;-5.81,-.1,;-6.58,-1.43,;-4.27,-.1,;-3.79,-1.56,;-2.25,-1.56,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-3.02,.81,;-3.02,2.35,;-1.69,3.12,;-.36,2.35,;.98,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,)|

BDBM269667

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(C)cc2C#N)nnc1-c1cncc(Cl)c1 |(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;3.56,-.1,;4.89,.67,;4.89,2.21,;6.22,2.98,;7.56,2.21,;8.89,2.98,;7.56,.67,;6.22,-.1,;6.22,-1.64,;6.22,-3.18,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-8.89,-2.76,;-6.58,-1.43,)|

BDBM269668

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,)|

BDBM269669

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wD:16.17,18.19,(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,)|

BDBM269670

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wU:16.17,wD:18.19,(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,)|

BDBM269671

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(OCC(F)(F)F)n1 |r,wU:16.17,18.19,(1.27,3.56,;.18,2.48,;-1.31,2.87,;-1.71,4.36,;-3.19,4.76,;-4.28,3.67,;-3.88,2.18,;-4.97,1.09,;-6.46,1.49,;-2.4,1.78,;-2,.3,;-.53,-.18,;.8,.59,;2.13,-.18,;1.36,-1.51,;3.47,-.95,;2.9,1.15,;2.13,2.49,;4.44,1.15,;5.21,-.18,;5.21,2.49,;6.75,2.49,;7.52,3.82,;6.75,5.16,;7.52,6.49,;5.21,5.16,;4.44,3.82,;-.53,-1.72,;-2,-2.19,;-2.9,-.95,;-4.44,-.95,;-5.21,.38,;-6.75,.38,;-7.52,-.95,;-6.75,-2.28,;-7.52,-3.62,;-9.06,-3.62,;-9.83,-4.95,;-10.6,-6.28,;-11.17,-4.18,;-8.5,-5.72,;-5.21,-2.28,)|

BDBM269672

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(OCCO)n1 |r,wU:16.17,18.19,(1.27,2.79,;.18,1.71,;-1.31,2.1,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,;-2.4,1.01,;-2,-.47,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.38,;2.13,1.72,;4.44,.38,;5.21,-.95,;5.21,1.72,;6.75,1.72,;7.52,3.05,;6.75,4.39,;7.52,5.72,;5.21,4.39,;4.44,3.05,;-.53,-2.49,;-2,-2.96,;-2.9,-1.72,;-4.44,-1.72,;-5.21,-.39,;-6.75,-.39,;-7.52,-1.72,;-6.75,-3.05,;-7.52,-4.39,;-6.75,-5.72,;-5.21,-5.72,;-4.44,-4.39,;-5.21,-3.05,)|

BDBM269673

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OCC(F)(F)F)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(4.83,3,;3.49,2.23,;3.49,.69,;2.16,-.08,;2.16,-1.62,;.83,.69,;.06,-.65,;1.6,2.02,;-.51,1.46,;-1.84,.69,;-1.84,-.85,;-3.3,-1.33,;-4.21,-.08,;-5.75,-.08,;-6.52,1.25,;-8.06,1.25,;-8.83,-.08,;-8.06,-1.42,;-8.83,-2.75,;-10.37,-2.75,;-11.14,-4.08,;-11.91,-5.42,;-12.47,-3.31,;-9.81,-4.85,;-6.52,-1.42,;-3.3,1.16,;-3.7,2.65,;-2.61,3.74,;-1.13,3.34,;-.04,4.43,;-3.01,5.23,;-4.5,5.62,;-5.59,4.54,;-5.19,3.05,;-6.28,1.96,;-7.77,2.36,;4.83,-.08,;6.16,.69,;7.5,-.08,;7.5,-1.62,;8.83,-2.39,;6.16,-2.39,;4.83,-1.62,)|

BDBM269674

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OCCO)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.58,-2.87,;3.25,-2.1,;3.25,-.56,;1.91,.21,;1.91,1.75,;.58,-.56,;-.19,-1.9,;1.35,-1.9,;-.75,.21,;-2.09,-.56,;-2.56,-2.03,;-4.1,-2.03,;-4.58,-.56,;-6.12,-.56,;-6.89,.77,;-8.43,.77,;-9.2,-.56,;-8.43,-1.9,;-9.2,-3.23,;-8.43,-4.56,;-6.94,-4.96,;-5.61,-4.19,;-6.89,-1.9,;-3.33,.34,;-3.33,1.88,;-2,2.65,;-.67,1.88,;.67,2.65,;-2,4.19,;-3.33,4.96,;-4.67,4.19,;-4.67,2.65,;-6,1.88,;-7.33,2.65,;4.74,-.16,;5.82,-1.25,;7.31,-.85,;7.71,.63,;9.2,1.03,;6.62,1.72,;5.13,1.32,)|

BDBM269675

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cccc(Cl)n2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.67,2.65,;-.67,1.88,;-2,2.65,;-2,4.19,;-3.33,4.96,;-4.67,4.19,;-4.67,2.65,;-6,1.88,;-7.33,2.65,;-3.33,1.88,;-3.33,.34,;-2.09,-.56,;-.75,.21,;.58,-.56,;-.19,-1.9,;1.35,-1.9,;1.91,.21,;1.91,1.75,;3.25,-.56,;3.25,-2.1,;4.74,-.16,;5.13,1.32,;6.62,1.72,;7.71,.63,;7.31,-.85,;8.4,-1.94,;5.82,-1.25,;-2.56,-2.03,;-4.1,-2.03,;-4.58,-.56,;-6.12,-.56,;-6.89,.77,;-8.43,.77,;-9.2,-.56,;-8.43,-1.9,;-6.89,-1.9,)|

BDBM269676

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2cccc(Cl)n2)nnc1-c1cccnc1 |r,wU:18.19,wD:16.17,(.67,2.65,;-.67,1.88,;-2,2.65,;-2,4.19,;-3.33,4.96,;-4.67,4.19,;-4.67,2.65,;-6,1.88,;-7.33,2.65,;-3.33,1.88,;-3.33,.34,;-2.09,-.56,;-.75,.21,;.58,-.56,;-.19,-1.9,;1.35,-1.9,;1.91,.21,;1.91,1.75,;3.25,-.56,;3.25,-2.1,;4.74,-.16,;5.13,1.32,;6.62,1.72,;7.71,.63,;7.31,-.85,;8.4,-1.94,;5.82,-1.25,;-2.56,-2.03,;-4.1,-2.03,;-4.58,-.56,;-6.12,-.56,;-6.89,.77,;-8.43,.77,;-9.2,-.56,;-8.43,-1.9,;-6.89,-1.9,)|

BDBM269677

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(OCC(C)(C)O)n1 |r,wU:16.17,18.19,(1.27,3.46,;.18,2.37,;-1.31,2.77,;-1.71,4.26,;-3.19,4.66,;-4.28,3.57,;-3.88,2.08,;-4.97,.99,;-6.46,1.39,;-2.4,1.68,;-2,.19,;-.53,-.28,;.8,.49,;2.13,-.28,;1.36,-1.62,;3.47,-1.05,;2.9,1.05,;2.13,2.39,;4.44,1.05,;5.21,-.28,;5.21,2.39,;4.44,3.72,;5.21,5.05,;6.75,5.05,;7.52,6.39,;7.52,3.72,;6.75,2.39,;-.53,-1.82,;-2,-2.3,;-2.9,-1.05,;-4.44,-1.05,;-5.21,.28,;-6.75,.28,;-7.52,-1.05,;-6.75,-2.39,;-7.52,-3.72,;-6.75,-5.05,;-5.21,-5.05,;-4.44,-3.72,;-4.44,-6.39,;-3.67,-5.05,;-5.21,-2.39,)|

BDBM269678

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OCC(C)(C)O)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(6.75,-.28,;5.21,-.28,;4.44,1.05,;2.9,1.05,;2.13,2.39,;2.13,-.28,;1.36,-1.62,;3.47,-1.05,;.8,.49,;-.53,-.28,;-.53,-1.82,;-2,-2.3,;-2.9,-1.05,;-4.44,-1.05,;-5.21,.28,;-6.75,.28,;-7.52,-1.05,;-6.75,-2.39,;-7.52,-3.72,;-6.75,-5.05,;-5.21,-5.05,;-4.44,-3.72,;-4.44,-6.39,;-3.67,-5.05,;-5.21,-2.39,;-2,.19,;-2.4,1.68,;-1.31,2.77,;.18,2.37,;1.27,3.46,;-1.71,4.26,;-3.19,4.66,;-4.28,3.57,;-3.88,2.08,;-4.97,.99,;-6.46,1.39,;5.21,2.39,;4.44,3.72,;5.21,5.05,;6.75,5.05,;7.52,6.39,;7.52,3.72,;6.75,2.39,)|

BDBM269679

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(OCC(O)(C(F)(F)F)C(F)(F)F)n1 |r,wD:16.17,18.19,(1.11,4.72,;.79,3.22,;1.94,2.19,;3.4,2.66,;4.54,1.63,;4.22,.13,;2.76,-.35,;2.44,-1.86,;3.58,-2.89,;1.62,.68,;.15,.21,;-.33,-1.26,;.58,-2.51,;-.05,-3.91,;-1.45,-3.29,;1.36,-4.54,;-.67,-5.32,;-2.2,-5.48,;.23,-6.56,;1.76,-6.4,;-.39,-7.97,;.51,-9.22,;-.12,-10.62,;-1.65,-10.79,;-2.27,-12.19,;-2.55,-9.54,;-1.93,-8.13,;-1.87,-1.26,;-2.34,.21,;-1.1,1.11,;-1.1,2.65,;.24,3.42,;.24,4.96,;-1.1,5.73,;-2.43,4.96,;-3.76,5.73,;-3.76,7.27,;-5.1,8.04,;-4.33,9.37,;-6.43,8.81,;-7.76,9.58,;-5.66,10.14,;-7.2,7.48,;-5.87,6.71,;-6.64,5.37,;-7.4,6.55,;-4.53,5.94,;-2.43,3.42,)|

BDBM269680

CNc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-6.75,-5.72,;-7.52,-4.39,;-6.75,-3.05,;-7.52,-1.72,;-6.75,-.39,;-5.21,-.38,;-4.44,-1.72,;-5.21,-3.05,;-2.9,-1.72,;-2,-2.96,;-.53,-2.49,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.39,;2.13,1.72,;4.44,.39,;5.21,-.95,;6.75,-.95,;5.21,1.72,;4.44,3.05,;5.21,4.39,;6.75,4.39,;7.52,5.72,;7.52,3.05,;6.75,1.72,;-2,-.47,;-2.4,1.01,;-1.31,2.1,;.18,1.71,;1.27,2.79,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,)|

BDBM269681

COCCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:19.20,21.22,(-2.9,-4.39,;-4.44,-4.39,;-5.21,-5.72,;-6.75,-5.72,;-7.52,-4.39,;-6.75,-3.05,;-7.52,-1.72,;-6.75,-.39,;-5.21,-.38,;-4.44,-1.72,;-5.21,-3.05,;-2.9,-1.72,;-2,-2.96,;-.53,-2.49,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.39,;2.13,1.72,;4.44,.39,;5.21,-.95,;6.75,-.95,;5.21,1.72,;4.44,3.05,;5.21,4.39,;6.75,4.39,;7.52,5.72,;7.52,3.05,;6.75,1.72,;-2,-.47,;-2.4,1.01,;-1.31,2.1,;.18,1.71,;1.27,2.79,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,)|

BDBM269682

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(n2)N(C)C)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(6.85,-3.21,;5.36,-2.82,;4.96,-1.33,;3.48,-.93,;3.08,.56,;2.39,-2.02,;1.3,-3.11,;3.48,-3.11,;1.3,-.93,;-.19,-1.33,;-.66,-2.79,;-2.2,-2.79,;-2.68,-1.33,;-4.17,-.93,;-4.57,.56,;-6.05,.96,;-7.14,-.13,;-6.74,-1.62,;-5.26,-2.02,;-7.83,-2.71,;-9.32,-2.31,;-7.43,-4.2,;-1.43,-.42,;-1.43,1.12,;-.1,1.89,;1.23,1.12,;2.57,1.89,;-.1,3.43,;-1.43,4.2,;-2.77,3.43,;-2.77,1.89,;-4.1,1.12,;-5.44,1.89,;6.05,-.24,;7.54,-.64,;8.63,.45,;8.23,1.94,;9.32,3.03,;6.74,2.34,;5.66,1.25,)|

BDBM269683

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.76,1.89,;-.57,1.12,;-1.91,1.89,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;-7.24,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.19,-3.35,;1.35,-3.35,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.04,-.82,;6.53,-.42,;7.62,-1.51,;9.11,-1.11,;7.22,-3,;5.73,-3.4,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,.01,;-8.34,.01,;-9.11,-1.33,;-8.34,-2.66,;-6.8,-2.66,)|

BDBM269684

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2cnc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(.76,1.89,;-.57,1.12,;-1.91,1.89,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;-7.24,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.19,-3.35,;1.35,-3.35,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.04,-.82,;6.53,-.42,;7.62,-1.51,;9.11,-1.11,;7.22,-3,;5.73,-3.4,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,-2.66,;-8.34,-2.66,;-9.11,-1.33,;-8.34,.01,;-9.11,1.34,;-6.8,.01,)|

BDBM269685

COc1cccc(n1)-c1nnc(NS(=O)(=O)CCc2ccc(F)cc2[N+]#[C-])n1-c1c(OC)cccc1OC |(-8.08,-4.76,;-8.85,-3.43,;-8.08,-2.1,;-8.85,-.76,;-8.08,.57,;-6.54,.57,;-5.77,-.76,;-6.54,-2.1,;-4.23,-.76,;-3.75,-2.23,;-2.21,-2.23,;-1.73,-.76,;-.25,-.36,;.84,-1.45,;.07,-2.79,;1.61,-2.79,;2.18,-.68,;3.51,-1.45,;4.84,-.68,;6.18,-1.45,;7.51,-.68,;7.51,.86,;8.85,1.63,;6.18,1.63,;4.73,.94,;3.4,1.71,;2.07,2.49,;-2.98,.14,;-2.98,1.68,;-1.65,2.45,;-.31,1.68,;1.02,2.45,;-1.65,3.99,;-2.98,4.76,;-4.31,3.99,;-4.31,2.45,;-5.65,1.68,;-6.98,2.45,)|

BDBM269686

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@@H](C)CCN(C)C2=O)nnc1-c1cncc(C)c1 |r,wD:19.20,(-4.14,2.99,;-3.05,1.9,;-1.57,2.3,;-1.17,3.79,;.32,4.19,;1.41,3.1,;1.01,1.61,;2.1,.52,;3.59,.92,;-.48,1.21,;-.88,-.27,;.03,-1.52,;1.57,-1.52,;2.34,-2.85,;3.11,-4.19,;1.01,-3.62,;3.67,-2.08,;3.67,-.54,;5.01,.23,;6.34,-.54,;6.34,-2.08,;7.67,.23,;7.67,1.77,;6.34,2.54,;6.34,4.08,;5.01,1.77,;3.67,2.54,;-.88,-2.77,;-2.34,-2.29,;-2.34,-.75,;-3.67,.02,;-3.67,1.56,;-5.01,2.33,;-6.34,1.56,;-6.34,.02,;-7.67,-.75,;-5.01,-.75,)|

BDBM269687

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccccn1 |r,wU:16.17,(1.27,1.46,;.18,.37,;-1.31,.77,;-1.71,2.26,;-3.19,2.66,;-4.28,1.57,;-3.88,.08,;-4.97,-1.01,;-6.46,-.61,;-2.4,-.32,;-2,-1.81,;-.53,-2.28,;.8,-1.51,;2.13,-2.28,;3.47,-3.05,;1.36,-3.62,;2.9,-.95,;2.13,.38,;4.44,-.95,;5.21,.38,;6.75,.38,;7.52,1.72,;6.75,3.05,;7.52,4.39,;5.21,3.05,;4.44,1.72,;-.53,-3.82,;-2,-4.3,;-2.9,-3.05,;-4.44,-3.05,;-5.21,-1.72,;-6.75,-1.72,;-7.52,-3.05,;-6.75,-4.39,;-5.21,-4.39,)|

BDBM269688

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.93,-2.3,;-8.41,-1.9,;-8.81,-.41,;-7.72,.68,;-8.12,2.16,;-6.24,.28,;-3.1,-.7,;-3.1,.84,;-1.77,1.61,;-.44,.84,;.9,1.61,;-1.77,3.15,;-3.1,3.92,;-4.44,3.15,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM269689

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.74,-4.79,;3.08,-4.02,;3.08,-2.48,;1.99,-1.39,;2.39,.1,;.5,-1.79,;-.59,-2.88,;.9,-3.28,;-.59,-.7,;-2.07,-1.1,;-2.55,-2.56,;-4.09,-2.56,;-4.57,-1.1,;-6.05,-.7,;-7.14,-1.79,;-8.63,-1.39,;-9.03,.1,;-7.94,1.19,;-8.34,2.67,;-6.45,.79,;-3.32,-.19,;-3.32,1.71,;-4.65,2.48,;-5.99,1.71,;-7.32,2.48,;-4.65,4.02,;-3.32,4.79,;-1.99,4.02,;-1.99,2.48,;-.65,1.71,;.68,2.48,;4.57,-2.08,;5.66,-3.17,;7.14,-2.77,;7.54,-1.28,;9.03,-.88,;6.45,-.19,;4.96,-.59,)|

BDBM269690

COc1cccc(n1)-c1nnc(NS(=O)(=O)CCc2ccc(F)cc2C#N)n1-c1c(OC)ncnc1OC |(-9.01,.02,;-7.67,-.75,;-6.34,.02,;-6.34,1.56,;-5.01,2.33,;-3.67,1.56,;-3.67,.02,;-5.01,-.75,;-2.34,-.75,;-2.34,-2.29,;-.88,-2.77,;.03,-1.52,;1.57,-1.52,;2.34,-2.85,;3.11,-4.19,;1.01,-3.62,;3.67,-2.08,;3.67,-.54,;5.01,.23,;5.01,1.77,;6.34,2.54,;7.67,1.77,;9.01,2.54,;7.67,.23,;6.38,-.65,;6.4,-2.19,;6.42,-3.73,;-.88,-.27,;-.48,1.21,;-1.57,2.3,;-3.05,1.9,;-4.14,2.99,;-1.17,3.79,;.32,4.19,;1.41,3.1,;1.01,1.61,;2.1,.52,;3.59,.92,)|

BDBM269691

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cccnc1 |r,wD:16.17,(-6.48,-6.09,;-5.15,-6.86,;-3.81,-6.09,;-3.81,-4.55,;-2.48,-3.78,;-1.15,-4.55,;-1.15,-6.09,;.19,-6.86,;1.52,-6.09,;-2.48,-6.86,;-2.48,-8.4,;-1.23,-9.3,;.1,-8.53,;1.43,-9.3,;2.77,-10.07,;.1,-10.07,;2.77,-8.53,;2.77,-6.99,;4.1,-9.3,;5.44,-8.53,;6.77,-9.3,;8.1,-8.53,;8.1,-6.99,;9.44,-6.22,;6.77,-6.22,;5.44,-6.99,;-1.71,-10.77,;-3.25,-10.77,;-3.72,-9.3,;-5.26,-9.3,;-6.03,-7.97,;-7.57,-7.97,;-8.34,-9.3,;-7.57,-10.64,;-6.03,-10.64,)|

BDBM269693

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cccnc1 |r,wD:16.17,(.85,-3.58,;-.49,-4.35,;-1.82,-3.58,;-1.82,-2.04,;-3.16,-1.27,;-4.49,-2.04,;-4.49,-3.58,;-5.82,-4.35,;-7.16,-3.58,;-3.16,-4.35,;-3.16,-5.89,;-1.91,-6.79,;-.58,-6.02,;.76,-6.79,;-.01,-8.13,;1.53,-8.13,;2.09,-6.02,;2.09,-4.48,;3.43,-6.79,;4.76,-6.02,;6.09,-6.79,;7.43,-6.02,;7.43,-4.48,;8.76,-3.71,;6.09,-3.71,;4.76,-4.48,;-2.39,-8.26,;-3.93,-8.26,;-4.4,-6.79,;-5.94,-6.79,;-6.71,-5.46,;-8.25,-5.46,;-9.02,-6.79,;-8.25,-8.13,;-6.71,-8.13,)|

BDBM269694

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,(-7.03,5.9,;-5.69,5.13,;-4.36,5.9,;-4.36,7.44,;-3.02,8.21,;-1.69,7.44,;-1.69,5.9,;-.36,5.13,;.98,5.9,;-3.02,5.13,;-3.02,3.59,;-1.78,2.68,;-.45,3.45,;.89,2.68,;.12,1.35,;1.66,1.35,;2.22,3.45,;2.22,4.99,;3.56,2.68,;4.89,3.45,;6.22,2.68,;7.56,3.45,;7.56,4.99,;8.89,5.76,;6.22,5.76,;4.89,4.99,;-2.25,1.22,;-3.79,1.22,;-4.27,2.68,;-5.81,2.68,;-6.58,1.35,;-8.12,1.35,;-8.89,2.68,;-8.12,4.02,;-8.89,5.35,;-6.58,4.02,)|

BDBM269697

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccnc1C |r,wU:16.17,(-7.03,6.96,;-5.69,6.19,;-4.36,6.96,;-4.36,8.5,;-3.02,9.27,;-1.69,8.5,;-1.69,6.96,;-.36,6.19,;.98,6.96,;-3.02,6.19,;-3.02,4.65,;-1.78,3.74,;-.45,4.51,;.89,3.74,;.12,2.41,;1.66,2.41,;2.22,4.51,;2.22,6.05,;3.56,3.74,;4.89,4.51,;6.22,3.74,;7.56,4.51,;7.56,6.05,;8.89,6.82,;6.22,6.82,;4.89,6.05,;-2.25,2.28,;-3.79,2.28,;-4.27,3.74,;-5.81,3.74,;-6.58,5.08,;-8.12,5.08,;-8.89,3.74,;-8.12,2.41,;-6.58,2.41,;-5.81,1.08,)|

BDBM269698

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccnc1C |r,wU:16.17,(-7.03,6.92,;-5.69,6.15,;-4.36,6.92,;-4.36,8.46,;-3.02,9.23,;-1.69,8.46,;-1.69,6.92,;-.36,6.15,;.98,6.92,;-3.02,6.15,;-3.02,4.61,;-1.78,3.7,;-.45,4.47,;.89,3.7,;.12,2.37,;1.66,2.37,;2.22,4.47,;2.22,6.01,;3.56,3.7,;4.89,4.47,;6.22,3.7,;7.56,4.47,;7.56,6.01,;8.89,6.78,;6.22,6.78,;4.89,6.01,;-2.25,2.24,;-3.79,2.24,;-4.27,3.7,;-5.81,3.7,;-6.58,5.04,;-8.12,5.04,;-8.89,3.7,;-8.12,2.37,;-6.58,2.37,;-5.81,1.04,)|

BDBM269699

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccc(C)nc1 |r,wU:16.17,(-6.26,5.9,;-4.92,5.13,;-3.59,5.9,;-3.59,7.44,;-2.25,8.21,;-.92,7.44,;-.92,5.9,;.41,5.13,;1.75,5.9,;-2.25,5.13,;-2.25,3.59,;-1.01,2.69,;.32,3.46,;1.66,2.69,;.89,1.35,;2.43,1.35,;2.99,3.46,;2.99,5,;4.33,2.69,;5.66,3.46,;6.99,2.69,;8.33,3.46,;8.33,5,;9.66,5.77,;6.99,5.77,;5.66,5,;-1.48,1.22,;-3.02,1.22,;-3.5,2.69,;-5.04,2.69,;-5.81,4.02,;-7.35,4.02,;-8.12,2.69,;-9.66,2.69,;-7.35,1.35,;-5.81,1.35,)|

BDBM269700

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccc(C)nc1 |r,wU:16.17,(-6.26,5.7,;-4.92,4.93,;-3.59,5.7,;-3.59,7.24,;-2.25,8.01,;-.92,7.24,;-.92,5.7,;.41,4.93,;1.75,5.7,;-2.25,4.93,;-2.25,3.39,;-1.01,2.49,;.32,3.26,;1.66,2.49,;.89,1.15,;2.43,1.15,;2.99,3.26,;2.99,4.8,;4.33,2.49,;5.66,3.26,;6.99,2.49,;8.33,3.26,;8.33,4.8,;9.66,5.57,;6.99,5.57,;5.66,4.8,;-1.48,1.02,;-3.02,1.02,;-3.5,2.49,;-5.04,2.49,;-5.81,3.82,;-7.35,3.82,;-8.12,2.49,;-9.66,2.49,;-7.35,1.15,;-5.81,1.15,)|

BDBM269701

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cnccc1C |r,wU:16.17,(-7.03,6.86,;-5.69,6.09,;-4.36,6.86,;-4.36,8.4,;-3.02,9.17,;-1.69,8.4,;-1.69,6.86,;-.36,6.09,;.98,6.86,;-3.02,6.09,;-3.02,4.55,;-1.78,3.65,;-.45,4.42,;.89,3.65,;.12,2.32,;1.66,2.32,;2.22,4.42,;2.22,5.96,;3.56,3.65,;4.89,4.42,;6.22,3.65,;7.56,4.42,;7.56,5.96,;8.89,6.73,;6.22,6.73,;4.89,5.96,;-2.25,2.19,;-3.79,2.19,;-4.27,3.65,;-5.81,3.65,;-6.58,4.98,;-8.12,4.98,;-8.89,3.65,;-8.12,2.32,;-6.58,2.32,;-5.81,.98,)|

BDBM269702

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cnccc1C |r,wU:16.17,(-7.03,6.86,;-5.69,6.09,;-4.36,6.86,;-4.36,8.4,;-3.02,9.17,;-1.69,8.4,;-1.69,6.86,;-.36,6.09,;.98,6.86,;-3.02,6.09,;-3.02,4.55,;-1.78,3.65,;-.45,4.42,;.76,3.65,;.12,2.32,;1.66,2.32,;2.22,4.42,;2.22,5.96,;3.56,3.65,;4.89,4.42,;6.22,3.65,;7.56,4.42,;7.56,5.96,;8.89,6.73,;6.22,6.73,;4.89,5.96,;-2.25,2.19,;-3.79,2.19,;-4.27,3.65,;-5.81,3.65,;-6.58,4.98,;-8.12,4.98,;-8.89,3.65,;-8.12,2.32,;-6.58,2.32,;-5.81,.98,)|

BDBM269704

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(Cl)c1 |r,wU:16.17,(-7.03,5.9,;-5.69,5.13,;-4.36,5.9,;-4.36,7.44,;-3.02,8.21,;-1.69,7.44,;-1.69,5.9,;-.36,5.13,;.98,5.9,;-3.02,5.13,;-3.02,3.59,;-1.78,2.68,;-.45,3.45,;.89,2.68,;.12,1.35,;1.66,1.35,;2.22,3.45,;2.22,4.99,;3.56,2.68,;4.89,3.45,;6.22,2.68,;7.56,3.45,;7.56,4.99,;8.89,5.76,;6.22,5.76,;4.89,4.99,;-2.25,1.22,;-3.79,1.22,;-4.27,2.68,;-5.81,2.68,;-6.58,1.35,;-8.12,1.35,;-8.89,2.68,;-8.12,4.02,;-8.89,5.35,;-6.58,4.02,)|

BDBM269708

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)ccn1 |r,wU:16.17,(-7.03,5.9,;-5.69,5.13,;-4.36,5.9,;-4.36,7.44,;-3.02,8.21,;-1.69,7.44,;-1.69,5.9,;-.36,5.13,;.98,5.9,;-3.02,5.13,;-3.02,3.59,;-1.78,2.68,;-.45,3.45,;.89,2.68,;.12,1.35,;1.66,1.35,;2.22,3.45,;2.22,4.99,;3.56,2.68,;4.89,3.45,;6.22,2.68,;7.56,3.45,;7.56,4.99,;8.89,5.76,;6.22,5.76,;4.89,4.99,;-2.25,1.22,;-3.79,1.22,;-4.27,2.68,;-5.81,2.68,;-6.58,4.02,;-8.12,4.02,;-8.89,5.35,;-8.89,2.68,;-8.12,1.35,;-6.58,1.35,)|

BDBM269710

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(F)c1 |r,wU:16.17,(-7.03,5.9,;-5.69,5.13,;-4.36,5.9,;-4.36,7.44,;-3.02,8.21,;-1.69,7.44,;-1.69,5.9,;-.36,5.13,;.98,5.9,;-3.02,5.13,;-3.02,3.59,;-1.78,2.68,;-.45,3.45,;.89,2.68,;.12,1.35,;1.66,1.35,;2.22,3.45,;2.22,4.99,;3.56,2.68,;4.89,3.45,;6.22,2.68,;7.56,3.45,;7.56,4.99,;8.89,5.76,;6.22,5.76,;4.89,4.99,;-2.25,1.22,;-3.79,1.22,;-4.27,2.68,;-5.81,2.68,;-6.58,1.35,;-8.12,1.35,;-8.89,2.68,;-8.12,4.02,;-8.89,5.35,;-6.58,4.02,)|

BDBM269713

CCNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:19.20,(-5.04,2.44,;-5.81,1.1,;-7.35,1.1,;-8.12,2.44,;-9.66,2.44,;-7.35,3.77,;-8.12,5.1,;-7.35,6.44,;-5.81,6.44,;-5.04,5.1,;-5.81,3.77,;-3.5,5.1,;-3.02,3.64,;-1.48,3.64,;-1.01,5.1,;.32,5.87,;1.66,5.1,;.89,3.77,;2.43,3.77,;2.99,5.87,;2.99,7.41,;4.33,5.1,;5.66,5.87,;6.99,5.1,;8.33,5.87,;8.33,7.41,;9.66,8.18,;6.99,8.18,;5.66,7.41,;-2.25,6.01,;-2.25,7.55,;-3.59,8.32,;-4.92,7.55,;-6.26,8.32,;-3.59,9.86,;-2.25,10.63,;-.92,9.86,;-.92,8.32,;.41,7.55,;1.75,8.32,)|

BDBM269716

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C(=O)N(C)C |r,wU:16.17,(-6.26,9.32,;-4.92,8.55,;-3.59,9.32,;-3.59,10.86,;-2.25,11.63,;-.92,10.86,;-.92,9.32,;.41,8.55,;1.75,9.32,;-2.25,8.55,;-2.25,7.01,;-1.01,6.1,;.32,6.87,;1.66,6.1,;.89,4.77,;2.43,4.77,;2.99,6.87,;2.99,8.41,;4.33,6.1,;5.66,6.87,;6.99,6.1,;8.33,6.87,;8.33,8.41,;9.66,9.18,;6.99,9.18,;5.66,8.41,;-1.48,4.64,;-3.02,4.64,;-3.5,6.1,;-5.04,6.1,;-5.81,7.44,;-7.35,7.44,;-8.12,6.1,;-7.35,4.77,;-5.81,4.77,;-8.12,3.44,;-9.66,3.44,;-7.35,2.1,;-5.81,2.1,;-8.12,.77,)|

BDBM269717

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C(=O)N(C)C |r,wU:16.17,(-6.26,9.27,;-4.92,8.5,;-3.59,9.27,;-3.59,10.81,;-2.25,11.58,;-.92,10.81,;-.92,9.27,;.41,8.5,;1.75,9.27,;-2.25,8.5,;-2.25,6.96,;-1.01,6.05,;.32,6.82,;1.66,6.05,;.89,4.72,;2.43,4.72,;2.99,6.82,;2.99,8.36,;4.33,6.05,;5.66,6.82,;6.99,6.05,;8.33,6.82,;8.33,8.36,;9.66,9.13,;6.99,9.13,;5.66,8.36,;-1.48,4.59,;-3.02,4.59,;-3.5,6.05,;-5.04,6.05,;-5.81,7.39,;-7.35,7.39,;-8.12,6.05,;-7.35,4.72,;-5.81,4.72,;-8.12,3.39,;-9.66,3.39,;-7.35,2.05,;-5.81,2.05,;-8.12,.72,)|

BDBM269718

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C(=O)N(C)C |r,wU:16.17,(-6.26,9.25,;-4.92,8.48,;-3.59,9.25,;-3.59,10.79,;-2.25,11.56,;-.92,10.79,;-.92,9.25,;.41,8.48,;1.75,9.25,;-2.25,8.48,;-2.25,6.94,;-1.01,6.03,;.32,6.8,;1.66,6.03,;.89,4.7,;2.43,4.7,;2.99,6.8,;2.99,8.34,;4.33,6.03,;5.66,6.8,;6.99,6.03,;8.33,6.8,;8.33,8.34,;9.66,9.11,;6.99,9.11,;5.66,8.34,;-1.48,4.57,;-3.02,4.57,;-3.5,6.03,;-5.04,6.03,;-5.81,7.36,;-7.35,7.36,;-8.12,6.03,;-7.35,4.7,;-5.81,4.7,;-8.12,3.36,;-9.66,3.36,;-7.35,2.03,;-5.81,2.03,;-8.12,.7,)|

BDBM269719

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(.82,-12.76,;-.51,-13.53,;-1.85,-12.76,;-1.85,-11.22,;-3.18,-10.45,;-4.52,-11.22,;-4.52,-12.76,;-5.85,-13.53,;-7.18,-12.76,;-3.18,-13.53,;-3.18,-15.07,;-1.94,-15.98,;-.6,-15.21,;.73,-15.98,;-.04,-17.31,;1.5,-17.31,;2.06,-15.21,;2.06,-13.67,;3.4,-15.98,;3.4,-17.52,;4.73,-15.21,;6.07,-15.98,;7.4,-15.21,;7.4,-13.67,;8.73,-12.9,;6.07,-12.9,;4.73,-13.67,;-2.41,-17.44,;-3.95,-17.44,;-4.43,-15.98,;-5.97,-15.98,;-6.74,-17.31,;-8.28,-17.31,;-9.05,-15.98,;-8.28,-14.65,;-9.05,-13.31,;-6.74,-14.65,)|

BDBM269720

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(.85,-12.76,;-.49,-13.53,;-1.82,-12.76,;-1.82,-11.22,;-3.16,-10.45,;-4.49,-11.22,;-4.49,-12.76,;-5.82,-13.53,;-7.16,-12.76,;-3.16,-13.53,;-3.16,-15.07,;-1.91,-15.98,;-.58,-15.21,;.76,-15.98,;-.01,-17.31,;1.53,-17.31,;2.09,-15.21,;2.09,-13.67,;3.43,-15.98,;3.43,-17.52,;4.76,-15.21,;6.09,-15.98,;7.43,-15.21,;7.43,-13.67,;8.76,-12.9,;6.09,-12.9,;4.76,-13.67,;-2.39,-17.44,;-3.93,-17.44,;-4.4,-15.98,;-5.94,-15.98,;-6.71,-17.31,;-8.25,-17.31,;-9.02,-15.98,;-8.25,-14.65,;-9.02,-13.31,;-6.71,-14.65,)|

BDBM269723

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(.85,-12.76,;-.49,-13.53,;-1.82,-12.76,;-1.82,-11.22,;-3.16,-10.45,;-4.49,-11.22,;-4.49,-12.76,;-5.82,-13.53,;-7.16,-12.76,;-3.16,-13.53,;-3.16,-15.07,;-1.91,-15.98,;-.58,-15.21,;.76,-15.98,;-.01,-17.31,;1.53,-17.31,;2.09,-15.21,;2.09,-13.67,;3.43,-15.98,;3.43,-17.52,;4.76,-15.21,;6.09,-15.98,;7.43,-15.21,;7.43,-13.67,;8.76,-12.9,;6.09,-12.9,;4.76,-13.67,;-2.39,-17.44,;-3.93,-17.44,;-4.4,-15.98,;-5.94,-15.98,;-6.71,-17.31,;-8.25,-17.31,;-9.02,-15.98,;-8.25,-14.65,;-9.02,-13.31,;-6.71,-14.65,)|

BDBM269724

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(3.26,-3.14,;1.72,-2.98,;.82,-4.22,;-.71,-4.06,;-1.62,-5.31,;-1.34,-2.66,;-2.75,-3.28,;.07,-2.03,;-1.97,-1.25,;-1.06,-0,;.48,-0,;.96,1.46,;-.29,2.37,;-.29,3.91,;1.04,4.68,;1.04,6.22,;-.29,6.99,;-1.62,6.22,;-2.96,6.99,;-4.29,6.22,;-1.62,4.68,;-1.54,1.46,;-3,1.94,;-4.15,.91,;-3.82,-.6,;-4.97,-1.63,;-5.61,1.38,;-5.93,2.89,;-4.79,3.92,;-3.32,3.44,;-2.18,4.47,;-2.5,5.98,;1.45,-5.63,;2.98,-5.79,;3.6,-7.2,;2.7,-8.44,;3.32,-9.85,;1.17,-8.28,;.54,-6.88,)|

BDBM269725

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wD:3.3,2.1,(3.26,-3.14,;1.72,-2.98,;.82,-4.22,;-.71,-4.06,;-1.62,-5.31,;-1.34,-2.66,;-2.75,-3.28,;.07,-2.03,;-1.97,-1.25,;-1.06,-0,;.48,-0,;.96,1.46,;-.29,2.37,;-.29,3.91,;1.04,4.68,;1.04,6.22,;-.29,6.99,;-1.62,6.22,;-2.96,6.99,;-4.29,6.22,;-1.62,4.68,;-1.54,1.46,;-3,1.94,;-4.15,.91,;-3.82,-.6,;-4.97,-1.63,;-5.61,1.38,;-5.93,2.89,;-4.79,3.92,;-3.32,3.44,;-2.18,4.47,;-2.5,5.98,;1.45,-5.63,;2.98,-5.79,;3.6,-7.2,;2.7,-8.44,;3.32,-9.85,;1.17,-8.28,;.54,-6.88,)|

BDBM269728

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(3.26,-3.14,;1.72,-2.98,;.82,-4.22,;-.71,-4.06,;-1.62,-5.31,;-1.34,-2.66,;-2.75,-3.28,;.07,-2.03,;-1.97,-1.25,;-1.06,-0,;.48,-0,;.96,1.46,;-.29,2.37,;-.29,3.91,;1.04,4.68,;1.04,6.22,;-.29,6.99,;-1.62,6.22,;-2.96,6.99,;-1.62,4.68,;-1.54,1.46,;-3,1.94,;-4.15,.91,;-3.82,-.6,;-4.97,-1.63,;-5.61,1.38,;-5.93,2.89,;-4.79,3.92,;-3.32,3.44,;-2.18,4.47,;-2.5,5.98,;1.45,-5.63,;2.98,-5.79,;3.6,-7.2,;2.7,-8.44,;3.32,-9.85,;1.17,-8.28,;.54,-6.88,)|

BDBM269729

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wD:3.3,2.1,(3.26,-3.14,;1.72,-2.98,;.82,-4.22,;-.71,-4.06,;-1.62,-5.31,;-1.34,-2.66,;-2.75,-3.28,;.07,-2.03,;-1.97,-1.25,;-1.06,-0,;.48,-0,;.96,1.46,;-.29,2.37,;-.29,3.91,;1.04,4.68,;1.04,6.22,;-.29,6.99,;-1.62,6.22,;-2.96,6.99,;-1.62,4.68,;-1.54,1.46,;-3,1.94,;-4.15,.91,;-3.82,-.6,;-4.97,-1.63,;-5.61,1.38,;-5.93,2.89,;-4.79,3.92,;-3.32,3.44,;-2.18,4.47,;-2.5,5.98,;1.45,-5.63,;2.98,-5.79,;3.6,-7.2,;2.7,-8.44,;3.32,-9.85,;1.17,-8.28,;.54,-6.88,)|

BDBM269730

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(cc2)C#N)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-7.69,5.81,;-6.36,5.04,;-5.03,5.81,;-5.03,7.35,;-3.69,8.12,;-2.36,7.35,;-2.36,5.81,;-1.02,5.04,;.31,5.81,;-3.69,5.04,;-3.69,3.5,;-2.45,2.6,;-1.11,3.37,;.22,2.6,;-.55,1.26,;.99,1.26,;1.56,3.37,;1.56,4.91,;2.89,2.6,;2.89,1.06,;4.22,3.37,;5.56,2.6,;6.89,3.37,;6.94,4.94,;5.56,5.68,;4.22,4.91,;8.27,5.71,;9.6,6.48,;-2.92,1.13,;-4.46,1.13,;-4.94,2.6,;-6.48,2.6,;-7.25,1.26,;-8.79,1.26,;-9.56,2.6,;-8.79,3.93,;-9.56,5.27,;-7.25,3.93,)|

BDBM269731

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(cc2)C#N)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-7.69,5.92,;-6.36,5.15,;-5.03,5.92,;-5.03,7.46,;-3.69,8.23,;-2.36,7.46,;-2.36,5.92,;-1.02,5.15,;.31,5.92,;-3.69,5.15,;-3.69,3.61,;-2.45,2.71,;-1.11,3.48,;.22,2.71,;-.55,1.37,;.99,1.37,;1.56,3.48,;1.56,5.02,;2.89,2.71,;2.89,1.17,;4.22,3.48,;5.56,2.71,;6.89,3.48,;6.94,5.04,;5.56,5.79,;4.22,5.02,;8.27,5.82,;9.6,6.59,;-2.92,1.24,;-4.46,1.24,;-4.94,2.71,;-6.48,2.71,;-7.25,1.37,;-8.79,1.37,;-9.56,2.71,;-8.79,4.04,;-9.56,5.37,;-7.25,4.04,)|

BDBM269733

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncccn1 |r,wU:3.3,2.1,(5.48,-3.92,;4.14,-3.15,;4.14,-1.61,;2.81,-.84,;2.81,.7,;1.48,-1.61,;.71,-2.94,;2.25,-2.94,;.14,-.84,;-1.19,-1.61,;-1.67,-3.07,;-3.21,-3.07,;-3.68,-1.61,;-5.17,-1.21,;-6.26,-2.3,;-7.75,-1.9,;-8.15,-.41,;-7.06,.68,;-7.45,2.16,;-5.57,.28,;-2.44,-.7,;-2.44,.84,;-3.77,1.61,;-5.1,.84,;-6.44,1.61,;-3.77,3.15,;-2.44,3.92,;-1.1,3.15,;-1.1,1.61,;.23,.84,;1.56,1.61,;5.48,-.84,;6.81,-1.61,;8.15,-.84,;8.15,.7,;6.81,1.47,;5.48,.7,)|

BDBM269734

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:4.4,3.2,(4.79,-4.69,;4.79,-3.15,;3.45,-2.38,;3.45,-.84,;2.12,-.07,;2.12,1.47,;.79,-.84,;.02,-2.17,;1.56,-2.17,;-.55,-.07,;-1.88,-.84,;-2.36,-2.3,;-3.9,-2.3,;-4.37,-.84,;-5.71,-.07,;-6.48,-1.4,;-8.02,-1.4,;-8.79,-.07,;-8.02,1.27,;-8.79,2.6,;-6.48,1.27,;-3.13,.07,;-3.13,1.61,;-1.72,2.29,;-.4,1.51,;.95,2.26,;-1.79,3.92,;-3.13,4.69,;-4.46,3.92,;-4.46,2.38,;-5.8,1.61,;-7.13,2.38,;4.79,-.07,;6.12,-.84,;7.45,-.07,;7.45,1.47,;8.79,2.24,;6.12,2.24,;4.79,1.47,)|

BDBM269735

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(4.79,-4.69,;4.79,-3.15,;3.45,-2.38,;3.45,-.84,;2.12,-.07,;2.12,1.47,;.79,-.84,;.02,-2.17,;1.56,-2.17,;-.55,-.07,;-1.88,-.84,;-2.36,-2.3,;-3.9,-2.3,;-4.37,-.84,;-5.71,-.07,;-6.48,-1.4,;-8.02,-1.4,;-8.79,-.07,;-8.02,1.27,;-8.79,2.6,;-6.48,1.27,;-3.13,.07,;-3.13,1.61,;-1.72,2.29,;-.4,1.51,;.95,2.26,;-1.79,3.92,;-3.13,4.69,;-4.46,3.92,;-4.46,2.38,;-5.8,1.61,;-7.13,2.38,;4.79,-.07,;6.12,-.84,;7.45,-.07,;7.45,1.47,;8.79,2.24,;6.12,2.24,;4.79,1.47,)|

BDBM269736

CCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,wD:3.2,(4.79,-4.69,;4.79,-3.15,;3.45,-2.38,;3.45,-.84,;2.12,-.07,;2.12,1.47,;.79,-.84,;.02,-2.17,;1.56,-2.17,;-.55,-.07,;-1.88,-.84,;-2.36,-2.3,;-3.9,-2.3,;-4.37,-.84,;-5.71,-.07,;-6.48,-1.4,;-8.02,-1.4,;-8.79,-.07,;-8.02,1.27,;-8.79,2.6,;-6.48,1.27,;-3.13,.07,;-3.13,1.61,;-1.75,2.35,;-.41,1.58,;.92,2.35,;-1.79,3.92,;-3.13,4.69,;-4.46,3.92,;-4.46,2.38,;-5.65,1.72,;-6.97,2.51,;4.79,-.07,;6.12,-.84,;7.45,-.07,;7.45,1.47,;8.79,2.24,;6.12,2.24,;4.79,1.47,)|

BDBM269737

CCO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.2,wD:4.4,(4.79,-4.69,;4.79,-3.15,;3.45,-2.38,;3.45,-.84,;2.12,-.07,;2.12,1.47,;.79,-.84,;.02,-2.17,;1.56,-2.17,;-.55,-.07,;-1.88,-.84,;-2.36,-2.3,;-3.9,-2.3,;-4.37,-.84,;-5.71,-.07,;-6.48,-1.4,;-8.02,-1.4,;-8.79,-.07,;-8.02,1.27,;-8.79,2.6,;-6.48,1.27,;-3.13,.07,;-3.13,1.61,;-1.75,2.35,;-.41,1.58,;.92,2.35,;-1.79,3.92,;-3.13,4.69,;-4.46,3.92,;-4.46,2.38,;-5.65,1.72,;-6.97,2.51,;4.79,-.07,;6.12,-.84,;7.45,-.07,;7.45,1.47,;8.79,2.24,;6.12,2.24,;4.79,1.47,)|

BDBM269738

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2cn3ccccc3n2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-10.26,2.4,;-8.77,2,;-7.68,3.09,;-8.08,4.58,;-6.99,5.67,;-5.5,5.27,;-5.1,3.78,;-6.19,2.7,;-3.62,3.39,;-3.14,1.92,;-1.6,1.92,;-1.12,3.39,;.21,4.16,;1.54,3.39,;.77,2.05,;2.31,2.05,;2.88,4.16,;2.88,5.7,;4.21,3.39,;4.21,1.85,;5.54,4.16,;5.71,5.69,;7.21,6.01,;7.98,7.34,;9.52,7.34,;10.29,6.01,;9.52,4.67,;7.98,4.67,;6.95,3.53,;-2.37,4.29,;-2.37,5.83,;-3.7,6.6,;-5.04,5.83,;-6.37,6.6,;-3.7,8.14,;-2.37,8.91,;-1.04,8.14,;-1.04,6.6,;.3,5.83,;1.63,6.6,)|

BDBM269739

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2cn3ccccc3n2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-10.29,-8.35,;-8.8,-8.75,;-7.72,-7.66,;-8.11,-6.17,;-7.03,-5.09,;-5.54,-5.48,;-5.14,-6.97,;-6.23,-8.06,;-3.65,-7.37,;-3.18,-8.84,;-1.64,-8.84,;-1.16,-7.37,;.17,-6.6,;1.51,-7.37,;.74,-8.7,;2.28,-8.7,;2.84,-6.6,;2.84,-5.06,;4.17,-7.37,;4.17,-8.91,;5.51,-6.6,;5.67,-5.07,;7.18,-4.75,;7.95,-3.42,;9.49,-3.42,;10.26,-4.75,;9.49,-6.08,;7.95,-6.08,;6.92,-7.23,;-2.41,-6.47,;-2.41,-4.93,;-3.74,-4.16,;-5.07,-4.93,;-6.41,-4.16,;-3.74,-2.62,;-2.41,-1.85,;-1.07,-2.62,;-1.07,-4.16,;.26,-4.93,;1.6,-4.16,)|

BDBM269740

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2cn(C)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.22,1.18,;-8.62,2.67,;-7.53,3.76,;-7.93,5.25,;-6.84,6.33,;-5.36,5.94,;-4.96,4.45,;-6.05,3.36,;-3.47,4.05,;-2.99,2.58,;-1.45,2.58,;-.98,4.05,;.36,4.82,;1.69,4.05,;.92,2.72,;2.46,2.72,;3.02,4.82,;3.02,6.36,;4.36,4.05,;4.36,2.51,;5.69,4.82,;5.69,6.36,;7.16,6.84,;7.93,8.17,;8.06,5.59,;7.16,4.34,;-2.22,4.95,;-2.22,6.49,;-3.56,7.26,;-4.89,6.49,;-6.22,7.26,;-3.56,8.8,;-2.22,9.57,;-.89,8.8,;-.89,7.26,;.44,6.49,;1.78,7.26,)|

BDBM269741

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)c2cn(C)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.22,1.18,;-8.62,2.67,;-7.53,3.76,;-7.93,5.25,;-6.84,6.33,;-5.36,5.94,;-4.96,4.45,;-6.05,3.36,;-3.47,4.05,;-2.99,2.58,;-1.45,2.58,;-.98,4.05,;.36,4.82,;1.69,4.05,;.92,2.72,;2.46,2.72,;3.02,4.82,;3.02,6.36,;4.36,4.05,;4.36,2.51,;5.69,4.82,;5.69,6.36,;7.16,6.84,;7.93,8.17,;8.06,5.59,;7.16,4.34,;-2.22,4.95,;-2.22,6.49,;-3.56,7.26,;-4.89,6.49,;-6.22,7.26,;-3.56,8.8,;-2.22,9.57,;-.89,8.8,;-.89,7.26,;.44,6.49,;1.78,7.26,)|

BDBM269742

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2cc(C)n(C)n2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.69,-9.57,;-9.09,-8.09,;-8,-7,;-8.39,-5.51,;-7.31,-4.42,;-5.82,-4.82,;-5.42,-6.31,;-6.51,-7.4,;-3.93,-6.71,;-3.46,-8.17,;-1.92,-8.17,;-1.44,-6.71,;-.11,-5.94,;1.23,-6.71,;.46,-8.04,;2,-8.04,;2.56,-5.94,;2.56,-4.4,;3.89,-6.71,;3.89,-8.25,;5.23,-5.94,;5.23,-4.4,;6.69,-3.92,;7.46,-2.59,;7.6,-5.17,;9.09,-5.57,;6.69,-6.41,;-2.69,-5.8,;-2.69,-4.26,;-4.02,-3.49,;-5.35,-4.26,;-6.69,-3.49,;-4.02,-1.95,;-2.69,-1.18,;-1.35,-1.95,;-1.35,-3.49,;-.02,-4.26,;1.31,-3.49,)|

BDBM269743

COc1cccc(OC)c1\N=C(/CS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(C)cn1)NNC(=O)c1cncc(C)c1 |r|

BDBM269744

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)c2ccc(Cl)cc2)n1-c1c(OC)cccc1OC |r,wD:23.24,(-9.1,-9.61,;-9.5,-8.12,;-8.41,-7.03,;-8.81,-5.55,;-7.72,-4.46,;-6.23,-4.86,;-5.83,-6.34,;-6.92,-7.43,;-4.34,-6.74,;-3.87,-8.21,;-2.33,-8.21,;-1.85,-6.74,;-.37,-6.34,;.03,-4.86,;1.52,-4.46,;2.29,-3.12,;1.52,-1.79,;3.06,-1.79,;3.78,-2.73,;.97,-7.11,;.2,-8.45,;1.74,-8.45,;2.3,-6.34,;3.64,-7.11,;3.64,-8.65,;4.97,-6.34,;6.3,-7.11,;7.64,-6.34,;7.64,-4.8,;8.97,-4.03,;6.3,-4.03,;4.97,-4.8,;-3.1,-5.84,;-3.1,-4.3,;-1.76,-3.53,;-.43,-4.3,;.9,-3.53,;-1.76,-1.99,;-3.1,-1.22,;-4.43,-1.99,;-4.43,-3.53,;-5.77,-4.3,;-7.1,-3.53,)|

BDBM269745

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(Cl)cc2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-9,-9.59,;-9.39,-8.11,;-8.3,-7.02,;-8.7,-5.53,;-7.61,-4.44,;-6.13,-4.84,;-5.73,-6.33,;-6.82,-7.41,;-4.24,-6.72,;-3.76,-8.19,;-2.22,-8.19,;-1.75,-6.72,;-.42,-5.95,;.92,-6.72,;.15,-8.06,;1.69,-8.06,;2.25,-5.95,;3.59,-6.72,;3.59,-8.26,;4.92,-5.95,;6.25,-6.72,;7.59,-5.95,;7.59,-4.41,;8.92,-3.64,;6.25,-3.64,;4.92,-4.41,;-2.99,-5.82,;-2.99,-4.28,;-1.66,-3.51,;-.33,-4.28,;1.01,-3.51,;-1.66,-1.97,;-2.99,-1.2,;-4.33,-1.97,;-4.33,-3.51,;-5.66,-4.28,;-7,-3.51,)|

BDBM269746

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(Cl)cc2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.33,-9.35,;-8.72,-7.86,;-7.63,-6.78,;-8.03,-5.29,;-6.94,-4.2,;-5.45,-4.6,;-5.06,-6.09,;-6.15,-7.18,;-3.72,-6.86,;-3.25,-8.32,;-1.71,-8.32,;-1.23,-6.86,;.1,-6.09,;1.44,-6.86,;.67,-8.19,;2.21,-8.19,;2.77,-6.09,;4.1,-6.86,;4.1,-8.4,;5.44,-6.09,;6.77,-6.86,;8.1,-6.09,;8.1,-4.55,;9.44,-3.78,;6.77,-3.78,;5.44,-4.55,;-2.48,-5.95,;-2.48,-3.69,;-3.81,-2.92,;-5.14,-3.69,;-6.48,-2.92,;-3.81,-1.38,;-2.48,-.61,;-1.14,-1.38,;-1.14,-2.92,;.19,-3.69,;1.52,-2.92,)|

BDBM269747

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)c2ccc(F)cc2Br)n1-c1c(OC)cccc1OC |r,wD:23.24,(-8.2,-11.61,;-8.6,-10.12,;-7.51,-9.03,;-7.9,-7.54,;-6.81,-6.46,;-5.33,-6.86,;-4.93,-8.35,;-6.02,-9.43,;-3.6,-9.12,;-3.12,-10.58,;-1.58,-10.58,;-1.1,-9.12,;.23,-8.35,;.63,-6.86,;2.12,-6.46,;2.51,-4.97,;4,-4.57,;1.43,-3.88,;2.91,-3.48,;1.56,-9.12,;.79,-10.45,;2.33,-10.45,;2.9,-8.35,;4.23,-9.12,;4.23,-10.66,;5.56,-8.35,;5.56,-6.81,;6.9,-6.04,;8.23,-6.81,;9.57,-6.04,;8.23,-8.35,;6.9,-9.12,;6.9,-10.66,;-2.35,-8.21,;-2.35,-3.78,;-3.68,-3.01,;-5.02,-3.78,;-6.35,-3.01,;-3.68,-1.47,;-2.35,-.7,;-1.02,-1.47,;-1.02,-3.01,;.32,-3.78,;1.65,-3.01,)|

BDBM269748

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(F)cc2S(C)(=O)=O)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.29,-9.17,;-8.68,-7.68,;-7.59,-6.59,;-7.99,-5.11,;-6.89,-4.02,;-5.41,-4.42,;-5.01,-5.91,;-6.1,-7,;-3.68,-6.68,;-3.2,-8.14,;-1.66,-8.14,;-1.19,-6.68,;.15,-5.91,;1.48,-6.68,;.71,-8.01,;2.25,-8.01,;2.81,-5.91,;4.15,-6.68,;4.15,-8.22,;5.48,-5.91,;5.48,-4.37,;6.82,-3.6,;8.15,-4.37,;9.48,-3.6,;8.15,-5.91,;6.82,-6.68,;6.82,-8.22,;5.48,-8.99,;8.15,-8.99,;8.15,-7.45,;-2.43,-5.77,;-2.43,-3.69,;-3.77,-2.92,;-5.1,-3.69,;-6.43,-2.92,;-3.77,-1.38,;-2.43,-.61,;-1.1,-1.38,;-1.1,-2.92,;.24,-3.69,;1.57,-2.92,)|

BDBM269749

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(F)cc2S(C)(=O)=O)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.33,-9.33,;-8.73,-7.84,;-7.63,-6.76,;-8.03,-5.27,;-6.94,-4.18,;-5.45,-4.58,;-5.06,-6.07,;-6.15,-7.16,;-3.72,-6.84,;-3.25,-8.31,;-1.71,-8.31,;-1.23,-6.84,;.1,-6.07,;1.44,-6.84,;.67,-8.18,;2.21,-8.18,;2.77,-6.07,;4.1,-6.84,;4.1,-8.38,;5.44,-6.07,;5.44,-4.53,;6.77,-3.76,;8.1,-4.53,;9.44,-3.76,;8.1,-6.07,;6.77,-6.84,;6.77,-8.38,;5.44,-9.15,;8.1,-9.15,;8.1,-7.61,;-2.48,-5.94,;-2.48,-3.85,;-3.81,-3.08,;-5.14,-3.85,;-6.48,-3.08,;-3.81,-1.54,;-2.48,-.77,;-1.14,-1.54,;-1.14,-3.08,;.19,-3.85,;1.52,-3.08,)|

BDBM269750

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.69,-9.29,;-9.08,-7.8,;-7.99,-6.71,;-8.39,-5.22,;-7.3,-4.14,;-5.81,-4.54,;-5.41,-6.03,;-6.5,-7.11,;-4.08,-6.8,;-3.6,-8.26,;-2.06,-8.26,;-1.59,-6.8,;-.25,-6.03,;1.08,-6.8,;.31,-8.13,;1.85,-8.13,;2.41,-6.03,;3.75,-6.8,;3.75,-8.34,;5.08,-6.03,;6.41,-6.8,;7.75,-6.03,;7.75,-4.49,;9.08,-3.72,;6.41,-3.72,;5.08,-4.49,;-2.83,-5.89,;-2.83,-3.81,;-4.17,-3.04,;-5.5,-3.81,;-6.83,-3.04,;-4.17,-1.5,;-2.83,-.73,;-1.5,-1.5,;-1.5,-3.04,;-.17,-3.81,;1.17,-3.04,)|

BDBM269751

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.69,-9.24,;-9.08,-7.75,;-7.99,-6.67,;-8.39,-5.18,;-7.3,-4.09,;-5.81,-4.49,;-5.41,-5.98,;-6.5,-7.07,;-4.08,-6.75,;-3.6,-8.22,;-2.06,-8.22,;-1.59,-6.75,;-.25,-5.98,;1.08,-6.75,;.31,-8.08,;1.85,-8.08,;2.41,-5.98,;3.75,-6.75,;3.75,-8.29,;5.08,-5.98,;6.41,-6.75,;7.75,-5.98,;7.75,-4.44,;9.08,-3.67,;6.41,-3.67,;5.08,-4.44,;-2.83,-5.85,;-2.83,-3.76,;-4.17,-2.99,;-5.5,-3.76,;-6.83,-2.99,;-4.17,-1.45,;-2.83,-.68,;-1.5,-1.45,;-1.5,-2.99,;-.17,-3.76,;1.17,-2.99,)|

BDBM269752

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wD:2.1,(2.89,-8.89,;4.23,-8.12,;4.23,-6.58,;2.89,-5.81,;1.56,-6.58,;.79,-7.91,;2.33,-7.91,;.23,-5.81,;-1.11,-6.58,;-1.58,-8.04,;-3.12,-8.04,;-3.6,-6.58,;-4.93,-5.81,;-5.33,-4.32,;-6.82,-3.92,;-7.91,-5.01,;-7.51,-6.49,;-8.6,-7.58,;-8.21,-9.07,;-6.03,-6.9,;-2.35,-5.67,;-2.35,-3.59,;-3.69,-2.82,;-5.02,-3.59,;-6.36,-2.82,;-3.69,-1.28,;-2.35,-.51,;-1.02,-1.28,;-1.02,-2.82,;.31,-3.59,;1.65,-2.82,;5.56,-5.81,;5.56,-4.27,;6.89,-3.5,;8.23,-4.27,;9.56,-3.5,;8.23,-5.81,;6.89,-6.58,;6.89,-8.12,;5.56,-8.89,;8.23,-8.89,;8.23,-7.35,)|

BDBM269753

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wD:2.1,(2.77,-9.26,;4.1,-8.49,;4.1,-6.95,;2.77,-6.18,;1.44,-6.95,;.67,-8.28,;2.21,-8.28,;.1,-6.18,;-1.23,-6.95,;-1.71,-8.41,;-3.25,-8.41,;-3.72,-6.95,;-5.06,-6.18,;-5.45,-4.69,;-6.94,-4.29,;-8.03,-5.38,;-7.63,-6.86,;-8.73,-7.95,;-8.33,-9.44,;-6.15,-7.27,;-2.48,-6.04,;-2.48,-3.78,;-3.81,-3.01,;-5.14,-3.78,;-6.48,-3.01,;-3.81,-1.47,;-2.48,-.7,;-1.14,-1.47,;-1.14,-3.01,;.19,-3.78,;1.52,-3.01,;5.44,-6.18,;5.44,-4.64,;6.77,-3.87,;8.1,-4.64,;9.44,-3.87,;8.1,-6.18,;6.77,-6.95,;6.77,-8.49,;5.44,-9.26,;8.1,-9.26,;8.1,-7.72,)|

BDBM269754

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wD:2.1,(2.77,-8.98,;4.1,-8.21,;4.1,-6.67,;2.77,-5.9,;1.44,-6.67,;.67,-8,;2.21,-8,;.1,-5.9,;-1.23,-6.67,;-1.71,-8.13,;-3.25,-8.13,;-3.72,-6.67,;-5.06,-5.9,;-5.45,-4.41,;-6.94,-4.01,;-8.03,-5.1,;-7.63,-6.59,;-8.73,-7.67,;-8.33,-9.16,;-6.15,-6.99,;-2.48,-5.76,;-2.48,-3.68,;-3.81,-2.91,;-5.14,-3.68,;-6.48,-2.91,;-3.81,-1.37,;-2.48,-.6,;-1.14,-1.37,;-1.14,-2.91,;.19,-3.68,;1.52,-2.91,;5.44,-5.9,;5.44,-4.36,;6.77,-3.59,;8.1,-4.36,;9.44,-3.59,;8.1,-5.9,;6.77,-6.67,;6.77,-8.21,;5.44,-8.98,;8.1,-8.98,;8.1,-7.44,)|

BDBM269755

CO[C@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1Br |r,wD:2.1,(2.9,-11.43,;4.23,-10.66,;4.23,-9.12,;2.9,-8.35,;1.56,-9.12,;.79,-10.45,;2.33,-10.45,;.23,-8.35,;.63,-6.86,;2.12,-6.46,;2.51,-4.97,;4,-4.57,;1.43,-3.88,;2.91,-3.48,;-1.1,-9.12,;-1.58,-10.58,;-3.12,-10.58,;-3.6,-9.12,;-4.93,-8.35,;-5.33,-6.86,;-6.81,-6.46,;-7.9,-7.54,;-7.51,-9.03,;-8.6,-10.12,;-8.2,-11.61,;-6.02,-9.43,;-2.35,-8.21,;-2.35,-3.78,;-3.68,-3.01,;-5.02,-3.78,;-6.35,-3.01,;-3.68,-1.47,;-2.35,-.7,;-1.02,-1.47,;-1.02,-3.01,;.32,-3.78,;1.65,-3.01,;5.56,-8.35,;5.56,-6.81,;6.9,-6.04,;8.23,-6.81,;9.57,-6.04,;8.23,-8.35,;6.9,-9.12,;6.9,-10.66,)|

BDBM269756

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1C#N |r,wD:2.1,(2.31,-9.47,;3.65,-8.7,;3.65,-7.16,;2.31,-6.39,;.98,-7.16,;-.11,-8.24,;1.38,-8.64,;-.11,-6.07,;-1.6,-6.47,;-2.07,-7.93,;-3.61,-7.93,;-4.09,-6.47,;-5.58,-6.07,;-5.98,-4.58,;-7.46,-4.18,;-8.55,-5.27,;-8.15,-6.76,;-9.24,-7.85,;-8.84,-9.33,;-6.67,-7.16,;-2.84,-5.56,;-2.84,-3.54,;-4.18,-2.77,;-5.51,-3.54,;-6.84,-2.77,;-4.18,-1.23,;-2.84,-.46,;-1.51,-1.23,;-1.51,-2.77,;-.18,-3.54,;1.16,-2.77,;4.98,-6.39,;4.98,-4.85,;6.31,-4.08,;7.65,-4.85,;8.98,-4.08,;7.65,-6.39,;6.31,-7.21,;6.31,-8.75,;6.31,-10.29,)|

BDBM269758

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2F)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.3,-18.97,;-8.7,-17.48,;-7.61,-16.39,;-8.01,-14.9,;-6.92,-13.81,;-5.43,-14.21,;-5.03,-15.7,;-6.12,-16.79,;-3.55,-16.1,;-3.07,-17.56,;-1.53,-17.56,;-1.05,-16.1,;.28,-15.33,;1.61,-16.1,;.84,-17.43,;2.38,-17.43,;2.95,-15.33,;2.95,-13.79,;4.28,-16.1,;4.28,-17.64,;5.61,-15.33,;5.61,-13.79,;6.95,-13.02,;8.28,-13.79,;9.62,-13.02,;8.28,-15.33,;6.95,-16.1,;6.95,-17.64,;-2.3,-15.19,;-2.3,-13.65,;-3.63,-12.88,;-4.97,-13.65,;-6.3,-12.88,;-3.63,-11.34,;-2.3,-10.57,;-.97,-11.34,;-.97,-12.88,;.37,-13.65,;1.7,-12.88,)|

BDBM269759

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(F)cc2F)n1-c1c(OC)cccc1OC |r,wU:18.19,16.17,(-8.3,-18.97,;-8.7,-17.48,;-7.61,-16.39,;-8.01,-14.9,;-6.92,-13.81,;-5.43,-14.21,;-5.03,-15.7,;-6.12,-16.79,;-3.55,-16.1,;-3.07,-17.56,;-1.53,-17.56,;-1.05,-16.1,;.28,-15.33,;1.61,-16.1,;.84,-17.43,;2.38,-17.43,;2.95,-15.33,;2.95,-13.79,;4.28,-16.1,;4.28,-17.64,;5.61,-15.33,;5.61,-13.79,;6.95,-13.02,;8.28,-13.79,;9.62,-13.02,;8.28,-15.33,;6.95,-16.1,;6.95,-17.64,;-2.3,-15.19,;-2.3,-13.65,;-3.63,-12.88,;-4.97,-13.65,;-6.3,-12.88,;-3.63,-11.34,;-2.3,-10.57,;-.97,-11.34,;-.97,-12.88,;.37,-13.65,;1.7,-12.88,)|

BDBM269760

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(F)cc2F)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-9.25,-20.18,;-8.85,-18.69,;-7.36,-18.3,;-6.96,-16.81,;-5.47,-16.41,;-4.39,-17.5,;-4.78,-18.99,;-6.27,-19.38,;-3.7,-20.08,;-3.7,-21.62,;-2.23,-22.09,;-1.33,-20.85,;.21,-20.85,;.98,-22.18,;1.75,-23.51,;-.35,-22.95,;2.32,-21.41,;2.32,-19.87,;3.65,-22.18,;3.65,-23.72,;4.99,-21.41,;4.99,-19.87,;6.32,-19.1,;7.65,-19.87,;8.99,-19.1,;7.65,-21.41,;6.32,-22.18,;6.32,-23.72,;-2.23,-19.6,;-1.47,-16.75,;-2.56,-15.66,;-4.04,-16.06,;-5.13,-14.97,;-2.16,-14.17,;-.67,-13.77,;.42,-14.86,;.02,-16.35,;1.11,-17.44,;2.6,-17.04,)|

BDBM269762

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(-8.87,-19.99,;-9.27,-18.51,;-8.18,-17.42,;-8.58,-15.93,;-7.49,-14.84,;-6,-15.24,;-5.6,-16.73,;-6.69,-17.82,;-4.12,-17.13,;-3.64,-18.59,;-2.1,-18.59,;-1.62,-17.13,;-.14,-16.73,;.26,-15.24,;1.75,-14.84,;2.15,-13.35,;3.64,-12.95,;1.06,-12.26,;2.55,-11.87,;.95,-17.82,;1.35,-19.3,;-.14,-18.9,;2.29,-17.05,;2.29,-15.51,;3.62,-17.82,;3.62,-19.36,;4.95,-17.05,;6.29,-17.82,;7.62,-17.05,;7.62,-15.51,;8.95,-14.74,;6.29,-14.74,;4.95,-15.51,;-2.87,-16.22,;-2.87,-14.68,;-4.2,-13.91,;-5.54,-14.68,;-6.87,-13.91,;-4.2,-12.37,;-2.87,-11.6,;-1.54,-12.37,;-1.54,-13.91,;-.2,-14.68,;1.13,-13.91,)|

BDBM269763

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-9.25,-20.18,;-8.85,-18.69,;-7.36,-18.3,;-6.96,-16.81,;-5.47,-16.41,;-4.39,-17.5,;-4.78,-18.99,;-6.27,-19.38,;-3.7,-20.08,;-3.7,-21.62,;-2.23,-22.09,;-1.33,-20.85,;.21,-20.85,;.98,-22.18,;1.75,-23.51,;-.35,-22.95,;2.32,-21.41,;2.32,-19.87,;3.65,-22.18,;3.65,-23.72,;4.99,-21.41,;6.32,-22.18,;7.65,-21.41,;7.65,-19.87,;8.99,-19.1,;6.32,-19.1,;4.99,-19.87,;-2.23,-19.6,;-1.47,-16.75,;-2.56,-15.66,;-4.04,-16.06,;-5.13,-14.97,;-2.16,-14.17,;-.67,-13.77,;.42,-14.86,;.02,-16.35,;1.11,-17.44,;2.6,-17.04,)|

BDBM269767

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2Br)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(2.02,-10.37,;1.62,-8.88,;2.71,-7.79,;2.31,-6.3,;3.4,-5.21,;4.89,-5.61,;5.28,-7.1,;4.19,-8.19,;6.77,-7.5,;7.25,-8.96,;8.79,-8.96,;9.26,-7.5,;10.75,-7.1,;11.52,-5.77,;13.01,-5.37,;13.41,-3.88,;12.32,-2.79,;14.89,-3.48,;13.81,-2.39,;12.08,-7.87,;12.85,-9.2,;11.31,-9.2,;13.42,-7.1,;13.42,-5.56,;14.75,-7.87,;14.75,-9.41,;16.09,-7.1,;16.09,-5.56,;17.42,-4.79,;18.75,-5.56,;20.09,-4.79,;18.75,-7.1,;17.42,-7.87,;17.42,-9.41,;8.02,-6.59,;8.02,-5.05,;6.68,-4.28,;5.35,-5.05,;4.02,-4.28,;6.68,-2.74,;8.02,-1.97,;9.35,-2.74,;9.35,-4.28,;10.68,-5.05,;12.02,-4.28,)|

BDBM269768

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cc2S(C)(=O)=O)n1-c1c(OC)cccc1OC |r,wD:18.19,16.17,(-8.62,-6.29,;-8.22,-4.81,;-6.73,-4.41,;-6.33,-2.92,;-4.85,-2.52,;-3.76,-3.61,;-4.16,-5.1,;-5.64,-5.5,;-3.07,-6.19,;-3.07,-7.73,;-1.6,-8.2,;-.7,-6.96,;.84,-6.96,;1.61,-8.29,;.28,-9.06,;2.38,-9.63,;2.95,-7.52,;2.95,-6.03,;4.24,-8.27,;4.24,-9.76,;5.53,-7.52,;5.53,-6.03,;6.82,-5.28,;8.12,-6.03,;9.41,-5.28,;8.12,-7.52,;6.82,-8.41,;6.82,-9.95,;5.28,-9.95,;6.82,-11.49,;8.36,-9.95,;-1.6,-5.71,;-1.17,-3.4,;.32,-3.01,;1.41,-4.1,;2.9,-3.7,;.72,-1.52,;-.37,-.43,;-1.86,-.83,;-2.26,-2.32,;-3.74,-2.71,;-4.83,-1.63,)|

BDBM269770

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@@H](C)[C@@H](O)c2nc(C)c(C)s2)cc1 |r|

BDBM269771

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2nc(C)c(C)s2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(3.06,-4.2,;4.39,-4.97,;5.73,-4.2,;5.73,-2.66,;7.06,-1.89,;8.39,-2.66,;8.39,-4.2,;9.73,-4.97,;11.06,-4.2,;7.06,-4.97,;7.06,-6.51,;8.31,-7.41,;9.64,-6.64,;10.73,-7.73,;9.96,-9.06,;11.5,-9.06,;12.22,-7.33,;12.62,-5.84,;13.31,-8.42,;12.91,-9.91,;14.79,-8.02,;16.04,-8.93,;17.29,-8.02,;18.62,-8.79,;16.81,-6.56,;17.58,-5.22,;15.27,-6.56,;7.83,-8.88,;6.29,-8.88,;5.82,-7.41,;4.28,-7.41,;3.51,-8.74,;1.97,-8.74,;1.2,-7.41,;1.97,-6.08,;1.2,-4.74,;3.51,-6.08,)|

BDBM269772

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2nc(C)c(C)s2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(3.08,-3.98,;4.41,-4.75,;5.75,-3.98,;5.75,-2.44,;7.08,-1.67,;8.41,-2.44,;8.41,-3.98,;9.75,-4.75,;11.08,-3.98,;7.08,-4.75,;7.08,-6.29,;8.33,-7.2,;9.66,-6.43,;10.75,-7.52,;9.98,-8.85,;11.52,-8.85,;12.24,-7.12,;12.63,-5.63,;13.32,-8.21,;12.93,-9.7,;14.81,-7.81,;16.06,-8.72,;17.3,-7.81,;18.64,-8.58,;16.83,-6.35,;17.6,-5.01,;15.29,-6.35,;7.85,-8.66,;6.31,-8.66,;5.83,-7.2,;4.29,-7.2,;3.52,-8.53,;1.98,-8.53,;1.21,-7.2,;1.98,-5.87,;1.21,-4.53,;3.52,-5.87,)|

BDBM269773

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2nc(C)c(C)s2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(3.33,-4.18,;4.67,-4.95,;6,-4.18,;6,-2.64,;7.34,-1.87,;8.67,-2.64,;8.67,-4.18,;10,-4.95,;11.34,-4.18,;7.34,-4.95,;7.34,-6.49,;8.58,-7.4,;9.91,-6.63,;11,-7.72,;10.23,-9.05,;11.77,-9.05,;12.49,-7.32,;12.89,-5.83,;13.58,-8.41,;13.18,-9.89,;15.07,-8.01,;16.31,-8.91,;17.56,-8.01,;18.89,-8.78,;17.08,-6.54,;17.85,-5.21,;15.54,-6.54,;8.11,-8.86,;6.57,-8.86,;6.09,-7.4,;4.55,-7.4,;3.78,-8.73,;2.24,-8.73,;1.47,-7.4,;2.24,-6.06,;1.47,-4.73,;3.78,-6.06,)|

BDBM269774

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2nc(C)c(C)s2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(3,-3.99,;4.33,-4.76,;5.67,-3.99,;5.67,-2.45,;7,-1.68,;8.33,-2.45,;8.33,-3.99,;9.67,-4.76,;11,-3.99,;7,-4.76,;7,-6.3,;8.25,-7.21,;9.58,-6.44,;10.67,-7.52,;9.9,-8.86,;11.44,-8.86,;12.16,-7.13,;12.56,-5.64,;13.25,-8.22,;12.85,-9.7,;14.73,-7.82,;15.98,-8.72,;17.23,-7.82,;18.56,-8.59,;16.75,-6.35,;17.52,-5.02,;15.21,-6.35,;7.77,-8.67,;6.23,-8.67,;5.76,-7.21,;4.22,-7.21,;3.45,-8.54,;1.91,-8.54,;1.14,-7.21,;1.91,-5.87,;1.14,-4.54,;3.45,-5.87,)|

BDBM269776

CO[C@H]([C@H](C)S(=O)(=O)N(Cc1ccc(OC)cc1)Cc1ccc(OC)cc1)c1nc(C)c(C)s1 |r|

BDBM269777

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1nc(C)c(C)s1 |r,wU:3.3,wD:2.1,(14.21,-10.89,;13.13,-9.8,;13.52,-8.31,;12.44,-7.22,;12.83,-5.74,;10.95,-7.62,;11.69,-8.91,;10.2,-8.91,;9.64,-6.93,;8.15,-7.33,;7.67,-8.8,;6.13,-8.8,;5.66,-7.33,;4.12,-7.33,;3.35,-8.67,;1.81,-8.67,;1.04,-7.33,;1.81,-6,;1.01,-4.62,;3.35,-6,;6.9,-6.43,;6.9,-4.89,;5.57,-4.12,;4.24,-4.89,;2.9,-4.12,;5.57,-2.58,;6.9,-1.81,;8.24,-2.58,;8.24,-4.12,;9.57,-4.89,;10.91,-4.12,;15.01,-7.91,;16.26,-8.82,;17.5,-7.91,;18.84,-8.68,;17.03,-6.45,;17.8,-5.12,;15.49,-6.45,)|

BDBM269779

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1nc(C)c(C)s1 |r,wU:3.3,wD:2.1,(14.49,-10.89,;13.4,-9.8,;13.8,-8.31,;12.71,-7.22,;13.1,-5.74,;11.22,-7.62,;11.96,-8.91,;10.47,-8.91,;9.91,-6.93,;8.42,-7.33,;7.95,-8.8,;6.41,-8.8,;5.93,-7.33,;4.39,-7.33,;3.62,-8.67,;2.08,-8.67,;1.31,-7.33,;2.08,-6,;1.28,-4.62,;3.62,-6,;7.18,-6.43,;7.18,-4.89,;5.84,-4.12,;4.51,-4.89,;3.17,-4.12,;5.84,-2.58,;7.18,-1.81,;8.51,-2.58,;8.51,-4.12,;9.84,-4.89,;11.18,-4.12,;15.28,-7.91,;16.53,-8.82,;17.77,-7.91,;19.11,-8.68,;17.3,-6.45,;18.07,-5.12,;15.76,-6.45,)|

BDBM269782

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@@H](C)[C@@H](O)c2cnc(OC)cn2)cc1 |r|

BDBM269783

COc1cnc(cn1)[C@H](O)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:10.11,wD:8.9,(20.95,-8.64,;19.86,-7.55,;18.37,-7.95,;17.97,-9.43,;16.48,-9.83,;15.39,-8.74,;15.79,-7.26,;17.28,-6.86,;13.91,-9.14,;13.51,-10.63,;12.82,-8.05,;13.22,-6.57,;11.33,-8.45,;12.08,-9.74,;10.58,-9.74,;10.02,-7.74,;8.53,-8.14,;8.06,-9.61,;6.52,-9.61,;6.04,-8.14,;4.5,-8.14,;3.73,-9.48,;2.19,-9.48,;1.42,-8.14,;2.19,-6.81,;1.4,-5.43,;3.73,-6.81,;7.29,-7.24,;7.29,-5.7,;5.95,-4.93,;4.62,-5.7,;3.29,-4.93,;5.95,-3.39,;7.29,-2.62,;8.62,-3.39,;8.62,-4.93,;9.95,-5.7,;11.29,-4.93,)|

BDBM269785

COc1cnc(cn1)[C@H](O)[C@@H](C)S(N)(=O)=O |r|

BDBM269786

COc1cnc(cn1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wD:8.9,10.11,(9.57,9.67,;8.49,10.75,;7,10.36,;6.6,8.87,;5.11,8.47,;4.02,9.56,;4.42,11.05,;5.91,11.44,;2.54,9.16,;2.14,7.67,;1.45,10.25,;1.85,11.74,;-.04,9.85,;-.81,8.52,;.36,8.36,;-1.13,10.94,;-2.46,10.17,;-2.94,8.7,;-4.48,8.7,;-4.95,10.17,;-6.49,10.17,;-7.26,8.84,;-8.8,8.84,;-9.57,10.17,;-8.8,11.5,;-9.57,12.84,;-7.26,11.5,;-3.71,11.07,;-3.71,12.61,;-5.04,13.38,;-6.38,12.61,;-7.71,13.38,;-5.04,14.92,;-3.71,15.69,;-2.38,14.92,;-2.38,13.38,;-1.04,12.61,;.31,13.35,)|

BDBM269788

CO[C@H]([C@H](C)S(=O)(=O)N(Cc1ccc(OC)cc1)Cc1ccc(OC)cc1)c1cnc(OC)cn1 |r|

BDBM269789

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(OC)cn1 |r,wU:2.1,3.3,(3.24,23.21,;2.14,24.32,;2.54,25.8,;1.45,26.89,;1.85,28.38,;-.04,26.49,;-.81,25.16,;.36,25.01,;-1.13,27.58,;-2.46,26.81,;-2.94,25.35,;-4.48,25.35,;-4.95,26.81,;-6.49,26.81,;-7.26,25.48,;-8.8,25.48,;-9.57,26.81,;-8.8,28.15,;-9.57,29.48,;-7.26,28.15,;-3.71,27.72,;-3.71,29.26,;-5.04,30.03,;-6.38,29.26,;-7.71,30.03,;-5.04,31.57,;-3.71,32.34,;-2.38,31.57,;-2.38,30.03,;-1.04,29.26,;.31,29.99,;4.02,26.2,;4.42,27.69,;5.91,28.09,;7,27,;8.49,27.4,;9.57,26.31,;6.6,25.51,;5.11,25.11,)|

BDBM269790

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(OC)cn1 |r,wU:2.1,3.3,(3.24,23.78,;2.14,24.88,;2.54,26.37,;1.45,27.46,;1.85,28.95,;-.04,27.06,;-.81,25.73,;.36,25.57,;-1.13,28.15,;-2.46,27.38,;-2.94,25.92,;-4.48,25.92,;-4.95,27.38,;-6.49,27.38,;-7.26,26.05,;-8.8,26.05,;-9.57,27.38,;-8.8,28.71,;-9.57,30.05,;-7.26,28.71,;-3.71,28.29,;-3.71,29.83,;-5.04,30.6,;-6.38,29.83,;-7.71,30.6,;-5.04,32.14,;-3.71,32.91,;-2.38,32.14,;-2.38,30.6,;-1.04,29.83,;.31,30.56,;4.02,26.77,;4.42,28.26,;5.91,28.66,;7,27.57,;8.49,27.97,;9.57,26.88,;6.6,26.08,;5.11,25.68,)|

BDBM269791

C\C(=C(\C)S(N)(=O)=O)c1ncc(C)cn1

BDBM269792

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:18.19,16.17,(-10.75,-1.29,;-9.42,-2.06,;-8.07,-1.28,;-8.07,.28,;-6.72,1.06,;-5.37,.28,;-5.37,-1.28,;-6.72,-2.06,;-4.02,-2.06,;-3.54,-3.53,;-2,-3.53,;-1.53,-2.06,;-.2,-1.29,;.89,-2.38,;.12,-3.71,;1.29,-3.87,;2.38,-1.98,;2.78,-.5,;3.47,-3.07,;3.07,-4.56,;4.96,-2.67,;6.05,-3.76,;7.53,-3.36,;7.93,-1.88,;9.42,-1.48,;6.84,-.79,;5.36,-1.19,;-2.77,-1.16,;-2.77,1.48,;-4.11,2.25,;-5.44,1.48,;-6.78,2.25,;-4.11,3.79,;-2.77,4.56,;-1.44,3.79,;-1.44,2.25,;-.11,1.48,;1.25,2.21,)|

BDBM269793

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)c2ccc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:23.24,(-6.07,-18.93,;-6.84,-17.6,;-6.07,-16.27,;-6.84,-14.93,;-6.07,-13.6,;-4.53,-13.6,;-3.76,-14.93,;-4.53,-16.27,;-2.22,-14.93,;-1.31,-16.18,;.15,-15.7,;.15,-14.16,;1.48,-13.39,;1.48,-11.85,;2.82,-11.08,;2.82,-9.54,;4.36,-9.54,;1.28,-9.54,;2.82,-8,;2.82,-14.16,;4.15,-14.93,;2.05,-15.5,;3.59,-12.83,;5.13,-12.83,;5.9,-14.16,;5.9,-11.5,;5.13,-10.16,;5.9,-8.83,;7.44,-8.83,;8.21,-7.49,;8.21,-10.16,;7.44,-11.5,;-1.31,-13.69,;-2.57,-11.39,;-4.11,-11.39,;-4.88,-12.72,;-6.42,-12.72,;-4.88,-10.06,;-4.11,-8.72,;-2.57,-8.72,;-1.8,-10.06,;-.26,-10.06,;.51,-8.72,)|

BDBM269794

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-8.65,5.74,;-9.05,7.22,;-7.96,8.31,;-8.36,9.8,;-7.27,10.89,;-5.78,10.49,;-5.38,9,;-6.47,7.91,;-4.05,8.23,;-3.58,6.79,;-2.06,6.79,;-1.59,8.23,;-.27,8.99,;1.06,8.22,;.29,6.89,;1.83,6.89,;2.4,8.99,;3.73,8.22,;3.73,6.68,;5.06,8.99,;4.67,10.48,;5.75,11.57,;7.24,11.17,;8.33,12.26,;7.64,9.68,;6.55,8.59,;-2.82,9.13,;-2.82,11.73,;-4.14,12.49,;-5.45,11.73,;-6.77,12.49,;-4.14,14.01,;-2.82,14.77,;-1.5,14.01,;-1.5,12.49,;-.18,11.73,;1.15,12.46,)|

BDBM269795

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-8.87,9.22,;-9.27,10.71,;-8.18,11.8,;-8.58,13.29,;-7.49,14.38,;-6.01,13.98,;-5.61,12.49,;-6.7,11.4,;-4.27,11.72,;-3.8,10.27,;-2.28,10.27,;-1.81,11.72,;-.49,12.48,;.84,11.71,;.07,10.38,;1.61,10.38,;2.17,12.48,;3.51,11.71,;3.51,10.17,;4.84,12.48,;4.44,13.97,;5.53,15.06,;7.02,14.66,;8.11,15.75,;7.42,13.17,;6.33,12.08,;-3.04,12.61,;-3.04,15.22,;-4.36,15.98,;-5.68,15.22,;-7,15.98,;-4.36,17.5,;-3.04,18.26,;-1.72,17.5,;-1.72,15.98,;-.41,15.22,;.93,15.94,)|

BDBM269796

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(cc2)C#N)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-10.66,6.44,;-9.12,6.44,;-8.35,5.1,;-9.12,3.77,;-8.35,2.43,;-6.81,2.43,;-6.04,3.77,;-6.81,5.1,;-4.5,3.77,;-4.03,2.3,;-2.49,2.3,;-2.01,3.77,;-.68,4.54,;.65,3.77,;1.05,2.28,;-.43,2.68,;2.19,3.77,;2.96,5.1,;2.96,2.43,;2.19,1.1,;4.5,2.43,;5.27,1.1,;6.81,1.1,;7.64,2.43,;6.81,3.77,;5.27,3.77,;9.18,2.44,;10.72,2.44,;-3.26,4.67,;-3.26,6.21,;-4.59,6.98,;-5.93,6.21,;-7.26,6.98,;-4.59,8.52,;-3.26,9.29,;-1.92,8.52,;-1.92,6.98,;-.59,6.21,;.74,6.98,)|

BDBM269797

BDBM269801

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccccc2OC)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-7.45,6.32,;-8.22,4.99,;-7.45,3.65,;-8.22,2.32,;-7.45,.99,;-5.91,.99,;-5.14,2.32,;-5.91,3.65,;-3.6,2.32,;-3.13,.86,;-1.59,.86,;-1.11,2.32,;.22,3.09,;1.56,2.32,;.79,.99,;2.33,.99,;2.89,3.09,;2.89,4.63,;4.22,2.32,;4.22,.78,;5.56,3.09,;6.89,2.32,;8.22,3.09,;8.22,4.63,;6.89,5.4,;5.56,4.63,;4.22,5.4,;4.22,6.94,;-2.36,3.23,;-2.36,4.77,;-3.69,5.54,;-5.03,4.77,;-6.36,5.54,;-3.69,7.08,;-2.36,7.85,;-1.02,7.08,;-1.02,5.54,;.31,4.77,;1.64,5.54,)|

BDBM269805

CO[C@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:2.1,(7.55,-13.31,;6.01,-13.31,;5.24,-11.97,;3.7,-11.97,;2.93,-13.31,;2.16,-14.64,;4.26,-14.08,;1.59,-12.54,;1.59,-11,;2.93,-10.23,;2.93,-8.69,;4.47,-8.69,;1.46,-8.21,;2.93,-7.15,;.26,-13.31,;.26,-14.85,;-1.21,-15.32,;-2.11,-14.08,;-3.6,-13.68,;-4,-12.19,;-5.48,-11.79,;-6.57,-12.88,;-6.17,-14.37,;-7.26,-15.46,;-6.87,-16.95,;-4.69,-14.77,;-1.21,-12.83,;-1.78,-10.69,;-.69,-9.6,;.8,-10,;1.89,-8.91,;-1.09,-8.11,;-2.58,-7.71,;-3.67,-8.8,;-3.27,-10.29,;-4.36,-11.38,;-5.84,-10.98,;6.01,-10.64,;5.24,-9.31,;6.01,-7.97,;7.55,-7.97,;8.32,-6.64,;8.32,-9.31,;7.55,-10.64,)|

BDBM269806

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:2.1,(7.77,-13.93,;6.23,-13.93,;5.46,-12.6,;3.92,-12.6,;3.15,-13.93,;2.38,-15.26,;4.49,-14.7,;1.82,-13.16,;.49,-13.93,;.49,-15.47,;-.98,-15.95,;-1.88,-14.7,;-3.37,-14.3,;-3.77,-12.81,;-5.26,-12.42,;-6.35,-13.5,;-5.95,-14.99,;-7.04,-16.08,;-6.64,-17.57,;-4.46,-15.39,;-.98,-13.45,;-1.55,-11.31,;-.46,-10.22,;1.02,-10.62,;2.11,-9.53,;-.86,-8.74,;-2.35,-8.34,;-3.44,-9.43,;-3.04,-10.91,;-4.13,-12,;-5.62,-11.6,;6.23,-11.26,;5.46,-9.93,;6.23,-8.6,;7.77,-8.6,;8.54,-7.26,;8.54,-9.93,;7.77,-11.26,)|

BDBM269808

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(Br)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-6.86,-17.57,;-7.26,-16.08,;-6.17,-14.99,;-6.57,-13.5,;-5.48,-12.42,;-3.99,-12.81,;-3.59,-14.3,;-4.68,-15.39,;-2.11,-14.7,;-1.2,-15.95,;.26,-15.47,;.26,-13.93,;1.6,-13.16,;2.93,-13.93,;2.16,-15.26,;4.27,-14.7,;3.7,-12.6,;5.24,-12.6,;6.01,-13.93,;6.01,-11.26,;5.24,-9.93,;6.01,-8.6,;7.55,-8.6,;8.32,-7.26,;8.32,-9.93,;7.55,-11.26,;-1.2,-13.45,;-1.77,-11.31,;-.69,-10.22,;.8,-10.62,;1.89,-9.53,;-1.08,-8.74,;-2.57,-8.34,;-3.66,-9.43,;-3.26,-10.91,;-4.35,-12,;-5.84,-11.6,)|

BDBM269809

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(cn2)C#N)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.37,-18.24,;-7.77,-16.75,;-6.68,-15.66,;-7.08,-14.17,;-5.99,-13.08,;-4.5,-13.48,;-4.1,-14.97,;-5.19,-16.06,;-2.62,-15.37,;-1.71,-16.61,;-.25,-16.14,;-.25,-14.6,;1.09,-13.83,;2.42,-14.6,;1.65,-15.93,;3.75,-15.37,;3.19,-13.26,;4.73,-13.26,;5.5,-14.6,;5.5,-11.93,;4.73,-10.6,;5.5,-9.26,;7.07,-9.21,;7.81,-10.6,;7.04,-11.93,;7.84,-7.88,;8.61,-6.55,;-1.71,-14.12,;-2.29,-11.98,;-1.2,-10.89,;.29,-11.29,;1.38,-10.2,;-1.6,-9.4,;-3.08,-9,;-4.17,-10.09,;-3.77,-11.58,;-4.86,-12.67,;-6.35,-12.27,)|

BDBM269811

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cc(C)on2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.17,-15.16,;-7.57,-13.68,;-6.48,-12.59,;-6.88,-11.1,;-5.79,-10.01,;-4.3,-10.41,;-3.91,-11.9,;-4.99,-12.99,;-2.57,-12.67,;-2.1,-14.13,;-.56,-14.13,;-.08,-12.67,;1.25,-11.9,;2.59,-12.67,;1.5,-13.76,;3.68,-13.76,;3.68,-11.58,;5.16,-11.98,;5.56,-13.46,;6.25,-10.89,;6.25,-9.35,;7.72,-8.87,;8.49,-7.54,;8.62,-10.12,;7.72,-11.36,;-1.33,-11.76,;-1.33,-9.86,;-2.66,-9.09,;-3.99,-9.86,;-5.33,-9.09,;-2.66,-7.55,;-1.33,-6.78,;.01,-7.55,;.01,-9.09,;1.34,-9.86,;2.67,-9.09,)|

BDBM269812

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cc(C)on2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.3,-15.16,;-7.7,-13.68,;-6.61,-12.59,;-7.01,-11.1,;-5.92,-10.01,;-4.43,-10.41,;-4.03,-11.9,;-5.12,-12.99,;-2.7,-12.67,;-2.22,-14.13,;-.68,-14.13,;-.21,-12.67,;1.13,-11.9,;2.46,-12.67,;1.37,-13.76,;3.55,-13.76,;3.55,-11.58,;5.04,-11.98,;5.43,-13.46,;6.12,-10.89,;6.12,-9.35,;7.59,-8.87,;8.36,-7.54,;8.49,-10.12,;7.59,-11.36,;-1.45,-11.76,;-1.45,-9.86,;-2.79,-9.09,;-4.12,-9.86,;-5.45,-9.09,;-2.79,-7.55,;-1.45,-6.78,;-.12,-7.55,;-.12,-9.09,;1.21,-9.86,;2.55,-9.09,)|

BDBM269813

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@H](O)c2cc(C)on2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-7.3,-15.16,;-7.7,-13.68,;-6.61,-12.59,;-7.01,-11.1,;-5.92,-10.01,;-4.43,-10.41,;-4.03,-11.9,;-5.12,-12.99,;-2.7,-12.67,;-2.22,-14.13,;-.68,-14.13,;-.21,-12.67,;1.13,-11.9,;2.46,-12.67,;1.37,-13.76,;3.55,-13.76,;3.55,-11.58,;5.04,-11.98,;5.43,-13.46,;6.12,-10.89,;6.12,-9.35,;7.59,-8.87,;8.36,-7.54,;8.49,-10.12,;7.59,-11.36,;-1.45,-11.76,;-1.45,-9.86,;-2.79,-9.09,;-4.12,-9.86,;-5.45,-9.09,;-2.79,-7.55,;-1.45,-6.78,;-.12,-7.55,;-.12,-9.09,;1.21,-9.86,;2.55,-9.09,)|

BDBM269814

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cc(C)no2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.29,-14.62,;-7.69,-13.13,;-6.6,-12.04,;-7,-10.55,;-5.91,-9.46,;-4.42,-9.86,;-4.02,-11.35,;-5.11,-12.44,;-2.69,-12.12,;-2.21,-13.58,;-.67,-13.58,;-.2,-12.12,;1.14,-11.35,;2.47,-12.12,;1.38,-13.21,;3.56,-13.21,;3.56,-11.03,;5.05,-11.43,;5.44,-12.92,;6.13,-10.34,;6.13,-8.8,;7.6,-8.32,;8.37,-6.99,;8.5,-9.57,;7.6,-10.81,;-1.44,-11.21,;-1.44,-9.31,;-2.78,-8.54,;-4.11,-9.31,;-5.45,-8.54,;-2.78,-7,;-1.44,-6.23,;-.11,-7,;-.11,-8.54,;1.22,-9.31,;2.56,-8.54,)|

BDBM269816

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.61,-14.86,;-8.01,-13.38,;-6.92,-12.29,;-7.32,-10.8,;-6.23,-9.71,;-4.74,-10.11,;-4.34,-11.6,;-5.43,-12.69,;-3.01,-12.37,;-2.53,-13.83,;-.99,-13.83,;-.52,-12.37,;.82,-11.6,;2.15,-12.37,;1.06,-13.46,;3.24,-13.46,;3.24,-11.28,;4.73,-11.68,;5.13,-13.16,;5.82,-10.59,;7.3,-10.99,;8.39,-9.9,;7.99,-8.41,;9.08,-7.32,;6.51,-8.01,;5.42,-9.1,;-1.76,-11.46,;-1.76,-9.56,;-3.1,-8.79,;-4.43,-9.56,;-5.76,-8.79,;-3.1,-7.25,;-1.76,-6.48,;-.43,-7.25,;-.43,-8.79,;.91,-9.56,;2.24,-8.79,)|

BDBM269817

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.74,-14.62,;-8.13,-13.13,;-7.05,-12.04,;-7.44,-10.55,;-6.35,-9.46,;-4.87,-9.86,;-4.47,-11.35,;-5.56,-12.44,;-3.14,-12.12,;-2.66,-13.58,;-1.12,-13.58,;-.64,-12.12,;.69,-11.35,;2.02,-12.12,;.94,-13.21,;3.11,-13.21,;3.11,-11.03,;4.6,-11.43,;5,-12.92,;5.69,-10.34,;7.18,-10.74,;8.27,-9.65,;7.87,-8.16,;8.96,-7.07,;6.38,-7.76,;5.29,-8.85,;-1.89,-11.21,;-1.89,-9.31,;-3.22,-8.54,;-4.56,-9.31,;-5.89,-8.54,;-3.22,-7,;-1.89,-6.23,;-.56,-7,;-.56,-8.54,;.78,-9.31,;2.11,-8.54,)|

BDBM269818

CCc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.68,-9.32,;-8.08,-7.83,;-6.99,-6.75,;-7.39,-5.26,;-6.3,-4.17,;-4.82,-4.57,;-4.42,-6.06,;-5.51,-7.14,;-2.93,-6.45,;-2.45,-7.92,;-.91,-7.92,;-.44,-6.45,;1.05,-6.06,;2.14,-7.14,;1.05,-8.23,;3.23,-8.23,;3.23,-6.06,;4.71,-6.45,;5.11,-7.94,;5.8,-5.36,;7.29,-5.76,;8.38,-4.67,;7.98,-3.19,;9.07,-2.1,;6.49,-2.79,;5.4,-3.88,;-1.68,-5.55,;-1.68,-4.01,;-3.02,-3.24,;-4.35,-4.01,;-5.69,-3.24,;-3.02,-1.7,;-1.68,-.93,;-.35,-1.7,;-.35,-3.24,;.98,-4.01,;2.32,-3.24,)|

BDBM269819

C[C@@H]([C@H](O[Si](C)(C)C(C)(C)C)c1ccc(Br)cc1F)S(N)(=O)=O |r|

BDBM269820

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(cc2F)C#N)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-6.23,-12.46,;-4.9,-13.23,;-3.56,-12.46,;-3.56,-10.92,;-2.23,-10.15,;-.9,-10.92,;-.9,-12.46,;.44,-13.23,;1.77,-12.46,;-2.23,-13.23,;-2.23,-14.77,;-.99,-15.68,;.5,-15.28,;1.59,-16.37,;.5,-17.46,;2.68,-17.46,;2.68,-15.28,;2.28,-13.79,;4.17,-15.68,;4.57,-17.17,;5.26,-14.59,;6.74,-14.99,;7.83,-13.9,;7.47,-12.37,;5.95,-12.01,;4.86,-13.1,;3.37,-12.7,;8.56,-11.28,;9.65,-10.2,;-1.46,-17.14,;-3,-17.14,;-3.48,-15.68,;-4.96,-15.28,;-5.36,-13.79,;-6.85,-13.39,;-7.94,-14.48,;-7.54,-15.97,;-8.63,-17.06,;-6.05,-16.37,)|

BDBM269822

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-6.23,-12.46,;-4.9,-13.23,;-3.56,-12.46,;-3.56,-10.92,;-2.23,-10.15,;-.9,-10.92,;-.9,-12.46,;.44,-13.23,;1.77,-12.46,;-2.23,-13.23,;-2.23,-14.77,;-.99,-15.68,;.5,-15.28,;1.59,-16.37,;.5,-17.46,;2.68,-17.46,;2.68,-15.28,;2.28,-13.79,;4.17,-15.68,;4.57,-17.17,;5.26,-14.59,;4.86,-13.1,;5.95,-12.01,;7.47,-12.37,;8.56,-11.28,;7.83,-13.9,;6.74,-14.99,;-1.46,-17.14,;-3,-17.14,;-3.48,-15.68,;-4.96,-15.28,;-5.36,-13.79,;-6.85,-13.39,;-7.94,-14.48,;-7.54,-15.97,;-8.63,-17.06,;-6.05,-16.37,)|

BDBM269823

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-5.56,-12.46,;-4.23,-13.23,;-2.89,-12.46,;-2.89,-10.92,;-1.56,-10.15,;-.22,-10.92,;-.22,-12.46,;1.11,-13.23,;2.44,-12.46,;-1.56,-13.23,;-1.56,-14.77,;-.31,-15.68,;1.18,-15.28,;2.26,-16.37,;1.18,-17.46,;3.35,-17.46,;3.35,-15.28,;2.95,-13.79,;4.84,-15.68,;5.24,-17.17,;5.93,-14.59,;5.53,-13.1,;6.62,-12.01,;8.11,-12.41,;9.2,-11.32,;8.51,-13.9,;7.42,-14.99,;-.79,-17.14,;-2.33,-17.14,;-2.8,-15.68,;-4.29,-15.28,;-4.69,-13.79,;-6.18,-13.39,;-7.27,-14.48,;-6.87,-15.97,;-7.96,-17.06,;-5.38,-16.37,)|

BDBM269825

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:17.18,(-5.43,-3.31,;-4.1,-4.08,;-2.76,-3.31,;-2.76,-1.77,;-1.43,-1,;-.1,-1.77,;-.1,-3.31,;1.24,-4.08,;2.57,-3.31,;-1.43,-4.08,;-1.43,-5.62,;-.18,-6.53,;1.3,-6.13,;2.39,-7.22,;1.3,-8.31,;3.48,-8.31,;3.48,-6.13,;4.97,-6.53,;5.37,-8.02,;6.06,-5.44,;5.66,-3.95,;6.75,-2.86,;8.24,-3.26,;9.32,-2.17,;8.63,-4.75,;7.55,-5.84,;-.66,-7.99,;-2.2,-7.99,;-2.68,-6.53,;-4.16,-6.13,;-4.56,-4.64,;-6.05,-4.24,;-7.14,-5.33,;-6.74,-6.82,;-7.83,-7.91,;-5.25,-7.22,)|

BDBM269826

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:17.18,(-5.56,-3.31,;-4.23,-4.08,;-2.89,-3.31,;-2.89,-1.77,;-1.56,-1,;-.22,-1.77,;-.22,-3.31,;1.11,-4.08,;2.44,-3.31,;-1.56,-4.08,;-1.56,-5.62,;-.31,-6.53,;1.18,-6.13,;2.26,-7.22,;1.18,-8.31,;3.35,-8.31,;3.35,-6.13,;4.84,-6.53,;5.24,-8.02,;5.93,-5.44,;5.53,-3.95,;6.62,-2.86,;8.11,-3.26,;9.2,-2.17,;8.51,-4.75,;7.42,-5.84,;-.79,-7.99,;-2.33,-7.99,;-2.8,-6.53,;-4.29,-6.13,;-4.69,-4.64,;-6.18,-4.24,;-7.27,-5.33,;-6.87,-6.82,;-7.96,-7.91,;-5.38,-7.22,)|

BDBM269828

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@@H](C)[C@H](O)c2ccc(F)cn2)cc1 |r|

BDBM269829

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:3.3,2.1,(3.5,-26.2,;4.59,-25.11,;4.39,-23.58,;3.06,-22.81,;2.86,-21.28,;1.97,-23.9,;.88,-24.99,;3.06,-24.99,;.88,-22.81,;-.45,-23.58,;-.93,-25.04,;-2.47,-25.04,;-2.95,-23.58,;-4.43,-23.18,;-4.83,-21.69,;-6.32,-21.3,;-7.41,-22.38,;-7.01,-23.87,;-8.1,-24.96,;-5.52,-24.27,;-1.7,-22.67,;-1.7,-21.13,;-3.03,-20.36,;-4.37,-21.13,;-5.7,-20.36,;-3.03,-18.82,;-1.7,-18.05,;-.37,-18.82,;-.37,-20.36,;.97,-21.13,;2.3,-20.36,;5.48,-22.49,;5.08,-21,;6.17,-19.91,;7.66,-20.31,;8.75,-19.22,;8.06,-21.8,;6.97,-22.89,)|

BDBM269831

CO[C@@H]([C@H](C)S(N)(=O)=O)c1ccc(Br)cc1F |r|

BDBM269832

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1F)C#N |r,wD:3.3,2.1,(3.02,-26.2,;4.11,-25.11,;3.91,-23.58,;2.58,-22.81,;2.37,-21.28,;1.49,-23.9,;.4,-24.99,;2.58,-24.99,;.4,-22.81,;-.94,-23.58,;-1.41,-25.04,;-2.95,-25.04,;-3.43,-23.58,;-4.92,-23.18,;-5.31,-21.69,;-6.8,-21.3,;-7.89,-22.38,;-7.49,-23.87,;-8.58,-24.96,;-6,-24.27,;-2.18,-22.67,;-2.18,-21.13,;-3.52,-20.36,;-4.85,-21.13,;-6.18,-20.36,;-3.52,-18.82,;-2.18,-18.05,;-.85,-18.82,;-.85,-20.36,;.48,-21.13,;1.82,-20.36,;5,-22.49,;4.6,-21,;5.69,-19.91,;7.18,-20.31,;7.57,-21.8,;6.49,-22.89,;6.88,-24.38,;8.26,-19.22,;9.35,-18.14,)|

BDBM269833

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1F)C#N |r,wD:3.3,2.1,(3.07,-26.2,;4.16,-25.11,;3.96,-23.58,;2.62,-22.81,;2.42,-21.28,;1.53,-23.9,;.45,-24.99,;2.62,-24.99,;.45,-22.81,;-.89,-23.58,;-1.36,-25.04,;-2.9,-25.04,;-3.38,-23.58,;-4.87,-23.18,;-5.27,-21.69,;-6.75,-21.3,;-7.84,-22.38,;-7.44,-23.87,;-8.53,-24.96,;-5.96,-24.27,;-2.13,-22.67,;-2.13,-21.13,;-3.47,-20.36,;-4.8,-21.13,;-6.14,-20.36,;-3.47,-18.82,;-2.13,-18.05,;-.8,-18.82,;-.8,-20.36,;.53,-21.13,;1.87,-20.36,;5.05,-22.49,;4.65,-21,;5.74,-19.91,;7.22,-20.31,;7.62,-21.8,;6.53,-22.89,;6.93,-24.38,;8.31,-19.22,;9.4,-18.14,)|

BDBM269835

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(1.83,-6.71,;.49,-7.48,;-.84,-6.71,;-.89,-5.14,;-2.22,-4.37,;-3.56,-5.14,;-3.56,-6.68,;-4.89,-7.45,;-6.22,-6.68,;-2.22,-7.45,;-2.22,-8.99,;-.98,-9.9,;.36,-9.13,;1.69,-9.9,;.92,-11.23,;2.46,-11.23,;3.03,-9.13,;3.03,-7.59,;4.36,-9.9,;4.36,-11.44,;5.69,-9.13,;7.03,-9.9,;8.36,-9.13,;8.36,-7.59,;9.69,-6.82,;7.03,-6.82,;5.69,-7.59,;-1.45,-11.36,;-2.99,-11.36,;-3.47,-9.9,;-4.95,-9.5,;-5.72,-10.83,;-7.26,-10.83,;-8.03,-9.5,;-7.26,-8.16,;-8.03,-6.83,;-5.72,-8.16,)|

BDBM269837

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,wD:2.1,(3.03,-11.82,;4.36,-11.05,;4.36,-9.51,;3.03,-8.74,;3.03,-7.2,;1.69,-9.51,;.92,-10.85,;2.46,-10.85,;.36,-8.74,;-.98,-9.51,;-1.45,-10.98,;-2.99,-10.98,;-3.47,-9.51,;-4.95,-9.11,;-5.72,-10.45,;-7.26,-10.45,;-8.03,-9.11,;-7.26,-7.78,;-8.03,-6.45,;-5.72,-7.78,;-2.22,-8.61,;-2.22,-7.07,;-.84,-6.32,;.49,-7.09,;1.83,-6.32,;-.89,-4.76,;-2.22,-3.99,;-3.56,-4.76,;-3.56,-6.3,;-4.89,-7.07,;-6.22,-6.3,;5.69,-8.74,;7.03,-9.51,;8.36,-8.74,;8.36,-7.2,;9.69,-6.43,;7.03,-6.43,;5.69,-7.2,)|

BDBM269839

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-10.91,3.94,;-9.37,3.94,;-8.6,5.27,;-9.37,6.6,;-8.6,7.94,;-7.06,7.94,;-6.29,6.6,;-7.06,5.27,;-4.8,6.2,;-4.32,4.74,;-2.78,4.74,;-2.31,6.2,;-.97,6.97,;.36,6.2,;-.41,4.87,;1.13,4.87,;1.69,6.97,;1.69,8.51,;3.03,6.2,;3.03,4.66,;4.36,6.97,;5.69,6.2,;7.03,6.97,;7.03,8.51,;8.36,9.28,;5.69,9.28,;4.36,8.51,;-3.55,7.11,;-3.55,8.65,;-2.17,9.39,;-.84,8.62,;.49,9.39,;-2.22,10.96,;-3.55,11.73,;-4.89,10.96,;-4.89,9.42,;-6.22,8.65,;-7.56,9.42,)|

BDBM269841

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(O)n2)n1-c1c(O)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,wD:2.1,(1.99,-9.13,;3.32,-8.36,;3.32,-6.82,;1.99,-6.05,;1.99,-4.51,;.65,-6.82,;-.12,-8.16,;1.42,-8.16,;-.68,-6.05,;-2.01,-6.82,;-2.49,-8.29,;-4.03,-8.29,;-4.5,-6.82,;-5.84,-6.05,;-6.61,-4.72,;-8.15,-4.72,;-8.92,-6.05,;-8.15,-7.39,;-8.92,-8.72,;-6.61,-7.39,;-3.26,-5.92,;-3.26,-4.05,;-4.59,-3.28,;-5.93,-4.05,;-4.59,-1.74,;-3.26,-.97,;-1.92,-1.74,;-1.88,-3.31,;-.54,-4.08,;.79,-3.31,;4.66,-6.05,;5.99,-6.82,;7.32,-6.05,;7.32,-4.51,;8.66,-3.74,;5.99,-3.74,;4.66,-4.51,)|

BDBM269842

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,wD:2.1,(2.52,-13.99,;3.85,-13.22,;3.85,-11.68,;2.52,-10.91,;2.52,-9.37,;1.19,-11.68,;.42,-13.01,;1.96,-13.01,;-.15,-10.91,;-1.48,-11.68,;-1.96,-13.14,;-3.5,-13.14,;-3.97,-11.68,;-5.31,-10.91,;-6.08,-9.57,;-7.62,-9.57,;-8.39,-10.91,;-7.62,-12.24,;-8.39,-13.58,;-9.93,-13.58,;-6.08,-12.24,;-2.73,-10.77,;-2.73,-8.87,;-1.35,-8.13,;-.01,-8.9,;1.32,-8.13,;-1.39,-6.56,;-2.73,-5.79,;-4.06,-6.56,;-4.06,-8.1,;-5.39,-8.87,;-6.73,-8.1,;5.19,-10.91,;6.52,-11.68,;7.85,-10.91,;7.85,-9.37,;9.19,-8.6,;6.52,-8.6,;5.19,-9.37,)|

BDBM269843

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cc2F)nnc1-c1cncc(C)c1 |r,wU:17.18,(1.32,-8.51,;-.01,-9.28,;-1.35,-8.51,;-1.39,-6.95,;-2.73,-6.18,;-4.06,-6.95,;-4.06,-8.49,;-5.39,-9.26,;-6.73,-8.49,;-2.73,-9.26,;-2.73,-11.16,;-1.48,-12.06,;-.15,-11.29,;1.19,-12.06,;.42,-13.4,;1.96,-13.4,;2.52,-11.29,;3.85,-12.06,;3.85,-13.6,;5.19,-11.29,;5.19,-9.75,;6.52,-8.98,;7.85,-9.75,;9.19,-8.98,;7.85,-11.29,;6.52,-12.06,;6.52,-13.6,;-1.96,-13.53,;-3.5,-13.53,;-3.97,-12.06,;-5.31,-11.29,;-6.08,-12.63,;-7.62,-12.63,;-8.39,-11.29,;-7.62,-9.96,;-8.39,-8.63,;-6.08,-9.96,)|

BDBM269845

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccccn1 |(1.32,-8.51,;-.01,-9.28,;-1.35,-8.51,;-1.39,-6.95,;-2.73,-6.18,;-4.06,-6.95,;-4.06,-8.49,;-5.39,-9.26,;-6.73,-8.49,;-2.73,-9.26,;-2.73,-11.16,;-1.48,-12.06,;-.15,-11.29,;1.19,-12.06,;.42,-13.4,;1.96,-13.4,;2.52,-11.29,;3.85,-12.06,;5.19,-11.29,;6.52,-12.06,;7.85,-11.29,;7.85,-9.75,;9.19,-8.98,;6.52,-8.98,;5.19,-9.75,;-1.96,-13.53,;-3.5,-13.53,;-3.97,-12.06,;-5.31,-11.29,;-6.08,-9.96,;-7.62,-9.96,;-8.39,-11.29,;-7.62,-12.63,;-6.08,-12.63,)|

BDBM269846

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccnc1 |(1.32,-8.51,;-.01,-9.28,;-1.35,-8.51,;-1.39,-6.95,;-2.73,-6.18,;-4.06,-6.95,;-4.06,-8.49,;-5.39,-9.26,;-6.73,-8.49,;-2.73,-9.26,;-2.73,-11.16,;-1.48,-12.06,;-.15,-11.29,;1.19,-12.06,;.42,-13.4,;1.96,-13.4,;2.52,-11.29,;3.85,-12.06,;5.19,-11.29,;6.52,-12.06,;7.85,-11.29,;7.85,-9.75,;9.19,-8.98,;6.52,-8.98,;5.19,-9.75,;-1.96,-13.53,;-3.5,-13.53,;-3.97,-12.06,;-5.31,-11.29,;-6.08,-9.96,;-7.62,-9.96,;-8.39,-11.29,;-7.62,-12.63,;-6.08,-12.63,)|

BDBM269847

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(4.05,-7.14,;2.96,-8.22,;1.47,-7.83,;1.08,-6.34,;-.41,-5.94,;-1.5,-7.03,;-1.1,-8.52,;-2.59,-8.91,;-3.68,-7.83,;.38,-8.91,;.78,-10.4,;2.25,-10.88,;3.58,-10.11,;4.92,-10.88,;4.14,-12.21,;6.25,-11.65,;5.68,-9.54,;4.92,-8.21,;7.22,-9.54,;8,-10.88,;8,-8.21,;9.54,-8.21,;10.3,-6.88,;9.54,-5.54,;10.3,-4.21,;8,-5.54,;7.22,-6.88,;2.25,-12.42,;.78,-12.89,;-.12,-11.65,;-1.99,-11.15,;-2.39,-9.66,;-3.87,-9.26,;-4.96,-10.35,;-4.56,-11.84,;-5.65,-12.93,;-3.08,-12.24,)|

BDBM269848

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-7.37,1.57,;-6.03,.8,;-4.7,1.57,;-4.7,3.11,;-3.37,3.88,;-2.03,3.11,;-2.03,1.57,;-.7,.8,;.64,1.57,;-3.37,.8,;-3.37,-.74,;-2.12,-1.65,;-.79,-.88,;.55,-1.65,;1.32,-2.98,;-.22,-2.98,;2.04,-1.25,;2.43,.24,;3.12,-2.34,;3.12,-3.88,;4.61,-1.94,;5.7,-3.03,;7.19,-2.63,;7.59,-1.14,;9.07,-.74,;6.5,-.05,;5.01,-.45,;-2.6,-3.11,;-4.14,-3.11,;-4.61,-1.65,;-6.1,-1.25,;-7.19,-2.34,;-8.68,-1.94,;-9.07,-.45,;-7.99,.64,;-8.38,2.12,;-6.5,.24,)|

BDBM269849

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,(1.49,-7.47,;.4,-8.56,;-1.09,-8.16,;-1.49,-6.67,;-2.97,-6.28,;-4.06,-7.37,;-3.66,-8.85,;-5.15,-9.25,;-6.24,-8.16,;-2.18,-9.25,;-1.78,-10.74,;-.31,-11.21,;1.02,-10.44,;2.35,-11.21,;1.58,-12.55,;3.69,-11.98,;3.12,-9.88,;2.35,-8.55,;4.66,-9.88,;5.43,-8.55,;6.97,-8.55,;7.74,-9.88,;9.28,-9.88,;6.97,-11.21,;5.43,-11.21,;-.31,-12.75,;-1.78,-13.23,;-2.68,-11.98,;-4.55,-11.48,;-4.95,-10,;-6.44,-9.6,;-7.52,-10.69,;-7.13,-12.18,;-8.22,-13.26,;-5.64,-12.57,)|

BDBM269850

COc1ccc(CSc2nnc(-c3cncc(C)c3)n2-c2c(OC)cccc2OC)cc1 |(8.41,.1,;7.08,.87,;5.75,.1,;5.75,-1.44,;4.41,-2.21,;3.08,-1.44,;1.74,-2.21,;.41,-1.44,;-.92,-2.21,;-1.4,-3.68,;-2.94,-3.68,;-3.41,-2.21,;-4.75,-1.44,;-5.15,.05,;-6.63,.45,;-7.72,-.64,;-7.32,-2.13,;-8.41,-3.22,;-5.84,-2.53,;-2.17,-1.31,;-2.17,.6,;-3.5,1.37,;-4.84,.6,;-6.17,1.37,;-3.5,2.91,;-2.17,3.68,;-.83,2.91,;-.83,1.37,;.5,.6,;1.83,1.37,;3.08,.1,;4.41,.87,)|

BDBM269851

COc1cccc(OC)c1-n1c(NC(=O)[C@@H](C)Cc2ccccc2)nnc1-c1cncc(C)c1 |r,wU:15.16,(-5.77,-3.91,;-4.44,-4.68,;-3.11,-3.91,;-3.11,-2.37,;-1.77,-1.6,;-.44,-2.37,;-.44,-3.91,;.9,-4.68,;2.23,-3.91,;-1.77,-4.68,;-1.77,-6.22,;-.53,-7.12,;.96,-6.73,;2.05,-7.81,;1.65,-9.3,;3.54,-7.42,;3.94,-5.93,;4.63,-8.5,;6.11,-8.11,;7.2,-9.19,;8.69,-8.8,;9.09,-7.31,;8,-6.22,;6.51,-6.62,;-1,-8.59,;-2.54,-8.59,;-3.02,-7.12,;-4.51,-6.73,;-4.9,-5.24,;-6.39,-4.84,;-7.48,-5.93,;-7.08,-7.42,;-8.17,-8.5,;-5.59,-7.81,)|

BDBM269852

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](N)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.84,-11.47,;-7.35,-11.86,;-6.95,-13.35,;-8.04,-14.44,;-7.64,-15.93,;-6.15,-16.33,;-5.06,-15.24,;-5.46,-13.75,;-3.58,-15.64,;-3.1,-17.1,;-1.56,-17.1,;-1.09,-15.64,;.25,-14.87,;1.58,-15.64,;.81,-16.97,;2.35,-16.97,;2.92,-14.87,;2.92,-13.33,;4.25,-15.64,;4.25,-17.18,;5.58,-14.87,;6.92,-15.64,;8.25,-14.87,;8.25,-13.33,;9.58,-12.56,;6.92,-12.56,;5.58,-13.33,;-2.33,-14.73,;-2.33,-13.19,;-3.67,-12.42,;-5,-13.19,;-6.33,-12.42,;-3.67,-10.88,;-2.33,-10.11,;-1,-10.88,;-1,-12.42,;.34,-13.19,;1.67,-12.42,)|

BDBM269856

COc1cccc(OC)c1-n1c(nnc1-c1cncc(C)c1)N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)C1(C)COC1 |r,wD:33.36,(-4.7,-2.82,;-3.61,-3.91,;-2.12,-3.51,;-1.72,-2.03,;-.23,-1.63,;.85,-2.72,;.46,-4.2,;1.54,-5.29,;3.03,-4.9,;-1.03,-4.6,;-1.43,-6.09,;-.53,-7.34,;-1.43,-8.58,;-2.89,-8.11,;-2.89,-6.57,;-4.23,-5.8,;-5.56,-6.57,;-6.9,-5.8,;-6.9,-4.26,;-5.56,-3.49,;-5.56,-1.95,;-4.23,-4.26,;1.01,-7.34,;1.78,-6,;3.32,-6,;4.09,-4.67,;5.63,-4.67,;4.09,-3.13,;4.86,-6,;1.78,-8.67,;2.55,-10,;.45,-9.44,;3.12,-7.9,;4.45,-8.67,;4.45,-10.21,;5.79,-7.9,;4.7,-6.81,;6.87,-8.99,;7.96,-7.9,;6.87,-6.81,)|

BDBM269857

COc1cccc(OC)c1-n1c(nnc1-c1cncc(C)c1)N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)C1CCC1 |r,wD:33.36,(-5.29,-3.78,;-3.96,-4.55,;-2.63,-3.78,;-2.63,-2.24,;-1.29,-1.47,;.04,-2.24,;.04,-3.78,;1.37,-4.55,;2.71,-3.78,;-1.29,-4.55,;-1.29,-6.09,;-.05,-6.99,;-.52,-8.46,;-2.06,-8.46,;-2.54,-6.99,;-4.03,-6.59,;-5.12,-7.68,;-6.6,-7.28,;-7,-5.8,;-5.91,-4.71,;-6.31,-3.22,;-4.43,-5.11,;1.29,-6.22,;2.06,-4.89,;3.6,-4.89,;4.37,-3.55,;5.91,-3.55,;4.37,-2.01,;5.46,-4.64,;2.62,-6.99,;1.85,-8.33,;3.39,-8.33,;3.95,-6.22,;5.29,-6.99,;5.29,-8.53,;6.62,-6.22,;8.11,-6.62,;8.51,-5.13,;7.02,-4.73,)|

BDBM269858

C[C@@H](O)[C@H](O)c1ncc(C)cn1 |r|

BDBM269859

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,(5.25,.6,;3.92,1.37,;3.92,2.91,;2.59,3.68,;1.25,2.91,;.48,1.57,;2.02,1.57,;-.08,3.68,;-1.41,2.91,;-1.89,1.44,;-3.43,1.44,;-3.91,2.91,;-5.39,3.31,;-5.79,4.79,;-7.28,5.19,;-8.37,4.1,;-7.97,2.62,;-9.06,1.53,;-10.55,1.93,;-6.48,2.22,;-2.66,3.81,;-2.66,5.35,;-1.33,6.12,;.01,5.35,;1.34,6.12,;-1.33,7.66,;-2.66,8.43,;-3.99,7.66,;-3.99,6.12,;-5.33,5.35,;-6.66,6.12,;5.25,3.68,;6.59,2.91,;7.92,3.68,;7.92,5.22,;9.25,5.99,;6.59,5.99,;5.25,5.22,)|

BDBM269861

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)C1CCC1 |r,wU:3.3,wD:2.1,(6.46,-8.18,;5.13,-7.41,;5.13,-5.87,;3.79,-5.1,;3.79,-3.56,;2.46,-5.87,;1.69,-7.2,;3.23,-7.2,;1.13,-5.1,;-.21,-5.87,;-.68,-7.33,;-2.22,-7.33,;-2.7,-5.87,;-4.19,-5.47,;-4.59,-3.98,;-6.07,-3.58,;-7.16,-4.67,;-6.76,-6.16,;-7.85,-7.25,;-9.34,-6.85,;-5.28,-6.56,;-1.45,-4.96,;-1.45,-3.42,;-.12,-2.65,;1.21,-3.42,;2.55,-2.65,;-.12,-1.11,;-1.45,-.34,;-2.79,-1.11,;-2.79,-2.65,;-4.12,-3.42,;-5.46,-2.65,;6.46,-5.1,;7.95,-5.5,;8.35,-4.01,;6.86,-3.61,)|

BDBM269862

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)C1CCC1 |r,wD:2.1,3.3,(6.61,.56,;5.27,1.33,;5.27,2.87,;3.94,3.64,;3.94,5.18,;2.61,2.87,;1.84,1.53,;3.38,1.53,;1.27,3.64,;-.06,2.87,;-.54,1.4,;-2.08,1.4,;-2.55,2.87,;-4.04,3.27,;-4.44,4.75,;-5.93,5.15,;-7.02,4.06,;-6.62,2.58,;-7.71,1.49,;-9.19,1.89,;-5.13,2.18,;-1.31,3.77,;-1.31,5.31,;.03,6.08,;1.36,5.31,;2.69,6.08,;.03,7.62,;-1.31,8.39,;-2.64,7.62,;-2.64,6.08,;-3.98,5.31,;-5.31,6.08,;6.61,3.64,;8.09,3.24,;8.49,4.73,;7.01,5.13,)|

BDBM269867

COc1cccc(OC)c1-n1c(NS(=O)(=O)N[C@@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wD:17.18,(1,1.2,;-.34,.43,;-1.67,1.2,;-1.72,2.76,;-3.05,3.53,;-4.38,2.76,;-4.38,1.22,;-5.72,.45,;-7.05,1.22,;-3.05,.45,;-3.05,-1.09,;-1.81,-1.99,;-.47,-1.22,;.86,-1.99,;.09,-3.33,;1.63,-3.33,;2.2,-1.22,;3.53,-1.99,;3.53,-3.53,;4.86,-1.22,;6.2,-1.99,;7.53,-1.22,;7.53,.32,;8.86,1.09,;6.2,1.09,;4.86,.32,;-2.28,-3.46,;-3.82,-3.46,;-4.3,-1.99,;-5.78,-1.59,;-6.55,-2.93,;-8.09,-2.93,;-8.86,-1.59,;-8.09,-.26,;-8.86,1.07,;-6.55,-.26,)|

BDBM269868

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OCCO)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(1.57,-2.91,;.24,-3.68,;-1.1,-2.91,;-1.14,-1.35,;-2.48,-.58,;-3.81,-1.35,;-3.81,-2.89,;-5.15,-3.66,;-6.48,-2.89,;-2.48,-3.66,;-2.48,-5.2,;-1.23,-6.1,;.1,-5.33,;1.44,-6.1,;.67,-7.43,;2.21,-7.43,;2.77,-5.33,;2.77,-3.79,;4.1,-6.1,;4.1,-7.64,;5.44,-8.41,;5.44,-9.95,;6.77,-10.72,;5.44,-5.33,;6.77,-6.1,;8.1,-5.33,;8.1,-3.79,;9.44,-3.02,;6.77,-3.02,;5.44,-3.79,;-1.71,-7.57,;-3.25,-7.57,;-3.72,-6.1,;-5.21,-5.7,;-5.98,-7.04,;-7.52,-7.04,;-8.29,-5.7,;-7.52,-4.37,;-8.29,-3.04,;-5.98,-4.37,)|

BDBM269869

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OCCO)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(1.44,-2.91,;.11,-3.68,;-1.22,-2.91,;-1.27,-1.35,;-2.61,-.58,;-3.94,-1.35,;-3.94,-2.89,;-5.27,-3.66,;-6.61,-2.89,;-2.61,-3.66,;-2.61,-5.2,;-1.36,-6.1,;-.03,-5.33,;1.31,-6.1,;.54,-7.43,;2.08,-7.43,;2.64,-5.33,;2.64,-3.79,;3.98,-6.1,;3.98,-7.64,;5.31,-8.41,;5.31,-9.95,;6.64,-10.72,;5.31,-5.33,;6.64,-6.1,;7.98,-5.33,;7.98,-3.79,;9.31,-3.02,;6.64,-3.02,;5.31,-3.79,;-1.84,-7.57,;-3.38,-7.57,;-3.85,-6.1,;-5.34,-5.7,;-6.11,-7.04,;-7.65,-7.04,;-8.42,-5.7,;-7.65,-4.37,;-8.42,-3.04,;-6.11,-4.37,)|

BDBM269870

COCCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:5.4,6.6,(6.64,-12.26,;6.64,-10.72,;5.31,-9.95,;5.31,-8.41,;3.98,-7.64,;3.98,-6.1,;2.64,-5.33,;2.64,-3.79,;1.31,-6.1,;.54,-7.43,;2.08,-7.43,;-.03,-5.33,;-1.36,-6.1,;-1.84,-7.57,;-3.38,-7.57,;-3.85,-6.1,;-5.34,-5.7,;-6.11,-7.04,;-7.65,-7.04,;-8.42,-5.7,;-7.65,-4.37,;-8.42,-3.04,;-6.11,-4.37,;-2.61,-5.2,;-2.61,-3.66,;-1.22,-2.91,;.11,-3.68,;1.44,-2.91,;-1.27,-1.35,;-2.61,-.58,;-3.94,-1.35,;-3.94,-2.89,;-5.27,-3.66,;-6.61,-2.89,;5.31,-5.33,;6.64,-6.1,;7.98,-5.33,;7.98,-3.79,;9.31,-3.02,;6.64,-3.02,;5.31,-3.79,)|

BDBM269871

COCCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:6.6,5.4,(6.56,-12.19,;6.56,-10.65,;5.22,-9.88,;5.22,-8.34,;3.89,-7.57,;3.89,-6.03,;2.55,-5.26,;2.55,-3.72,;1.22,-6.03,;.45,-7.36,;1.99,-7.36,;-.11,-5.26,;-1.45,-6.03,;-1.92,-7.49,;-3.46,-7.49,;-3.94,-6.03,;-5.34,-5.55,;-6.11,-6.88,;-7.65,-6.88,;-8.42,-5.55,;-7.65,-4.21,;-8.42,-2.88,;-6.11,-4.21,;-2.69,-5.12,;-2.69,-3.58,;-1.31,-2.84,;.02,-3.61,;1.36,-2.84,;-1.36,-1.27,;-2.69,-.5,;-4.03,-1.27,;-4.03,-2.81,;-5.36,-3.58,;-6.69,-2.81,;5.22,-5.26,;6.56,-6.03,;7.89,-5.26,;7.89,-3.72,;9.22,-2.95,;6.56,-2.95,;5.22,-3.72,)|

BDBM269872

COCCO[C@H]([C@@H](C)S(=O)(=O)\N=c1/n(C)nc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:6.6,5.4,(6.56,-23.88,;6.56,-22.34,;5.23,-21.57,;5.23,-20.03,;3.9,-19.26,;3.9,-17.72,;2.56,-16.95,;2.56,-15.41,;1.23,-17.72,;.46,-19.06,;2,-19.06,;-.11,-16.95,;-1.44,-17.72,;-1.9,-19.26,;-1.01,-20.52,;-3.46,-19.19,;-3.93,-17.72,;-5.34,-17.24,;-6.11,-18.58,;-7.65,-18.58,;-8.42,-17.24,;-7.65,-15.91,;-8.42,-14.57,;-6.11,-15.91,;-2.69,-16.82,;-2.69,-15.28,;-1.3,-14.54,;.03,-15.31,;1.36,-14.54,;-1.35,-12.97,;-2.69,-12.2,;-4.02,-12.97,;-4.02,-14.51,;-5.35,-15.28,;-6.69,-14.51,;5.23,-16.95,;6.56,-17.72,;7.9,-16.95,;7.9,-15.41,;9.23,-14.64,;6.56,-14.64,;5.23,-15.41,)|

BDBM269873

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC[C@H](C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,wD:21.23,(1.36,-14.72,;.03,-15.49,;-1.3,-14.72,;-1.35,-13.15,;-2.69,-12.38,;-4.02,-13.15,;-4.02,-14.69,;-5.35,-15.46,;-6.69,-14.69,;-2.69,-15.46,;-2.69,-17,;-1.44,-17.9,;-.11,-17.13,;1.23,-17.9,;.46,-19.24,;2,-19.24,;2.56,-17.13,;2.56,-15.59,;3.89,-17.9,;3.89,-19.44,;5.23,-20.21,;5.23,-21.75,;6.56,-22.52,;3.89,-22.52,;5.23,-17.13,;6.56,-17.9,;7.9,-17.13,;7.9,-15.59,;9.23,-14.82,;6.56,-14.82,;5.23,-15.59,;-1.92,-19.37,;-3.46,-19.37,;-3.93,-17.9,;-5.34,-17.42,;-6.11,-18.76,;-7.65,-18.76,;-8.42,-17.42,;-7.65,-16.09,;-8.42,-14.76,;-6.11,-16.09,)|

BDBM269877

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OCC(C)(C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.36,-2.62,;.02,-3.39,;-1.31,-2.62,;-1.36,-1.05,;-2.69,-.28,;-4.03,-1.05,;-4.03,-2.59,;-5.36,-3.36,;-6.69,-2.59,;-2.69,-3.36,;-2.69,-4.9,;-1.45,-5.81,;-.11,-5.04,;1.22,-5.81,;.45,-7.14,;1.99,-7.14,;2.55,-5.04,;2.55,-3.5,;3.89,-5.81,;3.89,-7.35,;5.22,-8.12,;5.22,-9.66,;6.56,-10.43,;5.22,-11.2,;3.89,-10.43,;5.22,-5.04,;6.56,-5.81,;7.89,-5.04,;7.89,-3.5,;9.22,-2.73,;6.56,-2.73,;5.22,-3.5,;-1.92,-7.27,;-3.46,-7.27,;-3.94,-5.81,;-5.34,-5.33,;-6.11,-6.66,;-7.65,-6.66,;-8.42,-5.33,;-7.65,-3.99,;-8.42,-2.66,;-6.11,-3.99,)|

BDBM269879

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OCCO)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(1.36,-2.94,;.02,-3.71,;-1.31,-2.94,;-1.36,-1.37,;-2.69,-.6,;-4.03,-1.37,;-4.03,-2.91,;-5.36,-3.68,;-6.69,-2.91,;-2.69,-3.68,;-2.69,-5.22,;-1.45,-6.13,;-.11,-5.36,;1.22,-6.13,;.45,-7.46,;1.99,-7.46,;2.55,-5.36,;2.55,-3.82,;3.89,-6.13,;3.89,-7.67,;5.22,-8.44,;5.22,-9.98,;6.56,-10.75,;5.22,-5.36,;6.56,-6.13,;7.89,-5.36,;7.89,-3.82,;9.22,-3.05,;6.56,-3.05,;5.22,-3.82,;-1.92,-7.59,;-3.46,-7.59,;-3.94,-6.13,;-5.34,-5.64,;-6.11,-6.98,;-7.65,-6.98,;-8.42,-5.64,;-7.65,-4.31,;-8.42,-2.98,;-6.11,-4.31,)|

BDBM269881

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OCC(C)(C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(1.28,-3.3,;-.05,-4.07,;-1.39,-3.3,;-1.44,-1.74,;-2.77,-.97,;-4.1,-1.74,;-4.1,-3.28,;-5.44,-4.05,;-6.77,-3.28,;-2.77,-4.05,;-2.77,-5.77,;-1.52,-6.67,;-.19,-5.9,;1.14,-6.67,;1.91,-8.01,;.37,-8.01,;2.48,-5.9,;2.48,-4.36,;3.81,-6.67,;3.81,-8.21,;5.14,-8.98,;5.14,-10.52,;6.48,-11.29,;5.14,-12.06,;3.81,-11.29,;5.14,-5.9,;5.14,-4.36,;6.48,-3.59,;7.81,-4.36,;9.15,-3.59,;7.81,-5.9,;6.48,-6.67,;-2,-8.14,;-3.54,-8.14,;-4.02,-6.67,;-5.35,-5.9,;-6.12,-7.24,;-7.66,-7.24,;-8.43,-5.9,;-7.66,-4.57,;-8.43,-3.24,;-6.12,-4.57,)|

BDBM269883

COCCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,wD:5.4,(6.48,-13.22,;6.48,-11.68,;5.14,-10.91,;5.14,-9.37,;3.81,-8.6,;3.81,-7.06,;2.48,-6.29,;2.48,-4.75,;1.14,-7.06,;1.91,-8.39,;.37,-8.39,;-.19,-6.29,;-1.52,-7.06,;-2,-8.52,;-3.54,-8.52,;-4.02,-7.06,;-5.35,-6.29,;-6.12,-7.62,;-7.66,-7.62,;-8.43,-6.29,;-7.66,-4.95,;-8.43,-3.62,;-6.12,-4.95,;-2.77,-6.15,;-2.77,-4.43,;-1.39,-3.69,;-.05,-4.46,;1.28,-3.69,;-1.44,-2.12,;-2.77,-1.35,;-4.1,-2.12,;-4.1,-3.66,;-5.44,-4.43,;-6.77,-3.66,;5.14,-6.29,;5.14,-4.75,;6.48,-3.98,;7.81,-4.75,;9.15,-3.98,;7.81,-6.29,;6.48,-7.06,)|

BDBM269884

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OCCO)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,16.17,(-9.97,-9.05,;-8.43,-9.05,;-7.66,-7.71,;-8.43,-6.38,;-7.66,-5.04,;-6.12,-5.04,;-5.35,-6.38,;-6.12,-7.71,;-4.02,-7.15,;-3.54,-8.61,;-2,-8.61,;-1.52,-7.15,;-.19,-6.38,;1.14,-7.15,;1.91,-8.48,;.37,-8.48,;2.48,-6.38,;2.48,-4.84,;3.81,-7.15,;3.81,-8.69,;5.14,-9.46,;5.14,-11,;6.48,-11.77,;5.14,-6.38,;5.14,-4.84,;6.48,-4.07,;7.81,-4.84,;9.15,-4.07,;7.81,-6.38,;6.48,-7.15,;-2.77,-6.24,;-2.77,-4.52,;-1.39,-3.78,;-.05,-4.55,;1.28,-3.78,;-1.44,-2.21,;-2.77,-1.44,;-4.1,-2.21,;-4.1,-3.75,;-5.44,-4.52,;-6.77,-3.75,)|

BDBM269886

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(C=C)c1 |r,wU:16.17,(2,-3.8,;.66,-4.57,;-.67,-3.8,;-.67,-2.26,;-2,-1.49,;-3.34,-2.26,;-3.34,-3.8,;-4.67,-4.57,;-6.01,-3.8,;-2,-4.57,;-2,-6.11,;-.76,-7.02,;.57,-6.25,;1.91,-7.02,;2.68,-8.35,;1.14,-8.35,;3.24,-6.25,;3.24,-4.71,;4.58,-7.02,;5.91,-6.25,;5.91,-4.71,;7.24,-3.94,;8.58,-4.71,;9.91,-3.94,;8.58,-6.25,;7.24,-7.02,;-1.23,-8.48,;-2.77,-8.48,;-3.25,-7.02,;-4.79,-7.02,;-5.56,-8.35,;-7.1,-8.35,;-7.87,-7.02,;-7.1,-5.68,;-7.87,-4.35,;-9.41,-4.35,;-5.56,-5.68,)|

BDBM269888

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(C=C)c1 |r,wD:16.17,(1.99,-3.97,;.66,-4.74,;-.68,-3.97,;-.68,-2.43,;-2.01,-1.66,;-3.34,-2.43,;-3.34,-3.97,;-4.68,-4.74,;-6.01,-3.97,;-2.01,-4.74,;-2.01,-6.28,;-.76,-7.19,;.57,-6.42,;1.9,-7.19,;2.67,-8.52,;1.13,-8.52,;3.24,-6.42,;3.24,-4.88,;4.57,-7.19,;5.9,-6.42,;5.9,-4.88,;7.24,-4.11,;8.57,-4.88,;9.9,-4.11,;8.57,-6.42,;7.24,-7.19,;-1.24,-8.65,;-2.78,-8.65,;-3.26,-7.19,;-4.8,-7.19,;-5.57,-8.52,;-7.11,-8.52,;-7.88,-7.19,;-7.11,-5.85,;-7.88,-4.52,;-9.42,-4.52,;-5.57,-5.85,)|

BDBM269890

CN[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(3.39,-18.18,;4.66,-17.45,;4.66,-15.91,;3.33,-15.14,;3.33,-13.6,;2,-15.91,;1.23,-17.24,;2.77,-17.24,;.66,-15.14,;-.67,-15.91,;-1.15,-17.37,;-2.69,-17.37,;-3.16,-15.91,;-4.7,-15.91,;-5.47,-14.57,;-7.01,-14.57,;-7.78,-15.91,;-7.01,-17.24,;-7.78,-18.57,;-9.32,-18.57,;-5.47,-17.24,;-1.92,-15,;-1.92,-13.46,;-.58,-12.69,;.75,-13.46,;2.08,-12.69,;-.58,-11.15,;-1.92,-10.38,;-3.25,-11.15,;-3.25,-12.69,;-4.58,-13.46,;-5.92,-12.69,;6,-15.14,;7.33,-15.91,;8.66,-15.14,;8.66,-13.6,;10,-12.83,;7.33,-12.83,;6,-13.6,)|

BDBM269892

CN[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(3.32,-18.18,;4.6,-17.45,;4.6,-15.91,;3.26,-15.14,;3.26,-13.6,;1.93,-15.91,;1.16,-17.24,;2.7,-17.24,;.59,-15.14,;-.74,-15.91,;-1.22,-17.37,;-2.76,-17.37,;-3.23,-15.91,;-4.77,-15.91,;-5.54,-14.57,;-7.08,-14.57,;-7.85,-15.91,;-7.08,-17.24,;-7.85,-18.57,;-9.39,-18.57,;-5.54,-17.24,;-1.99,-15,;-1.99,-13.46,;-.65,-12.69,;.68,-13.46,;2.02,-12.69,;-.65,-11.15,;-1.99,-10.38,;-3.32,-11.15,;-3.32,-12.69,;-4.65,-13.46,;-5.99,-12.69,;5.93,-15.14,;7.26,-15.91,;8.6,-15.14,;8.6,-13.6,;9.93,-12.83,;7.26,-12.83,;5.93,-13.6,)|

BDBM269896

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.93,-2.3,;-8.41,-1.9,;-8.81,-.41,;-7.72,.68,;-8.12,2.16,;-6.24,.28,;-3.1,-.7,;-3.1,.84,;-1.77,1.61,;-.44,.84,;.9,1.61,;-1.77,3.15,;-3.1,3.92,;-4.44,3.15,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM269897

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:4.4,3.2,(4.81,-4.69,;4.81,-3.15,;3.48,-2.38,;3.48,-.84,;2.14,-.07,;2.14,1.47,;.81,-.84,;.04,-2.17,;1.58,-2.17,;-.52,-.07,;-1.86,-.84,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.93,-1.53,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-8.12,2.93,;-6.24,1.05,;-3.1,.07,;-3.1,1.61,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-1.77,3.92,;-3.1,4.69,;-4.44,3.92,;-4.44,2.38,;-5.77,1.61,;-7.1,2.38,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,)|

BDBM269898

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:4.4,3.2,(4.81,-4.75,;4.81,-3.21,;3.48,-2.44,;3.48,-.9,;2.14,-.13,;2.14,1.41,;.81,-.9,;.04,-2.24,;1.58,-2.24,;-.52,-.13,;-1.86,-.9,;-2.33,-2.37,;-3.87,-2.37,;-4.35,-.9,;-5.84,-.5,;-6.24,.98,;-7.72,1.38,;-8.81,.29,;-8.41,-1.2,;-6.93,-1.59,;-3.1,0,;-3.5,1.78,;-2.41,2.87,;-1.08,2.1,;.25,2.87,;-2.81,4.35,;-4.3,4.75,;-5.39,3.66,;-4.99,2.18,;-6.48,1.78,;-6.88,3.27,;4.81,-.13,;6.14,-.9,;7.48,-.13,;7.48,1.41,;8.81,2.18,;6.14,2.18,;4.81,1.41,)|

BDBM269899

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:4.4,3.2,(3.83,-5.77,;2.3,-5.93,;1.39,-4.68,;-.14,-4.84,;-1.04,-3.6,;-2.57,-3.76,;-.42,-2.19,;-1.82,-1.56,;.99,-2.81,;.21,-.78,;-.69,.46,;-2.23,.46,;-2.71,1.93,;-1.46,2.83,;-1.46,4.37,;-.13,5.14,;-.13,6.68,;-1.46,7.45,;-2.8,6.68,;-2.8,5.14,;-.22,1.93,;1.25,2.41,;2.39,1.37,;2.07,-.13,;3.21,-1.16,;3.85,1.85,;4.17,3.36,;3.03,4.39,;1.57,3.91,;.42,4.94,;.74,6.45,;-.76,-6.25,;.14,-7.49,;-.48,-8.9,;-2.02,-9.06,;-2.64,-10.47,;-2.92,-7.82,;-2.3,-6.41,)|

BDBM269900

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)C(C)(C)C)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(-7.94,-18.77,;-6.46,-19.17,;-5.37,-18.08,;-5.77,-16.59,;-4.68,-15.5,;-3.19,-15.9,;-2.79,-17.39,;-3.88,-18.48,;-1.3,-17.79,;-.83,-19.25,;.71,-19.25,;1.19,-17.79,;2.52,-17.02,;2.52,-15.48,;3.86,-14.71,;3.86,-13.17,;5.19,-12.4,;2.52,-12.4,;3.86,-11.63,;3.86,-17.79,;4.63,-16.46,;3.09,-19.12,;5.19,-18.56,;5.19,-20.1,;6.52,-17.79,;6.52,-16.25,;7.86,-18.56,;9.19,-17.79,;7.86,-20.1,;9.19,-19.33,;-.06,-16.88,;-.85,-14.53,;.24,-13.44,;1.72,-13.84,;2.81,-12.75,;-.16,-11.95,;-1.65,-11.56,;-2.74,-12.64,;-2.34,-14.13,;-3.43,-15.22,;-4.92,-14.82,)|

BDBM269901

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C(C)(C)C)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.29,-8.35,;-6.8,-8.75,;-5.71,-7.66,;-6.11,-6.17,;-5.02,-5.09,;-3.54,-5.48,;-3.14,-6.97,;-4.23,-8.06,;-1.65,-7.37,;-1.17,-8.84,;.37,-8.84,;.84,-7.37,;2.18,-6.6,;3.51,-7.37,;2.74,-8.7,;4.28,-8.7,;4.84,-6.6,;4.84,-5.06,;6.18,-7.37,;6.18,-8.91,;7.51,-6.6,;8.84,-7.37,;7.51,-5.06,;8.84,-5.83,;-.4,-6.47,;-.4,-4.93,;-1.74,-4.16,;-3.07,-4.93,;-4.4,-4.16,;-1.74,-2.62,;-.4,-1.85,;.93,-2.62,;.93,-4.16,;2.26,-4.93,;3.6,-4.16,)|

BDBM269902

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)C(C)(C)C)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.29,-8.35,;-6.8,-8.75,;-5.71,-7.66,;-6.11,-6.17,;-5.02,-5.09,;-3.54,-5.48,;-3.14,-6.97,;-4.23,-8.06,;-1.65,-7.37,;-1.17,-8.84,;.37,-8.84,;.84,-7.37,;2.18,-6.6,;3.51,-7.37,;2.74,-8.7,;4.28,-8.7,;4.84,-6.6,;4.84,-5.06,;6.18,-7.37,;6.18,-8.91,;7.51,-6.6,;8.84,-7.37,;7.51,-5.06,;8.84,-5.83,;-.4,-6.47,;-.4,-4.93,;-1.74,-4.16,;-3.07,-4.93,;-4.4,-4.16,;-1.74,-2.62,;-.4,-1.85,;.93,-2.62,;.93,-4.16,;2.26,-4.93,;3.6,-4.16,)|

BDBM269905

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)C2CC2)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(-8.18,-21.1,;-6.7,-21.49,;-5.61,-20.41,;-6.01,-18.92,;-4.92,-17.83,;-3.43,-18.23,;-3.03,-19.72,;-4.12,-20.8,;-1.54,-20.11,;-1.07,-21.58,;.47,-21.58,;.95,-20.11,;2.28,-19.34,;2.28,-17.8,;3.62,-17.03,;3.62,-14.41,;2.28,-13.64,;5.23,-13.64,;3.62,-12.88,;3.62,-20.11,;2.85,-21.45,;4.39,-18.78,;4.95,-20.88,;4.95,-22.42,;6.28,-20.11,;6.28,-18.57,;7.62,-20.88,;8.39,-22.22,;9.16,-20.88,;-.3,-19.21,;-1.02,-16.85,;-2.51,-16.46,;-3.6,-17.55,;-5.08,-17.15,;-2.91,-14.97,;-1.82,-13.88,;-.33,-14.28,;.07,-15.77,;1.56,-16.16,;2.65,-15.08,)|

BDBM269906

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.41,-8.33,;-6.92,-8.73,;-5.83,-7.64,;-6.23,-6.16,;-5.14,-5.07,;-3.65,-5.47,;-3.25,-6.95,;-4.34,-8.04,;-1.77,-7.35,;-1.29,-8.82,;.25,-8.82,;.73,-7.35,;2.06,-6.58,;3.39,-7.35,;2.62,-8.69,;4.16,-8.69,;4.73,-6.58,;4.73,-5.04,;6.06,-7.35,;6.06,-8.89,;7.39,-6.58,;8.93,-6.58,;8.16,-5.25,;-.52,-6.45,;-.52,-4.91,;-1.85,-4.14,;-3.19,-4.91,;-4.52,-4.14,;-1.85,-2.6,;-.52,-1.83,;.81,-2.6,;.81,-4.14,;2.15,-4.91,;3.48,-4.14,)|

BDBM269908

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(-9.02,-22.05,;-7.54,-22.45,;-6.45,-21.36,;-6.85,-19.88,;-5.76,-18.79,;-4.27,-19.19,;-3.87,-20.67,;-4.96,-21.76,;-2.38,-21.07,;-1.91,-22.54,;-.37,-22.54,;.11,-21.07,;1.44,-20.3,;1.44,-18.76,;2.78,-17.99,;2.78,-15.37,;1.44,-14.6,;4.39,-14.6,;2.78,-13.83,;2.78,-21.07,;2.01,-22.41,;3.55,-19.74,;4.11,-21.84,;4.11,-23.38,;5.44,-21.07,;5.44,-19.53,;6.78,-21.84,;6.78,-23.38,;8.11,-24.15,;9.44,-23.38,;9.44,-21.84,;8.11,-21.07,;-1.14,-20.17,;-1.86,-17.81,;-3.35,-17.41,;-4.44,-18.5,;-5.93,-18.11,;-3.75,-15.93,;-2.66,-14.84,;-1.17,-15.24,;-.77,-16.72,;.71,-17.12,;1.8,-16.03,)|

BDBM269909

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)|

BDBM269911

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(-8.79,-21.99,;-7.3,-22.39,;-6.21,-21.3,;-6.61,-19.81,;-5.52,-18.72,;-4.03,-19.12,;-3.63,-20.61,;-4.72,-21.7,;-2.15,-21.01,;-1.67,-22.47,;-.13,-22.47,;.35,-21.01,;1.68,-20.24,;1.68,-18.7,;3.01,-17.93,;3.01,-15.3,;1.68,-14.53,;4.63,-14.53,;3.01,-13.77,;3.01,-21.01,;2.24,-22.34,;3.78,-19.67,;4.35,-21.78,;4.35,-23.32,;5.68,-21.01,;5.68,-19.47,;7.01,-21.78,;7.01,-23.32,;8.35,-24.09,;9.68,-23.32,;9.68,-21.78,;8.35,-21.01,;-.9,-20.1,;-1.62,-17.75,;-3.11,-17.35,;-4.2,-18.44,;-5.69,-18.04,;-3.51,-15.86,;-2.42,-14.77,;-.93,-15.17,;-.53,-16.66,;.95,-17.06,;2.04,-15.97,)|

BDBM269912

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.93,-8.38,;-7.44,-8.78,;-6.35,-7.69,;-6.75,-6.2,;-5.66,-5.11,;-4.17,-5.51,;-3.78,-7,;-4.86,-8.09,;-2.29,-7.4,;-1.81,-8.86,;-.27,-8.86,;.2,-7.4,;1.54,-6.63,;2.87,-7.4,;2.1,-8.73,;3.64,-8.73,;4.2,-6.63,;4.2,-5.09,;5.54,-7.4,;5.54,-8.94,;6.87,-6.63,;8.21,-7.4,;9.54,-6.63,;9.54,-5.09,;8.21,-4.32,;6.87,-5.09,;-1.04,-6.49,;-1.04,-4.95,;-2.38,-4.18,;-3.71,-4.95,;-5.04,-4.18,;-2.38,-2.64,;-1.04,-1.87,;.29,-2.64,;.29,-4.18,;1.63,-4.95,;2.96,-4.18,)|

BDBM269913

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.89,-8.11,;-7.41,-8.51,;-6.32,-7.42,;-6.71,-5.94,;-5.63,-4.85,;-4.14,-5.25,;-3.74,-6.73,;-4.83,-7.82,;-2.25,-7.13,;-1.78,-8.6,;-.24,-8.6,;.24,-7.13,;1.57,-6.36,;2.91,-7.13,;3.68,-8.47,;2.14,-8.47,;4.24,-6.36,;4.24,-4.82,;5.57,-7.13,;5.57,-8.67,;6.91,-6.36,;8.24,-7.13,;9.58,-6.36,;9.58,-4.82,;8.24,-4.05,;6.91,-4.82,;-1.01,-6.23,;-1.01,-4.69,;-2.34,-3.92,;-3.67,-4.69,;-5.01,-3.92,;-2.34,-2.38,;-1.01,-1.61,;.33,-2.38,;.33,-3.92,;1.66,-4.69,;2.99,-3.92,)|

BDBM269914

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.92,-8.96,;-7.43,-9.36,;-6.34,-8.27,;-6.74,-6.78,;-5.65,-5.69,;-4.16,-6.09,;-3.76,-7.58,;-4.85,-8.67,;-2.27,-7.98,;-1.8,-9.44,;-.26,-9.44,;.22,-7.98,;1.55,-7.21,;2.88,-7.98,;2.11,-9.31,;3.65,-9.31,;4.22,-7.21,;4.22,-5.67,;5.55,-7.98,;5.55,-9.52,;6.89,-7.21,;8.22,-7.98,;9.55,-7.21,;9.55,-5.67,;8.22,-4.9,;6.89,-5.67,;-1.03,-7.07,;-1.03,-5.53,;-2.36,-4.76,;-3.7,-5.53,;-5.03,-4.76,;-2.36,-3.22,;-1.03,-2.45,;.3,-3.22,;.3,-4.76,;1.64,-5.53,;2.97,-4.76,)|

BDBM269916

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(2.17,-4.02,;1.08,-5.11,;-.4,-4.71,;-.8,-3.23,;-2.29,-2.83,;-3.38,-3.92,;-2.98,-5.4,;-4.07,-6.49,;-5.56,-6.09,;-1.49,-5.8,;-1.09,-7.29,;.37,-7.77,;1.7,-7,;3.04,-7.77,;2.27,-9.1,;4.37,-8.54,;3.81,-6.43,;3.04,-5.1,;5.35,-6.43,;6.12,-7.77,;6.12,-5.1,;7.66,-5.1,;8.43,-3.76,;7.66,-2.43,;8.43,-1.1,;6.12,-2.43,;5.35,-3.76,;.37,-9.31,;-1.09,-9.78,;-2,-8.54,;-3.54,-8.54,;-4.31,-7.2,;-5.85,-7.2,;-6.62,-8.54,;-5.85,-9.87,;-6.62,-11.2,;-4.31,-9.87,)|

BDBM269917

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(1.27,2.13,;.18,1.04,;-1.31,1.44,;-1.71,2.92,;-3.19,3.32,;-4.28,2.23,;-3.88,.75,;-4.97,-.34,;-6.46,.06,;-2.4,.35,;-2,-1.14,;-.53,-1.62,;.8,-.85,;2.13,-1.62,;1.36,-2.95,;3.47,-2.39,;2.9,-.28,;2.13,1.05,;4.44,-.28,;5.21,-1.62,;5.21,1.05,;6.75,1.05,;7.52,2.39,;6.75,3.72,;7.52,5.05,;5.21,3.72,;4.44,2.39,;-.53,-3.16,;-2,-3.63,;-2.9,-2.39,;-4.44,-2.39,;-5.21,-1.05,;-6.75,-1.05,;-7.52,-2.39,;-6.75,-3.72,;-7.52,-5.05,;-5.21,-3.72,)|

BDBM269918

COc1ncccc1-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1cn(C)c2ccccc12 |r,wU:18.19,16.17,(-3.77,2.88,;-5.31,2.88,;-6.08,4.22,;-7.64,4.26,;-8.41,5.6,;-7.64,6.93,;-6.1,6.93,;-5.33,5.6,;-3.79,5.6,;-2.89,4.35,;-1.42,4.83,;-1.42,6.37,;-.09,7.14,;1.24,6.37,;.47,5.03,;2.58,5.6,;2.01,7.7,;1.24,9.04,;3.55,7.7,;4.32,6.37,;4.32,9.04,;5.86,9.04,;6.63,10.37,;5.86,11.7,;6.63,13.04,;4.32,11.7,;3.55,10.37,;-2.89,6.84,;-3.66,8.18,;-2.75,9.42,;-3.66,10.67,;-3.26,12.16,;-5.12,10.19,;-6.46,10.96,;-7.79,10.19,;-7.79,8.65,;-6.46,7.88,;-5.12,8.65,)|

BDBM269919

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wD:18.19,16.17,(2.17,-4.02,;1.08,-5.11,;-.4,-4.71,;-.8,-3.23,;-2.29,-2.83,;-3.38,-3.92,;-2.98,-5.4,;-4.07,-6.49,;-5.56,-6.09,;-1.49,-5.8,;-1.09,-7.29,;.37,-7.77,;1.7,-7,;3.04,-7.77,;2.27,-9.1,;4.37,-8.54,;3.81,-6.43,;3.04,-5.1,;5.35,-6.43,;6.12,-7.77,;6.12,-5.1,;7.66,-5.1,;8.43,-3.76,;7.66,-2.43,;8.43,-1.1,;6.12,-2.43,;5.35,-3.76,;.37,-9.31,;-1.09,-9.78,;-2,-8.54,;-3.54,-8.54,;-4.31,-7.2,;-5.85,-7.2,;-6.62,-8.54,;-5.85,-9.87,;-6.62,-11.2,;-4.31,-9.87,)|

BDBM269920

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wU:18.19,16.17,(1.27,2.13,;.18,1.04,;-1.31,1.44,;-1.71,2.92,;-3.19,3.32,;-4.28,2.23,;-3.88,.75,;-4.97,-.34,;-6.46,.06,;-2.4,.35,;-2,-1.14,;-.53,-1.62,;.8,-.85,;2.13,-1.62,;1.36,-2.95,;3.47,-2.39,;2.9,-.28,;2.13,1.05,;4.44,-.28,;5.21,-1.62,;5.21,1.05,;6.75,1.05,;7.52,2.39,;6.75,3.72,;7.52,5.05,;5.21,3.72,;4.44,2.39,;-.53,-3.16,;-2,-3.63,;-2.9,-2.39,;-4.44,-2.39,;-5.21,-1.05,;-6.75,-1.05,;-7.52,-2.39,;-6.75,-3.72,;-7.52,-5.05,;-5.21,-3.72,)|

BDBM269921

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(Cl)n1 |r,wU:16.17,18.19,(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;1.92,-3.33,;.38,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM269922

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(n1)-c1ccccc1 |r,wU:16.17,18.19,(-5.47,2.43,;-4.14,1.66,;-2.8,2.43,;-2.8,3.97,;-1.47,4.74,;-.14,3.97,;-.14,2.43,;1.2,1.66,;2.53,2.43,;-1.47,1.66,;-1.47,.12,;-.22,-.78,;1.11,-.01,;2.44,-.78,;3.21,-2.12,;1.67,-2.12,;3.78,-.01,;3.78,1.53,;5.11,-.78,;5.11,-2.32,;6.44,-.01,;7.78,-.78,;9.11,-.01,;9.11,1.53,;10.45,2.3,;7.78,2.3,;6.44,1.53,;-.7,-2.25,;-2.24,-2.25,;-2.72,-.78,;-4.2,-.39,;-4.6,1.1,;-6.09,1.5,;-7.18,.41,;-6.78,-1.08,;-5.29,-1.47,;-7.87,-2.16,;-9.36,-1.77,;-10.45,-2.86,;-10.05,-4.34,;-8.56,-4.74,;-7.47,-3.65,)|

BDBM269923

COc1cccc(OC)c1n3c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc3c5cccc(c4ccccc4)[n+]5[O-]

BDBM269924

COc1cccc(OC)c1-n1c(nnc1-c1cncc(C)c1)N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)c1ccc(Cl)cc1S(C)(=O)=O |r,wD:33.36,(-6.33,-4.54,;-4.99,-5.31,;-3.66,-4.54,;-3.66,-3,;-2.33,-2.23,;-.99,-3,;-.99,-4.54,;.34,-5.31,;1.67,-4.54,;-2.33,-5.31,;-2.33,-6.85,;-1.08,-7.76,;-1.56,-9.22,;-3.1,-9.22,;-3.57,-7.76,;-5.06,-7.36,;-5.46,-5.87,;-6.95,-5.47,;-8.04,-6.56,;-7.64,-8.05,;-8.73,-9.14,;-6.15,-8.45,;.25,-6.99,;-.52,-8.32,;.25,-9.65,;-.52,-10.99,;-1.85,-10.22,;.82,-11.76,;-1.29,-12.32,;1.59,-7.76,;2.36,-9.09,;.82,-9.09,;2.92,-6.99,;4.25,-7.76,;4.25,-9.3,;5.59,-6.99,;6.92,-7.76,;8.25,-6.99,;8.25,-5.45,;9.59,-4.68,;6.92,-4.68,;5.59,-5.45,;4.25,-4.68,;2.92,-5.45,;5.02,-3.34,;3.48,-3.34,)|

BDBM269925

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1cncc(C)c1 |r,wD:17.18,(-6.35,-5.82,;-5.02,-6.59,;-3.68,-5.82,;-3.68,-4.28,;-2.35,-3.51,;-1.02,-4.28,;-1.02,-5.82,;.32,-6.59,;1.65,-5.82,;-2.35,-6.59,;-2.35,-8.13,;-1.1,-9.03,;.23,-8.26,;1.56,-9.03,;2.33,-10.36,;.79,-10.36,;2.9,-8.26,;4.23,-9.03,;4.23,-10.57,;5.56,-8.26,;6.9,-9.03,;8.23,-8.26,;8.23,-6.72,;9.56,-5.95,;6.9,-5.95,;5.56,-6.72,;4.23,-5.95,;2.9,-6.72,;5,-4.62,;3.46,-4.62,;-1.58,-10.5,;-3.12,-10.5,;-3.6,-9.03,;-5.08,-8.63,;-5.48,-7.14,;-6.97,-6.75,;-8.06,-7.84,;-7.66,-9.32,;-8.75,-10.41,;-6.17,-9.72,)|

BDBM269927

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)C=C)cc1

BDBM269928

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2[N+]#[C-])nnc1-c1cccc(=O)[nH]1 |(.98,1.79,;-.36,1.02,;-1.69,1.79,;-1.69,3.33,;-3.02,4.1,;-4.36,3.33,;-4.36,1.79,;-5.69,1.02,;-7.03,1.79,;-3.02,1.02,;-3.02,-.52,;-1.78,-1.43,;-.45,-.66,;.89,-1.43,;.12,-2.76,;1.66,-2.76,;2.22,-.66,;3.56,-1.43,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.82,.97,;3.49,1.75,;2.17,2.54,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,)|

BDBM269929

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wD:16.16,18.19,(.75,-4.8,;-.58,-5.57,;-1.91,-4.8,;-1.91,-3.26,;-3.25,-2.49,;-4.58,-3.26,;-4.58,-4.8,;-5.91,-5.57,;-7.25,-4.8,;-3.25,-5.57,;-3.25,-7.11,;-2,-8.02,;-.67,-7.25,;.67,-8.02,;-.1,-9.35,;1.44,-9.35,;2,-7.25,;2,-5.71,;3.33,-4.94,;3.33,-3.4,;4.67,-5.71,;4.67,-7.25,;3.33,-8.02,;6,-8.02,;6,-9.56,;7.34,-10.33,;8.67,-9.56,;10,-10.33,;8.67,-8.02,;7.34,-7.25,;-2.48,-9.48,;-4.02,-9.48,;-4.49,-8.02,;-5.98,-7.62,;-6.38,-6.13,;-7.87,-5.73,;-8.95,-6.82,;-8.56,-8.31,;-9.65,-9.4,;-7.07,-8.71,)|

BDBM269930

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wD:16.16,18.19,(.62,-4.58,;-.71,-5.35,;-2.05,-4.58,;-2.05,-3.04,;-3.38,-2.27,;-4.71,-3.04,;-4.71,-4.58,;-6.05,-5.35,;-7.38,-4.58,;-3.38,-5.35,;-3.38,-6.89,;-2.13,-7.8,;-.8,-7.03,;.53,-7.8,;-.24,-9.13,;1.3,-9.13,;1.87,-7.03,;1.87,-5.49,;3.2,-4.72,;3.2,-3.18,;4.53,-5.49,;4.53,-7.03,;3.2,-7.8,;5.87,-7.8,;5.87,-9.34,;7.2,-10.11,;8.54,-9.34,;9.87,-10.11,;8.54,-7.8,;7.2,-7.03,;-2.61,-9.26,;-4.15,-9.26,;-4.63,-7.8,;-6.11,-7.4,;-6.51,-5.91,;-8,-5.51,;-9.09,-6.6,;-8.69,-8.09,;-9.78,-9.18,;-7.2,-8.49,)|

BDBM269932

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wD:16.16,18.19,(.75,-4.64,;-.58,-5.41,;-1.92,-4.64,;-1.92,-3.1,;-3.25,-2.33,;-4.59,-3.1,;-4.59,-4.64,;-5.92,-5.41,;-7.25,-4.64,;-3.25,-5.41,;-3.25,-6.95,;-2.01,-7.85,;-.67,-7.08,;.66,-7.85,;-.11,-9.19,;1.43,-9.19,;1.99,-7.08,;1.99,-5.54,;3.33,-4.77,;3.33,-3.23,;4.66,-5.54,;4.66,-7.08,;3.33,-7.85,;6,-7.85,;6,-9.39,;7.33,-10.16,;8.66,-9.39,;10,-10.16,;8.66,-7.85,;7.33,-7.08,;-2.48,-9.32,;-4.02,-9.32,;-4.5,-7.85,;-5.99,-7.45,;-6.38,-5.97,;-7.87,-5.57,;-8.96,-6.66,;-8.56,-8.14,;-9.65,-9.23,;-7.07,-8.54,)|

BDBM269933

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.16,(.75,-4.64,;-.58,-5.41,;-1.92,-4.64,;-1.92,-3.1,;-3.25,-2.33,;-4.59,-3.1,;-4.59,-4.64,;-5.92,-5.41,;-7.25,-4.64,;-3.25,-5.41,;-3.25,-6.95,;-2.01,-7.85,;-.67,-7.08,;.66,-7.85,;-.11,-9.19,;1.43,-9.19,;1.99,-7.08,;1.99,-5.54,;3.33,-4.77,;3.33,-3.23,;4.66,-5.54,;4.66,-7.08,;3.33,-7.85,;6,-7.85,;6,-9.39,;7.33,-10.16,;8.66,-9.39,;10,-10.16,;8.66,-7.85,;7.33,-7.08,;-2.48,-9.32,;-4.02,-9.32,;-4.5,-7.85,;-5.99,-7.45,;-6.38,-5.97,;-7.87,-5.57,;-8.96,-6.66,;-8.56,-8.14,;-9.65,-9.23,;-7.07,-8.54,)|

BDBM269934

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wD:16.16,18.19,(.62,-4.64,;-.71,-5.41,;-2.05,-4.64,;-2.05,-3.1,;-3.38,-2.33,;-4.71,-3.1,;-4.71,-4.64,;-6.05,-5.41,;-7.38,-4.64,;-3.38,-5.41,;-3.38,-6.95,;-2.13,-7.85,;-.8,-7.08,;.53,-7.85,;-.24,-9.19,;1.3,-9.19,;1.87,-7.08,;1.87,-5.54,;3.2,-4.77,;3.2,-3.23,;4.53,-5.54,;4.53,-7.08,;3.2,-7.85,;5.87,-7.85,;5.87,-9.39,;7.2,-10.16,;8.54,-9.39,;9.87,-10.16,;8.54,-7.85,;7.2,-7.08,;-2.61,-9.32,;-4.15,-9.32,;-4.63,-7.85,;-6.11,-7.45,;-6.51,-5.97,;-8,-5.57,;-9.09,-6.66,;-8.69,-8.14,;-9.78,-9.23,;-7.2,-8.54,)|

BDBM269935

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wD:16.16,18.19,(-7.17,-2.71,;-5.83,-3.48,;-4.5,-2.71,;-4.5,-1.17,;-3.17,-.4,;-1.83,-1.17,;-1.83,-2.71,;-.5,-3.48,;.84,-2.71,;-3.17,-3.48,;-3.17,-5.02,;-1.92,-5.92,;-.43,-5.53,;.66,-6.62,;-.11,-7.95,;1.43,-7.95,;1.99,-5.85,;1.99,-4.31,;3.32,-3.54,;3.32,-2,;4.66,-4.31,;4.66,-5.85,;3.32,-6.62,;5.99,-6.62,;5.99,-8.16,;7.33,-8.93,;8.66,-8.16,;9.99,-8.93,;8.66,-6.62,;7.33,-5.85,;-2.4,-7.39,;-3.94,-7.39,;-4.41,-5.92,;-5.9,-5.53,;-6.3,-4.04,;-7.78,-3.64,;-8.87,-4.73,;-8.48,-6.22,;-9.56,-7.31,;-6.99,-6.62,)|

BDBM269936

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.16,18.19,(-10.51,-6.68,;-9.03,-7.08,;-7.94,-5.99,;-8.33,-4.5,;-7.25,-3.41,;-5.76,-3.81,;-5.36,-5.3,;-6.45,-6.39,;-3.87,-5.69,;-3.4,-7.16,;-1.86,-7.16,;-1.38,-5.69,;.11,-5.3,;1.2,-6.39,;.43,-7.72,;1.97,-7.72,;2.53,-5.62,;2.53,-4.08,;3.86,-3.31,;3.86,-1.77,;5.2,-4.08,;5.2,-5.62,;3.86,-6.39,;6.53,-6.39,;6.53,-7.93,;7.86,-8.7,;9.2,-7.93,;10.53,-8.7,;9.2,-6.39,;7.86,-5.62,;-2.63,-4.79,;-2.63,-3.25,;-3.96,-2.48,;-5.29,-3.25,;-6.63,-2.48,;-3.96,-.94,;-2.63,-.17,;-1.29,-.94,;-1.29,-2.48,;.04,-3.25,;1.37,-2.48,)|

BDBM269937

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.16,(-10.5,-6.68,;-9.01,-7.08,;-7.92,-5.99,;-8.32,-4.5,;-7.23,-3.41,;-5.75,-3.81,;-5.35,-5.3,;-6.44,-6.39,;-3.86,-5.69,;-3.39,-7.16,;-1.85,-7.16,;-1.37,-5.69,;.12,-5.3,;1.21,-6.39,;.44,-7.72,;1.98,-7.72,;2.54,-5.62,;2.54,-4.08,;3.87,-3.31,;3.87,-1.77,;5.21,-4.08,;5.21,-5.62,;3.87,-6.39,;6.54,-6.39,;6.54,-7.93,;7.88,-8.7,;9.21,-7.93,;10.54,-8.7,;9.21,-6.39,;7.88,-5.62,;-2.62,-4.79,;-2.62,-3.25,;-3.95,-2.48,;-5.28,-3.25,;-6.62,-2.48,;-3.95,-.94,;-2.62,-.17,;-1.28,-.94,;-1.28,-2.48,;.05,-3.25,;1.39,-2.48,)|

BDBM269938

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.16,18.19,(-10.5,-6.79,;-9.01,-7.19,;-7.93,-6.1,;-8.32,-4.62,;-7.24,-3.53,;-5.75,-3.93,;-5.35,-5.41,;-6.44,-6.5,;-3.86,-5.81,;-3.39,-7.28,;-1.85,-7.28,;-1.37,-5.81,;.12,-5.41,;1.21,-6.5,;.44,-7.84,;1.98,-7.84,;2.54,-5.73,;2.54,-4.19,;3.87,-3.42,;3.87,-1.88,;5.21,-4.19,;5.21,-5.73,;3.87,-6.5,;6.54,-6.5,;6.54,-8.04,;7.88,-8.81,;9.21,-8.04,;10.54,-8.81,;9.21,-6.5,;7.88,-5.73,;-2.62,-4.91,;-2.62,-3.37,;-3.95,-2.6,;-5.28,-3.37,;-6.62,-2.6,;-3.95,-1.06,;-2.62,-.29,;-1.28,-1.06,;-1.28,-2.6,;.05,-3.37,;1.39,-2.6,)|

BDBM269939

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.16,18.19,(-10.51,-6.79,;-9.02,-7.19,;-7.93,-6.1,;-8.33,-4.62,;-7.24,-3.53,;-5.75,-3.93,;-5.35,-5.41,;-6.44,-6.5,;-3.86,-5.81,;-3.39,-7.28,;-1.85,-7.28,;-1.37,-5.81,;.11,-5.41,;1.2,-6.5,;.43,-7.84,;1.97,-7.84,;2.54,-5.73,;2.54,-4.19,;3.87,-3.42,;3.87,-1.88,;5.21,-4.19,;5.21,-5.73,;3.87,-6.5,;6.54,-6.5,;6.54,-8.04,;7.87,-8.81,;9.21,-8.04,;10.54,-8.81,;9.21,-6.5,;7.87,-5.73,;-2.62,-4.91,;-2.62,-3.37,;-3.95,-2.6,;-5.29,-3.37,;-6.62,-2.6,;-3.95,-1.06,;-2.62,-.29,;-1.28,-1.06,;-1.28,-2.6,;.05,-3.37,;1.38,-2.6,)|

BDBM269940

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@@H](O)c2ccc(Br)cc2Br)cc1 |r|

BDBM269941

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wD:3.3,2.1,(-3.28,-10.32,;-2.38,-9.07,;-.85,-9.24,;.06,-7.99,;1.59,-8.15,;-.57,-6.58,;-1.97,-7.21,;.84,-5.96,;-1.19,-5.18,;-.29,-3.93,;1.25,-3.93,;1.73,-2.47,;.48,-1.56,;.48,-.02,;-.85,.75,;-.85,2.29,;.48,3.06,;1.82,2.29,;3.15,3.06,;3.15,4.6,;1.82,.75,;-.76,-2.47,;-2.23,-1.99,;-2.55,-.48,;-1.4,.55,;-1.72,2.05,;-4.01,-.01,;-5.16,-1.04,;-4.84,-2.54,;-3.37,-3.02,;-3.05,-4.53,;-4.2,-5.56,;-.22,-10.64,;1.31,-10.8,;1.94,-12.21,;1.03,-13.46,;-.5,-13.29,;-1.12,-11.89,;-2.66,-11.73,;-4.19,-11.57,;1.66,-14.86,;2.29,-16.27,)|

BDBM269943

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wU:2.1,wD:3.3,(-3.28,-10.32,;-2.38,-9.07,;-.85,-9.24,;.06,-7.99,;1.59,-8.15,;-.57,-6.58,;-1.97,-7.21,;.84,-5.96,;-1.19,-5.18,;-.29,-3.93,;1.25,-3.93,;1.73,-2.47,;.48,-1.56,;.48,-.02,;-.85,.75,;-.85,2.29,;.48,3.06,;1.82,2.29,;3.15,3.06,;3.15,4.6,;1.82,.75,;-.76,-2.47,;-2.23,-1.99,;-2.55,-.48,;-1.4,.55,;-1.72,2.05,;-4.01,-.01,;-5.16,-1.04,;-4.84,-2.54,;-3.37,-3.02,;-3.05,-4.53,;-4.2,-5.56,;-.22,-10.64,;1.31,-10.8,;1.94,-12.21,;1.03,-13.46,;-.5,-13.29,;-1.12,-11.89,;-2.66,-11.73,;-4.19,-11.57,;1.66,-14.86,;2.29,-16.27,)|

BDBM269945

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wD:3.3,2.1,(-2.87,-10.26,;-1.96,-9.02,;-.43,-9.18,;.48,-7.93,;2.01,-8.09,;-.15,-6.52,;-1.56,-7.15,;1.26,-5.9,;-.78,-5.12,;.13,-3.87,;1.67,-3.87,;2.14,-2.41,;.9,-1.5,;.9,.04,;-.44,.81,;-.44,2.35,;.9,3.12,;2.23,2.35,;3.56,3.12,;2.23,.81,;-.35,-2.41,;-1.81,-1.93,;-2.13,-.42,;-.99,.61,;-1.31,2.11,;-3.6,.05,;-4.74,-.98,;-4.42,-2.49,;-2.96,-2.96,;-2.64,-4.47,;-3.78,-5.5,;.2,-10.58,;1.73,-10.75,;2.35,-12.15,;1.45,-13.4,;-.08,-13.24,;-.71,-11.83,;-2.24,-11.67,;-3.77,-11.51,;2.08,-14.8,;2.7,-16.21,)|

BDBM269946

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wU:3.3,2.1,(1.87,-10.96,;.96,-9.71,;-.57,-9.87,;-1.47,-8.63,;-3.01,-8.79,;-.85,-7.22,;-2.26,-6.59,;.56,-7.85,;-.22,-5.81,;-1.13,-4.57,;-2.67,-4.57,;-3.14,-3.1,;-1.9,-2.2,;-1.9,-.66,;-.56,.11,;-.56,1.65,;-1.9,2.42,;-3.23,1.65,;-4.56,2.42,;-3.23,.11,;-.65,-3.1,;.81,-2.63,;1.96,-3.66,;1.64,-5.16,;2.78,-6.19,;3.42,-3.18,;3.74,-1.67,;2.6,-.64,;1.13,-1.12,;-.01,-.09,;.31,1.42,;-1.2,-11.28,;-2.73,-11.44,;-3.35,-12.85,;-2.45,-14.09,;-.92,-13.93,;-.29,-12.52,;1.24,-12.36,;2.77,-12.2,;-3.07,-15.5,;-3.7,-16.91,)|

BDBM269948

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)c2ccc(Cl)cc2S(C)(=O)=O)n1-c1c(OC)cccc1OC |r,wD:23.24,(-9.02,-10.12,;-9.42,-8.63,;-8.33,-7.54,;-8.73,-6.05,;-7.64,-4.96,;-6.15,-5.36,;-5.76,-6.85,;-6.84,-7.94,;-4.27,-7.25,;-3.79,-8.71,;-2.25,-8.71,;-1.78,-7.25,;-.44,-6.48,;-1.21,-7.81,;-.44,-9.14,;-1.21,-10.48,;-2.55,-9.71,;.12,-11.25,;-1.98,-11.81,;.89,-7.25,;1.66,-8.58,;.12,-8.58,;2.23,-6.48,;3.56,-7.25,;3.56,-8.79,;4.89,-6.48,;6.23,-7.25,;7.56,-6.48,;7.56,-4.94,;8.89,-4.17,;6.23,-4.17,;4.89,-4.94,;3.56,-4.17,;2.23,-4.94,;2.79,-2.83,;4.33,-2.83,;-3.02,-6.34,;-3.02,-4.8,;-4.36,-4.03,;-5.69,-4.8,;-7.02,-4.03,;-4.36,-2.49,;-3.02,-1.72,;-1.69,-2.49,;-1.69,-4.03,;-.35,-4.8,;.98,-4.03,)|

BDBM269949

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(cc2S(C)(=O)=O)C#N)n1-c1c(OC)cccc1OC |r,wD:17.18,(-9.15,-11.69,;-9.55,-10.2,;-8.46,-9.11,;-8.86,-7.62,;-7.77,-6.53,;-6.28,-6.93,;-5.88,-8.42,;-6.97,-9.51,;-4.39,-8.82,;-3.92,-10.28,;-2.38,-10.28,;-1.9,-8.82,;-.57,-8.05,;.77,-8.82,;1.54,-10.15,;-0,-10.15,;2.1,-8.05,;3.43,-8.82,;3.43,-10.36,;4.77,-8.05,;6.1,-8.82,;7.43,-8.05,;7.43,-6.51,;6.1,-5.74,;4.77,-6.51,;3.43,-5.74,;2.1,-6.51,;2.66,-4.4,;4.2,-4.4,;8.77,-5.74,;10.1,-4.97,;-3.15,-7.91,;-3.15,-6.37,;-4.48,-5.6,;-5.81,-6.37,;-7.15,-5.6,;-4.48,-4.06,;-3.15,-3.29,;-1.81,-4.06,;-1.81,-5.6,;-.48,-6.37,;.85,-5.6,)|

BDBM269951

CO[C@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1S(C)(=O)=O)C#N |r,wD:2.1,(4.74,-10.38,;3.41,-9.61,;3.41,-8.07,;2.07,-7.3,;.74,-8.07,;1.51,-9.4,;-.03,-9.4,;-.59,-7.3,;-1.36,-8.63,;-.59,-9.97,;-1.36,-11.3,;-2.7,-10.53,;-.03,-12.07,;-2.13,-12.64,;-1.93,-8.07,;-2.4,-9.54,;-3.94,-9.54,;-4.42,-8.07,;-5.91,-7.67,;-6.31,-6.18,;-7.79,-5.79,;-8.88,-6.87,;-8.48,-8.36,;-9.57,-9.45,;-9.17,-10.94,;-7,-8.76,;-3.17,-7.17,;-3.17,-5.63,;-4.51,-4.86,;-5.84,-5.63,;-7.17,-4.86,;-4.51,-3.32,;-3.17,-2.55,;-1.84,-3.32,;-1.84,-4.86,;-.51,-5.63,;.83,-4.86,;4.74,-7.3,;6.08,-8.07,;7.41,-7.3,;7.41,-5.76,;6.08,-4.99,;4.74,-5.76,;3.41,-4.99,;2.07,-5.76,;2.64,-3.66,;4.18,-3.66,;8.74,-4.99,;10.08,-4.22,)|

BDBM269952

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1S(C)(=O)=O)C#N |r,wD:2.1,(4.77,-10.95,;3.43,-10.18,;3.43,-8.64,;2.1,-7.87,;.77,-8.64,;1.54,-9.97,;-0,-9.97,;-.57,-7.87,;-1.9,-8.64,;-2.38,-10.11,;-3.92,-10.11,;-4.39,-8.64,;-5.88,-8.24,;-6.28,-6.75,;-7.77,-6.36,;-8.86,-7.44,;-8.46,-8.93,;-9.55,-10.02,;-9.15,-11.51,;-6.97,-9.33,;-3.15,-7.74,;-3.15,-6.2,;-4.48,-5.43,;-5.81,-6.2,;-7.15,-5.43,;-4.48,-3.89,;-3.15,-3.12,;-1.81,-3.89,;-1.81,-5.43,;-.48,-6.2,;.85,-5.43,;4.77,-7.87,;6.1,-8.64,;7.44,-7.87,;7.44,-6.33,;6.1,-5.56,;4.77,-6.33,;3.43,-5.56,;2.1,-6.33,;2.66,-4.23,;4.2,-4.23,;8.77,-5.56,;10.1,-4.79,)|

BDBM269954

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.8,-10.19,;-9.2,-8.7,;-8.11,-7.61,;-8.5,-6.12,;-7.42,-5.04,;-5.93,-5.43,;-5.53,-6.92,;-6.62,-8.01,;-4.04,-7.32,;-3.57,-8.78,;-2.03,-8.78,;-1.55,-7.32,;-.22,-6.55,;1.12,-7.32,;1.89,-8.65,;.35,-8.65,;2.45,-6.55,;3.78,-7.32,;3.78,-8.86,;5.12,-6.55,;6.45,-7.32,;7.79,-6.55,;7.79,-5.01,;9.12,-4.24,;6.45,-4.24,;5.12,-5.01,;-2.8,-6.41,;-2.8,-4.87,;-4.13,-4.1,;-5.46,-4.87,;-6.8,-4.1,;-4.13,-2.56,;-2.8,-1.79,;-1.46,-2.56,;-1.46,-4.1,;-.13,-4.87,;1.2,-4.1,)|

BDBM269956

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(cc2S(C)(=O)=O)C#N)nnc1-c1cncc(C)c1 |r,wU:17.18,(-7.9,6.51,;-6.57,5.74,;-5.23,6.51,;-5.23,8.05,;-3.9,8.82,;-2.56,8.05,;-2.56,6.51,;-1.23,5.74,;.1,6.51,;-3.9,5.74,;-3.9,4.2,;-2.65,3.3,;-1.32,4.07,;.02,3.3,;-.75,1.96,;.79,1.96,;1.35,4.07,;2.68,3.3,;2.68,1.76,;4.02,4.07,;5.35,3.3,;6.68,4.07,;6.73,5.63,;5.35,6.38,;4.02,5.61,;2.68,6.38,;1.35,5.61,;1.91,7.71,;3.45,7.71,;8.07,6.4,;9.4,7.17,;-3.13,1.83,;-4.67,1.83,;-5.14,3.3,;-6.63,3.69,;-7.03,5.18,;-8.52,5.58,;-9.61,4.49,;-9.21,3,;-10.3,1.91,;-7.72,2.6,)|

BDBM269958

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cnc(C)nc2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.8,-9.79,;-9.2,-8.3,;-8.11,-7.21,;-8.5,-5.73,;-7.42,-4.64,;-5.93,-5.04,;-5.53,-6.52,;-6.62,-7.61,;-4.04,-6.92,;-3.57,-8.39,;-2.03,-8.39,;-1.55,-6.92,;-.22,-6.15,;1.12,-6.92,;.35,-8.26,;1.89,-8.26,;2.45,-6.15,;3.78,-6.92,;3.78,-8.46,;5.12,-6.15,;6.45,-6.92,;7.79,-6.15,;7.79,-4.61,;9.12,-3.84,;6.45,-3.84,;5.12,-4.61,;-2.8,-6.02,;-2.8,-4.48,;-4.13,-3.71,;-5.46,-4.48,;-6.8,-3.71,;-4.13,-2.17,;-2.8,-1.4,;-1.46,-2.17,;-1.46,-3.71,;-.13,-4.48,;1.2,-3.71,)|

BDBM269960

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cnc(C)nc2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-8.82,-20.91,;-9.22,-19.43,;-8.13,-18.34,;-8.53,-16.85,;-7.44,-15.76,;-5.96,-16.16,;-5.56,-17.65,;-6.65,-18.74,;-4.07,-18.05,;-3.59,-19.51,;-2.05,-19.51,;-1.58,-18.05,;-.24,-17.28,;1.09,-18.05,;.32,-19.38,;1.86,-19.38,;2.42,-17.28,;2.42,-15.74,;3.76,-18.05,;3.76,-19.59,;5.09,-17.28,;6.42,-18.05,;7.76,-17.28,;7.76,-15.74,;9.09,-14.97,;6.42,-14.97,;5.09,-15.74,;-2.82,-17.14,;-2.82,-15.6,;-4.16,-14.83,;-5.49,-15.6,;-6.82,-14.83,;-4.16,-13.29,;-2.82,-12.52,;-1.49,-13.29,;-1.49,-14.83,;-.16,-15.6,;1.18,-14.83,)|

BDBM269961

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cnc(C)nc2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-8.8,-20.91,;-9.2,-19.43,;-8.11,-18.34,;-8.5,-16.85,;-7.42,-15.76,;-5.93,-16.16,;-5.53,-17.65,;-6.62,-18.74,;-4.04,-18.05,;-3.57,-19.51,;-2.03,-19.51,;-1.55,-18.05,;-.22,-17.28,;1.12,-18.05,;.35,-19.38,;1.89,-19.38,;2.45,-17.28,;2.45,-15.74,;3.78,-18.05,;3.78,-19.59,;5.12,-17.28,;6.45,-18.05,;7.79,-17.28,;7.79,-15.74,;9.12,-14.97,;6.45,-14.97,;5.12,-15.74,;-2.8,-17.14,;-2.8,-15.6,;-4.13,-14.83,;-5.46,-15.6,;-6.8,-14.83,;-4.13,-13.29,;-2.8,-12.52,;-1.46,-13.29,;-1.46,-14.83,;-.13,-15.6,;1.2,-14.83,)|

BDBM269963

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)nc1 |r,wU:3.3,wD:2.1,(5.09,-20.36,;3.76,-19.59,;3.76,-18.05,;2.42,-17.28,;2.42,-15.74,;1.09,-18.05,;.32,-19.38,;1.86,-19.38,;-.24,-17.28,;-1.58,-18.05,;-2.05,-19.51,;-3.59,-19.51,;-4.07,-18.05,;-5.56,-17.65,;-5.96,-16.16,;-7.44,-15.76,;-8.53,-16.85,;-8.13,-18.34,;-9.22,-19.43,;-8.82,-20.91,;-6.65,-18.74,;-2.82,-17.14,;-2.82,-15.6,;-4.16,-14.83,;-5.49,-15.6,;-6.82,-14.83,;-4.16,-13.29,;-2.82,-12.52,;-1.49,-13.29,;-1.49,-14.83,;-.16,-15.6,;1.18,-14.83,;5.09,-17.28,;6.42,-18.05,;7.76,-17.28,;7.76,-15.74,;9.09,-14.97,;6.42,-14.97,;5.09,-15.74,)|

BDBM269964

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)nc1 |r,wU:3.3,wD:2.1,(5.12,-20.36,;3.78,-19.59,;3.78,-18.05,;2.45,-17.28,;2.45,-15.74,;1.12,-18.05,;.35,-19.38,;1.89,-19.38,;-.22,-17.28,;-1.55,-18.05,;-2.03,-19.51,;-3.57,-19.51,;-4.04,-18.05,;-5.53,-17.65,;-5.93,-16.16,;-7.42,-15.76,;-8.5,-16.85,;-8.11,-18.34,;-9.2,-19.43,;-8.8,-20.91,;-6.62,-18.74,;-2.8,-17.14,;-2.8,-15.6,;-4.13,-14.83,;-5.46,-15.6,;-6.8,-14.83,;-4.13,-13.29,;-2.8,-12.52,;-1.46,-13.29,;-1.46,-14.83,;-.13,-15.6,;1.2,-14.83,;5.12,-17.28,;6.45,-18.05,;7.79,-17.28,;7.79,-15.74,;9.12,-14.97,;6.45,-14.97,;5.12,-15.74,)|

BDBM269968

COc1cccc(OC)c1-n1c(NS(=O)(=O)C(\C)=C(/C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM269969

COc1cccc(n1)-c1nnc(NS(=O)(=O)C(\C)=C(/C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |(-8.76,-4.2,;-9.16,-2.71,;-8.07,-1.62,;-8.47,-.13,;-7.38,.96,;-5.89,.56,;-5.49,-.93,;-6.58,-2.02,;-4,-1.33,;-3.53,-2.79,;-1.99,-2.79,;-1.51,-1.33,;-.18,-.56,;1.15,-1.33,;.38,-2.66,;1.92,-2.66,;2.49,-.56,;2.49,.98,;3.82,-1.33,;3.82,-2.87,;5.16,-.56,;6.49,-1.33,;7.82,-.56,;7.82,.98,;9.16,1.75,;6.49,1.75,;5.16,.98,;-2.76,-.42,;-2.76,1.12,;-4.09,1.89,;-5.43,1.12,;-6.76,1.89,;-4.09,3.43,;-2.76,4.2,;-1.42,3.43,;-1.42,1.89,;-.09,1.12,;1.24,1.89,)|

BDBM269970

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM269971

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.76,-4.2,;-9.16,-2.71,;-8.07,-1.62,;-8.47,-.13,;-7.38,.96,;-5.89,.56,;-5.49,-.93,;-6.58,-2.02,;-4,-1.33,;-3.53,-2.79,;-1.99,-2.79,;-1.51,-1.33,;-.18,-.56,;1.15,-1.33,;.38,-2.66,;1.92,-2.66,;2.49,-.56,;2.49,.98,;3.82,-1.33,;3.82,-2.87,;5.16,-.56,;6.49,-1.33,;7.82,-.56,;7.82,.98,;9.16,1.75,;6.49,1.75,;5.16,.98,;-2.76,-.42,;-2.76,1.12,;-4.09,1.89,;-5.43,1.12,;-6.76,1.89,;-4.09,3.43,;-2.76,4.2,;-1.42,3.43,;-1.42,1.89,;-.09,1.12,;1.24,1.89,)|

BDBM269972

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(C)nc2OC)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.39,-9.74,;-8.79,-8.25,;-7.7,-7.16,;-8.1,-5.67,;-7.01,-4.58,;-5.53,-4.98,;-5.13,-6.47,;-6.22,-7.56,;-3.64,-6.87,;-3.16,-8.33,;-1.62,-8.33,;-1.15,-6.87,;.19,-6.1,;1.52,-6.87,;.75,-8.2,;2.29,-8.2,;2.85,-6.1,;2.85,-4.56,;4.19,-6.87,;4.19,-8.41,;5.52,-6.1,;5.52,-4.56,;6.85,-3.79,;8.19,-4.56,;9.52,-3.79,;8.19,-6.1,;6.85,-6.87,;6.85,-8.41,;8.19,-9.18,;-2.39,-5.96,;-2.39,-4.42,;-3.73,-3.65,;-5.06,-4.42,;-6.4,-3.65,;-3.73,-2.11,;-2.39,-1.34,;-1.06,-2.11,;-1.06,-3.65,;.27,-4.42,;1.61,-3.65,)|

BDBM269974

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)c2ncc(C)nc2OC)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.39,-9.74,;-8.79,-8.25,;-7.7,-7.16,;-8.1,-5.67,;-7.01,-4.58,;-5.53,-4.98,;-5.13,-6.47,;-6.22,-7.56,;-3.64,-6.87,;-3.16,-8.33,;-1.62,-8.33,;-1.15,-6.87,;.19,-6.1,;1.52,-6.87,;.75,-8.2,;2.29,-8.2,;2.85,-6.1,;2.85,-4.56,;4.19,-6.87,;4.19,-8.41,;5.52,-6.1,;5.52,-4.56,;6.85,-3.79,;8.19,-4.56,;9.52,-3.79,;8.19,-6.1,;6.85,-6.87,;6.85,-8.41,;8.19,-9.18,;-2.39,-5.96,;-2.39,-4.42,;-3.73,-3.65,;-5.06,-4.42,;-6.4,-3.65,;-3.73,-2.11,;-2.39,-1.34,;-1.06,-2.11,;-1.06,-3.65,;.27,-4.42,;1.61,-3.65,)|

BDBM269976

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)nc1OC |r,wD:3.3,2.1,(5.64,-9.21,;4.31,-8.44,;4.31,-6.9,;2.98,-6.13,;2.98,-4.59,;1.64,-6.9,;.87,-8.24,;2.41,-8.24,;.31,-6.13,;-1.03,-6.9,;-1.5,-8.37,;-3.04,-8.37,;-3.52,-6.9,;-5,-6.51,;-5.4,-5.02,;-6.89,-4.62,;-7.98,-5.71,;-7.58,-7.2,;-8.67,-8.29,;-8.27,-9.77,;-6.09,-7.6,;-2.27,-6,;-2.27,-4.46,;-3.61,-3.69,;-4.94,-4.46,;-6.27,-3.69,;-3.61,-2.15,;-2.27,-1.38,;-.94,-2.15,;-.94,-3.69,;.4,-4.46,;1.73,-3.69,;5.64,-6.13,;5.64,-4.59,;6.98,-3.82,;8.31,-4.59,;9.64,-3.82,;8.31,-6.13,;6.98,-6.9,;6.98,-8.44,;8.31,-9.21,)|

BDBM269977

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)nc1OC |r,wU:3.3,wD:2.1,(5.64,-9.21,;4.31,-8.44,;4.31,-6.9,;2.98,-6.13,;2.98,-4.59,;1.64,-6.9,;.87,-8.24,;2.41,-8.24,;.31,-6.13,;-1.03,-6.9,;-1.5,-8.37,;-3.04,-8.37,;-3.52,-6.9,;-5,-6.51,;-5.4,-5.02,;-6.89,-4.62,;-7.98,-5.71,;-7.58,-7.2,;-8.67,-8.29,;-8.27,-9.77,;-6.09,-7.6,;-2.27,-6,;-2.27,-4.46,;-3.61,-3.69,;-4.94,-4.46,;-6.27,-3.69,;-3.61,-2.15,;-2.27,-1.38,;-.94,-2.15,;-.94,-3.69,;.4,-4.46,;1.73,-3.69,;5.64,-6.13,;5.64,-4.59,;6.98,-3.82,;8.31,-4.59,;9.64,-3.82,;8.31,-6.13,;6.98,-6.9,;6.98,-8.44,;8.31,-9.21,)|

BDBM269979

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)nc1OC |r,wD:3.3,2.1,(5.52,-9.21,;4.18,-8.44,;4.18,-6.9,;2.85,-6.13,;2.85,-4.59,;1.51,-6.9,;.74,-8.24,;2.28,-8.24,;.18,-6.13,;-1.15,-6.9,;-1.63,-8.37,;-3.17,-8.37,;-3.64,-6.9,;-5.13,-6.51,;-5.53,-5.02,;-7.02,-4.62,;-8.11,-5.71,;-7.71,-7.2,;-8.8,-8.29,;-8.4,-9.77,;-6.22,-7.6,;-2.4,-6,;-2.4,-4.46,;-3.73,-3.69,;-5.07,-4.46,;-6.4,-3.69,;-3.73,-2.15,;-2.4,-1.38,;-1.07,-2.15,;-1.07,-3.69,;.27,-4.46,;1.6,-3.69,;5.52,-6.13,;5.52,-4.59,;6.85,-3.82,;8.18,-4.59,;9.52,-3.82,;8.18,-6.13,;6.85,-6.9,;6.85,-8.44,;8.18,-9.21,)|

BDBM269980

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)nc1OC |r,wU:2.1,wD:3.3,(5.52,-9.21,;4.18,-8.44,;4.18,-6.9,;2.85,-6.13,;2.85,-4.59,;1.51,-6.9,;.74,-8.24,;2.28,-8.24,;.18,-6.13,;-1.15,-6.9,;-1.63,-8.37,;-3.17,-8.37,;-3.64,-6.9,;-5.13,-6.51,;-5.53,-5.02,;-7.02,-4.62,;-8.11,-5.71,;-7.71,-7.2,;-8.8,-8.29,;-8.4,-9.77,;-6.22,-7.6,;-2.4,-6,;-2.4,-4.46,;-3.73,-3.69,;-5.07,-4.46,;-6.4,-3.69,;-3.73,-2.15,;-2.4,-1.38,;-1.07,-2.15,;-1.07,-3.69,;.27,-4.46,;1.6,-3.69,;5.52,-6.13,;5.52,-4.59,;6.85,-3.82,;8.18,-4.59,;9.52,-3.82,;8.18,-6.13,;6.85,-6.9,;6.85,-8.44,;8.18,-9.21,)|

BDBM269982

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(Cl)s2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.13,-9.77,;-8.53,-8.29,;-7.44,-7.2,;-7.84,-5.71,;-6.75,-4.62,;-5.26,-5.02,;-4.86,-6.51,;-5.95,-7.6,;-3.38,-6.9,;-2.9,-8.37,;-1.36,-8.37,;-.88,-6.9,;.45,-6.13,;1.78,-6.9,;1.01,-8.24,;2.55,-8.24,;3.12,-6.13,;4.45,-6.9,;4.45,-8.44,;5.78,-6.13,;5.78,-4.59,;7.25,-4.12,;8.15,-5.36,;9.49,-6.13,;7.25,-6.61,;-2.13,-6,;-2.13,-4.46,;-3.46,-3.69,;-4.8,-4.46,;-6.13,-3.69,;-3.46,-2.15,;-2.13,-1.38,;-.8,-2.15,;-.8,-3.69,;.54,-4.46,;1.87,-3.69,)|

BDBM269983

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(Cl)s2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.26,-9.77,;-8.66,-8.29,;-7.57,-7.2,;-7.97,-5.71,;-6.88,-4.62,;-5.39,-5.02,;-4.99,-6.51,;-6.08,-7.6,;-3.5,-6.9,;-3.03,-8.37,;-1.49,-8.37,;-1.01,-6.9,;.32,-6.13,;1.66,-6.9,;.89,-8.24,;2.43,-8.24,;2.99,-6.13,;4.32,-6.9,;4.32,-8.44,;5.66,-6.13,;5.66,-4.59,;7.12,-4.12,;8.03,-5.36,;9.36,-6.13,;7.12,-6.61,;-2.26,-6,;-2.26,-4.46,;-3.59,-3.69,;-4.92,-4.46,;-6.26,-3.69,;-3.59,-2.15,;-2.26,-1.38,;-.92,-2.15,;-.92,-3.69,;.41,-4.46,;1.74,-3.69,)|

BDBM269984

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(Cl)s2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.85,-9.43,;-9.25,-7.94,;-8.16,-6.85,;-8.55,-5.37,;-7.47,-4.28,;-5.98,-4.68,;-5.58,-6.16,;-6.67,-7.25,;-4.09,-6.56,;-3.62,-8.03,;-2.08,-8.03,;-1.6,-6.56,;-.27,-5.79,;1.07,-6.56,;1.84,-7.9,;.3,-7.9,;2.4,-5.79,;3.73,-6.56,;3.73,-8.1,;5.07,-5.79,;5.07,-4.25,;6.53,-3.78,;7.44,-5.02,;8.77,-5.79,;6.53,-6.27,;-2.85,-5.66,;-2.85,-4.12,;-4.18,-3.35,;-5.51,-4.12,;-6.85,-3.35,;-4.18,-1.81,;-2.85,-1.04,;-1.51,-1.81,;-1.51,-3.35,;-.18,-4.12,;1.15,-3.35,)|

BDBM269985

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wD:2.1,(5.04,-8.87,;3.71,-8.1,;3.71,-6.56,;2.37,-5.79,;1.04,-6.56,;1.81,-7.9,;.27,-7.9,;-.29,-5.79,;-1.63,-6.56,;-2.1,-8.03,;-3.64,-8.03,;-4.12,-6.56,;-5.61,-6.16,;-6,-4.68,;-7.49,-4.28,;-8.58,-5.37,;-8.18,-6.85,;-9.27,-7.94,;-8.87,-9.43,;-6.7,-7.25,;-2.87,-5.66,;-2.87,-4.12,;-4.21,-3.35,;-5.54,-4.12,;-6.87,-3.35,;-4.21,-1.81,;-2.87,-1.04,;-1.54,-1.81,;-1.54,-3.35,;-.21,-4.12,;1.13,-3.35,;5.04,-5.79,;5.04,-4.25,;6.51,-3.78,;7.41,-5.02,;8.74,-5.79,;6.51,-6.27,)|

BDBM269986

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wD:2.1,(5.07,-8.87,;3.73,-8.1,;3.73,-6.56,;2.4,-5.79,;1.07,-6.56,;1.84,-7.9,;.3,-7.9,;-.27,-5.79,;-1.6,-6.56,;-2.08,-8.03,;-3.62,-8.03,;-4.09,-6.56,;-5.58,-6.16,;-5.98,-4.68,;-7.47,-4.28,;-8.55,-5.37,;-8.16,-6.85,;-9.25,-7.94,;-8.85,-9.43,;-6.67,-7.25,;-2.85,-5.66,;-2.85,-4.12,;-4.18,-3.35,;-5.51,-4.12,;-6.85,-3.35,;-4.18,-1.81,;-2.85,-1.04,;-1.51,-1.81,;-1.51,-3.35,;-.18,-4.12,;1.15,-3.35,;5.07,-5.79,;5.07,-4.25,;6.53,-3.78,;7.44,-5.02,;8.77,-5.79,;6.53,-6.27,)|

BDBM269988

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)ccnc1OC |r,wU:16.17,18.19,(-8.49,-10.33,;-8.89,-8.85,;-7.8,-7.76,;-8.2,-6.27,;-7.11,-5.18,;-5.62,-5.58,;-5.22,-7.07,;-6.31,-8.15,;-3.74,-7.46,;-3.26,-8.93,;-1.72,-8.93,;-1.24,-7.46,;.09,-6.69,;1.42,-7.46,;.65,-8.8,;2.19,-8.8,;2.76,-6.69,;2.76,-5.15,;4.09,-7.46,;4.09,-9,;5.43,-6.69,;6.76,-7.46,;8.09,-6.69,;8.09,-5.15,;9.43,-4.38,;6.76,-4.38,;5.43,-5.15,;-2.49,-6.56,;-2.49,-5.02,;-3.82,-4.25,;-5.16,-5.02,;-6.49,-4.25,;-3.82,-2.71,;-2.49,-1.94,;-1.16,-2.71,;-1.16,-4.25,;.18,-5.02,;1.51,-4.25,)|

BDBM269989

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cc[nH]c1=O |r,wU:18.19,16.17,(-8.92,-10.62,;-9.31,-9.13,;-8.23,-8.04,;-8.62,-6.56,;-7.53,-5.47,;-6.05,-5.87,;-5.65,-7.35,;-6.74,-8.44,;-4.16,-7.75,;-3.69,-9.22,;-2.15,-9.22,;-1.67,-7.75,;-.34,-6.98,;1,-7.75,;1.77,-9.09,;.23,-9.09,;2.33,-6.98,;2.33,-5.44,;3.67,-7.75,;3.67,-9.29,;5,-6.98,;6.33,-7.75,;7.67,-6.98,;7.67,-5.44,;9,-4.67,;6.33,-4.67,;5,-5.44,;-2.92,-6.85,;-2.92,-5.31,;-4.25,-4.54,;-5.58,-5.31,;-6.92,-4.54,;-4.25,-3,;-2.92,-2.23,;-1.58,-3,;-1.58,-4.54,;-.25,-5.31,)|

BDBM269990

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cc[nH]c1=O |r,wU:18.19,16.17,(-8.89,-10.62,;-9.29,-9.13,;-8.2,-8.04,;-8.6,-6.56,;-7.51,-5.47,;-6.02,-5.87,;-5.62,-7.35,;-6.71,-8.44,;-4.13,-7.75,;-3.66,-9.22,;-2.12,-9.22,;-1.64,-7.75,;-.31,-6.98,;1.02,-7.75,;1.79,-9.09,;.25,-9.09,;2.36,-6.98,;2.36,-5.44,;3.69,-7.75,;3.69,-9.29,;5.03,-6.98,;6.36,-7.75,;7.69,-6.98,;7.69,-5.44,;9.03,-4.67,;6.36,-4.67,;5.03,-5.44,;-2.89,-6.85,;-2.89,-5.31,;-4.22,-4.54,;-5.56,-5.31,;-6.89,-4.54,;-4.22,-3,;-2.89,-2.23,;-1.56,-3,;-1.56,-4.54,;-.22,-5.31,)|

BDBM269992

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@@H](O)c2ccc(Cl)cn2)cc1 |r|

BDBM269993

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:2.1,3.3,(3.82,1.06,;2.48,1.83,;2.48,3.37,;1.15,4.14,;1.15,5.68,;-.18,3.37,;.59,2.04,;-.95,2.04,;-1.52,4.14,;-2.85,3.37,;-3.33,1.91,;-4.87,1.91,;-5.34,3.37,;-6.83,3.77,;-7.23,5.26,;-8.72,5.66,;-9.8,4.57,;-9.41,3.08,;-7.92,2.68,;-4.1,4.28,;-4.1,5.82,;-5.43,6.59,;-6.76,5.82,;-8.1,6.59,;-5.43,8.13,;-4.1,8.9,;-2.76,8.13,;-2.76,6.59,;-1.43,5.82,;-.1,6.59,;3.82,4.14,;3.82,5.68,;5.15,6.45,;6.49,5.68,;7.82,6.45,;6.49,4.14,;5.15,3.37,)|

BDBM269995

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:2.1,3.3,(3.93,1.06,;2.59,1.83,;2.59,3.37,;1.26,4.14,;1.26,5.68,;-.07,3.37,;.7,2.04,;-.84,2.04,;-1.41,4.14,;-2.74,3.37,;-3.22,1.91,;-4.76,1.91,;-5.23,3.37,;-6.72,3.77,;-7.12,5.26,;-8.61,5.66,;-9.69,4.57,;-9.3,3.08,;-10.39,1.99,;-7.81,2.68,;-3.99,4.28,;-3.99,5.82,;-5.32,6.59,;-6.65,5.82,;-7.99,6.59,;-5.32,8.13,;-3.99,8.9,;-2.65,8.13,;-2.65,6.59,;-1.32,5.82,;.01,6.59,;3.93,4.14,;3.93,5.68,;5.26,6.45,;6.6,5.68,;7.93,6.45,;6.6,4.14,;5.26,3.37,)|

BDBM269996

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:2.1,3.3,(4.16,1.06,;2.83,1.83,;2.83,3.37,;1.5,4.14,;1.5,5.68,;.16,3.37,;.93,2.04,;-.61,2.04,;-1.17,4.14,;-2.51,3.37,;-2.98,1.91,;-4.52,1.91,;-5,3.37,;-6.48,3.77,;-6.88,5.26,;-8.37,5.66,;-9.46,4.57,;-9.06,3.08,;-10.15,1.99,;-7.57,2.68,;-3.75,4.28,;-3.75,5.82,;-5.08,6.59,;-6.42,5.82,;-7.75,6.59,;-5.08,8.13,;-3.75,8.9,;-2.42,8.13,;-2.42,6.59,;-1.08,5.82,;.25,6.59,;4.16,4.14,;4.16,5.68,;5.5,6.45,;6.83,5.68,;8.16,6.45,;6.83,4.14,;5.5,3.37,)|

BDBM269997

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(4.92,-9.19,;3.59,-8.42,;3.59,-6.88,;2.25,-6.11,;2.25,-4.57,;.92,-6.88,;1.69,-8.21,;.15,-8.21,;-.42,-6.11,;-1.75,-6.88,;-2.22,-8.34,;-3.76,-8.34,;-4.24,-6.88,;-5.73,-6.48,;-6.13,-4.99,;-7.61,-4.59,;-8.7,-5.68,;-8.3,-7.17,;-9.39,-8.26,;-6.82,-7.57,;-2.99,-5.97,;-2.99,-4.43,;-4.33,-3.66,;-5.66,-4.43,;-7,-3.66,;-4.33,-2.12,;-2.99,-1.35,;-1.66,-2.12,;-1.66,-3.66,;-.33,-4.43,;1.01,-3.66,;4.92,-6.11,;4.92,-4.57,;6.25,-3.8,;7.59,-4.57,;8.92,-3.8,;7.59,-6.11,;6.25,-6.88,)|

BDBM269998

CO[C@@H]([C@H](C)S(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.91,-4.44,;3.58,-3.67,;3.58,-2.13,;2.25,-1.36,;2.25,.18,;.91,-2.13,;1.68,-3.46,;-.42,-2.9,;-.42,-1.36,;-.02,.13,;1.47,.53,;1.86,2.01,;.78,3.1,;3.63,2.41,;3.23,.92,;-1.96,-1.36,;-2.44,-2.83,;-3.98,-2.83,;-4.45,-1.36,;-5.94,-.96,;-7.03,-2.05,;-8.52,-1.65,;-8.92,-.16,;-7.83,.92,;-8.22,2.41,;-6.34,.53,;-3.21,-.46,;-3.79,1.47,;-5.27,1.86,;-6.76,1.47,;-7.85,2.55,;-5.67,3.35,;-4.58,4.44,;-3.1,4.04,;-2.7,2.55,;-1.21,2.16,;-.12,3.24,;4.91,-1.36,;6.25,-2.13,;7.58,-1.36,;7.58,.18,;8.92,.95,;6.25,.95,;4.91,.18,)|

BDBM269999

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@](C)(F)c2ncc(cn2)C#N)nnc1-c1cncc(C)c1 |r,wU:16.17,18.20,wD:18.19,(-6.16,-17.31,;-4.67,-17.71,;-3.58,-16.62,;-3.98,-15.13,;-2.89,-14.04,;-1.4,-14.44,;-1.01,-15.93,;.48,-16.33,;1.57,-15.24,;-2.09,-17.02,;-1.17,-19.85,;.08,-20.76,;1.41,-19.99,;2.75,-20.76,;1.98,-22.09,;4.08,-21.53,;3.52,-19.42,;2.75,-18.09,;5.06,-19.42,;5.06,-20.96,;5.83,-20.76,;5.83,-18.09,;7.37,-18.09,;8.14,-16.76,;7.37,-15.42,;5.83,-15.42,;5.06,-16.76,;8.14,-14.09,;8.91,-12.75,;-.4,-22.22,;-1.94,-22.22,;-2.41,-20.76,;-3.9,-20.36,;-4.3,-18.87,;-5.79,-18.47,;-6.87,-19.56,;-6.48,-21.05,;-7.57,-22.14,;-4.99,-21.45,)|

BDBM270001

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-6.16,-17.31,;-4.67,-17.71,;-3.58,-16.62,;-3.98,-15.13,;-2.89,-14.04,;-1.4,-14.44,;-1.01,-15.93,;.48,-16.33,;1.57,-15.24,;-2.09,-17.02,;-1.17,-19.85,;.08,-20.76,;1.41,-19.99,;2.75,-20.76,;1.98,-22.09,;4.08,-21.53,;3.52,-19.42,;2.75,-18.09,;5.06,-19.42,;5.06,-20.96,;5.83,-18.09,;7.37,-18.09,;8.14,-16.76,;7.37,-15.42,;8.14,-14.09,;5.83,-15.42,;5.06,-16.76,;-.4,-22.22,;-1.94,-22.22,;-2.41,-20.76,;-3.9,-20.36,;-4.3,-18.87,;-5.79,-18.47,;-6.87,-19.56,;-6.48,-21.05,;-7.57,-22.14,;-4.99,-21.45,)|

BDBM270002

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,wD:2.1,(2.27,-10.76,;3.6,-9.99,;3.6,-8.45,;2.51,-7.36,;2.91,-5.88,;1.03,-7.76,;-.06,-8.85,;1.42,-9.25,;-.06,-6.67,;-1.55,-7.07,;-2.03,-8.54,;-3.57,-8.54,;-4.04,-7.07,;-5.53,-6.67,;-6.62,-7.76,;-8.11,-7.36,;-8.5,-5.88,;-7.42,-4.79,;-7.81,-3.3,;-5.93,-5.19,;-2.8,-6.17,;-2.8,-4.27,;-4.13,-3.5,;-5.46,-4.27,;-6.8,-3.5,;-4.13,-1.96,;-2.8,-1.19,;-1.46,-1.96,;-1.46,-3.5,;-.13,-4.27,;1.2,-3.5,;5.09,-8.05,;6.18,-9.14,;7.67,-8.74,;8.07,-7.26,;9.55,-6.86,;6.98,-6.17,;5.49,-6.57,)|

BDBM270004

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(cn1)C#N |r,wU:3.3,wD:2.1,(6.39,-21.73,;5.06,-20.96,;5.06,-19.42,;3.52,-19.42,;2.75,-18.09,;2.75,-20.76,;1.98,-22.09,;4.08,-21.53,;1.41,-19.99,;.08,-20.76,;-.4,-22.22,;-1.94,-22.22,;-2.41,-20.76,;-3.9,-20.36,;-4.3,-18.87,;-5.79,-18.47,;-6.87,-19.56,;-6.48,-21.05,;-7.57,-22.14,;-9.05,-21.74,;-4.99,-21.45,;-1.17,-19.85,;-2.09,-17.02,;-3.58,-16.62,;-4.67,-17.71,;-6.16,-17.31,;-3.98,-15.13,;-2.89,-14.04,;-1.4,-14.44,;-1.01,-15.93,;.48,-16.33,;1.57,-15.24,;5.83,-18.09,;7.37,-18.09,;8.14,-16.76,;7.37,-15.42,;5.83,-15.42,;5.06,-16.76,;8.14,-14.09,;8.91,-12.75,)|

BDBM270005

COc1cccc(n1)-c1nnc(NS(=O)(=O)CCc2ccc(Br)cn2)n1-c1c(OC)cccc1OC |(-10,2.26,;-10.4,3.75,;-9.31,4.84,;-9.71,6.33,;-8.62,7.42,;-7.13,7.02,;-6.73,5.53,;-7.82,4.44,;-5.25,5.13,;-4.77,3.67,;-3.23,3.67,;-2.75,5.13,;-1.27,5.53,;-.18,4.44,;-1.27,3.35,;.91,3.35,;.91,5.53,;2.4,5.13,;3.49,6.22,;4.97,5.82,;6.06,6.91,;5.66,8.4,;6.75,9.49,;4.18,8.8,;3.09,7.71,;-4,6.04,;-4,7.58,;-5.33,8.35,;-6.67,7.58,;-8,8.35,;-5.33,9.89,;-4,10.66,;-2.67,9.89,;-2.67,8.35,;-1.33,7.58,;0,8.35,)|

BDBM270006

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cn1)C#N |r,wU:3.3,wD:2.1,(4.81,-9.41,;3.32,-9.01,;2.92,-7.52,;1.43,-7.12,;1.03,-5.64,;.34,-8.21,;-.75,-9.3,;1.43,-9.3,;-.75,-7.12,;-2.23,-7.52,;-2.71,-8.99,;-4.25,-8.99,;-4.72,-7.52,;-6.21,-7.12,;-7.3,-8.21,;-8.79,-7.81,;-9.19,-6.33,;-8.1,-5.24,;-8.5,-3.75,;-6.61,-5.64,;-3.48,-6.62,;-3.48,-4.72,;-4.81,-3.95,;-6.15,-4.72,;-7.48,-3.95,;-4.81,-2.41,;-3.48,-1.64,;-2.14,-2.41,;-2.14,-3.95,;-.81,-4.72,;.52,-3.95,;4.01,-6.43,;3.61,-4.94,;4.7,-3.86,;6.19,-4.25,;6.59,-5.74,;5.5,-6.83,;7.28,-3.17,;8.37,-2.08,)|

BDBM270010

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.04,-21.28,;5.81,-19.95,;5.04,-18.62,;3.5,-18.62,;2.73,-17.28,;2.73,-19.95,;1.96,-21.28,;4.07,-20.72,;1.4,-19.18,;.07,-19.95,;.07,-21.49,;-1.4,-21.97,;-2.3,-20.72,;-3.84,-20.72,;-4.61,-19.39,;-6.15,-19.39,;-6.92,-20.72,;-6.15,-22.05,;-6.92,-23.39,;-4.61,-22.05,;-1.4,-19.48,;-1.91,-17.63,;-3.39,-17.23,;-4.48,-18.32,;-5.97,-17.92,;-3.79,-15.74,;-2.7,-14.65,;-1.22,-15.05,;-.82,-16.54,;.67,-16.94,;1.76,-15.85,;5.81,-17.28,;7.35,-17.28,;8.12,-15.95,;7.35,-14.62,;8.12,-13.28,;5.81,-14.62,;5.04,-15.95,)|

BDBM270014

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-5.74,-5.54,;-4.26,-5.94,;-3.17,-4.85,;-3.56,-3.36,;-2.48,-2.27,;-.99,-2.67,;-.59,-4.16,;.9,-4.56,;1.99,-3.47,;-1.68,-5.25,;-1.17,-7.1,;.29,-7.57,;1.63,-6.8,;2.96,-7.57,;2.19,-8.9,;4.29,-8.34,;3.73,-6.24,;2.96,-4.9,;5.27,-6.24,;6.04,-7.57,;6.04,-4.9,;7.58,-4.9,;8.35,-3.57,;7.58,-2.24,;8.35,-.9,;6.04,-2.24,;5.27,-3.57,;.29,-9.11,;-1.17,-9.59,;-2.08,-8.34,;-3.62,-8.34,;-4.39,-7.01,;-5.93,-7.01,;-6.7,-8.34,;-5.93,-9.67,;-6.7,-11.01,;-4.39,-9.67,)|

BDBM270016

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:4.4,3.2,(-3.07,-11.93,;-1.54,-12.09,;-.63,-10.85,;.9,-11.01,;1.8,-9.76,;3.33,-9.92,;1.18,-8.35,;-.23,-8.98,;2.58,-7.73,;.55,-6.95,;1.46,-5.7,;3,-5.7,;3.47,-4.24,;2.23,-3.33,;2.23,-1.79,;3.56,-1.02,;3.56,.52,;2.23,1.29,;.89,.52,;-.44,1.29,;.89,-1.02,;.98,-4.24,;-.48,-3.76,;-.81,-2.25,;.34,-1.22,;.02,.28,;-2.27,-1.78,;-3.41,-2.81,;-3.09,-4.32,;-1.63,-4.79,;-1.31,-6.3,;-2.45,-7.33,;1.52,-12.41,;3.06,-12.57,;3.68,-13.98,;2.78,-15.23,;3.4,-16.63,;1.25,-15.07,;.62,-13.66,)|

BDBM270017

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:4.4,3.2,(-3.07,-11.41,;-1.54,-11.57,;-.63,-10.32,;.9,-10.48,;1.8,-9.24,;3.33,-9.4,;1.18,-7.83,;-.23,-8.46,;2.58,-7.2,;.55,-6.42,;1.46,-5.18,;3,-5.18,;3.47,-3.71,;2.23,-2.81,;2.23,-1.27,;3.56,-.5,;3.56,1.04,;2.23,1.81,;.89,1.04,;-.44,1.81,;.89,-.5,;.98,-3.71,;-.48,-3.24,;-.81,-1.73,;.34,-.7,;.02,.81,;-2.27,-1.26,;-3.41,-2.29,;-3.09,-3.79,;-1.63,-4.27,;-1.31,-5.77,;-2.45,-6.8,;1.52,-11.89,;3.06,-12.05,;3.68,-13.46,;2.78,-14.7,;3.4,-16.11,;1.25,-14.54,;.62,-13.14,)|

BDBM270018

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cnc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-6.01,-4.77,;-4.52,-5.17,;-3.43,-4.08,;-3.83,-2.6,;-2.74,-1.51,;-1.25,-1.91,;-.85,-3.39,;.63,-3.79,;1.72,-2.7,;-1.94,-4.48,;-1.11,-6.93,;.35,-7.4,;1.69,-6.63,;3.02,-7.4,;2.25,-8.74,;4.36,-8.17,;3.79,-6.07,;3.02,-4.74,;5.33,-6.07,;6.1,-7.4,;6.1,-4.74,;7.64,-4.74,;8.41,-3.4,;7.64,-2.07,;8.41,-.73,;6.1,-2.07,;5.33,-3.4,;.35,-8.94,;-1.11,-9.42,;-2.02,-8.17,;-3.5,-7.77,;-3.9,-6.29,;-5.39,-5.89,;-6.48,-6.98,;-6.08,-8.46,;-7.17,-9.55,;-4.59,-8.86,)|

BDBM270020

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:3.3,2.1,(5.33,-8.74,;6.1,-7.4,;5.33,-6.07,;3.79,-6.07,;3.02,-4.74,;3.02,-7.4,;2.25,-8.74,;4.36,-8.17,;1.69,-6.63,;.35,-7.4,;.35,-8.94,;-1.11,-9.42,;-2.02,-8.17,;-3.5,-7.77,;-3.9,-6.29,;-5.39,-5.89,;-6.48,-6.98,;-6.08,-8.46,;-7.17,-9.55,;-4.59,-8.86,;-1.11,-6.93,;-1.94,-4.48,;-3.43,-4.08,;-4.52,-5.17,;-6.01,-4.77,;-3.83,-2.6,;-2.74,-1.51,;-1.25,-1.91,;-.85,-3.39,;.63,-3.79,;1.72,-2.7,;6.1,-4.74,;7.64,-4.74,;8.41,-3.4,;7.64,-2.07,;8.41,-.73,;6.1,-2.07,;5.33,-3.4,)|

BDBM270022

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:3.3,2.1,(5.33,-8.74,;6.1,-7.4,;5.33,-6.07,;3.79,-6.07,;3.02,-4.74,;3.02,-7.4,;2.25,-8.74,;4.36,-8.17,;1.69,-6.63,;.35,-7.4,;.35,-8.94,;-1.11,-9.42,;-2.02,-8.17,;-3.5,-7.77,;-3.9,-6.29,;-5.39,-5.89,;-6.48,-6.98,;-6.08,-8.46,;-7.17,-9.55,;-8.66,-9.16,;-4.59,-8.86,;-1.11,-6.93,;-1.94,-4.48,;-3.43,-4.08,;-4.52,-5.17,;-6.01,-4.77,;-3.83,-2.6,;-2.74,-1.51,;-1.25,-1.91,;-.85,-3.39,;.63,-3.79,;1.72,-2.7,;6.1,-4.74,;7.64,-4.74,;8.41,-3.4,;7.64,-2.07,;8.41,-.73,;6.1,-2.07,;5.33,-3.4,)|

BDBM270024

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.66,-9.16,;-7.17,-9.55,;-6.08,-8.46,;-6.48,-6.98,;-5.39,-5.89,;-3.9,-6.29,;-3.5,-7.77,;-4.59,-8.86,;-2.02,-8.17,;-1.11,-9.42,;.35,-8.94,;.35,-7.4,;1.69,-6.63,;3.02,-7.4,;2.25,-8.74,;4.36,-8.17,;3.79,-6.07,;3.02,-4.74,;5.33,-6.07,;6.1,-7.4,;6.1,-4.74,;7.64,-4.74,;8.41,-3.4,;7.64,-2.07,;8.41,-.73,;6.1,-2.07,;5.33,-3.4,;-1.11,-6.93,;-1.94,-4.48,;-3.43,-4.08,;-4.52,-5.17,;-6.01,-4.77,;-3.83,-2.6,;-2.74,-1.51,;-1.25,-1.91,;-.85,-3.39,;.63,-3.79,;1.72,-2.7,)|

BDBM270026

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:3.3,2.1,(5.26,-9.87,;6.03,-8.53,;5.26,-7.2,;3.72,-7.2,;2.95,-5.87,;2.95,-8.53,;2.18,-9.87,;4.28,-9.3,;1.62,-7.76,;.28,-8.53,;.28,-10.07,;-1.18,-10.55,;-2.09,-9.3,;-3.57,-8.91,;-4.66,-9.99,;-6.15,-9.6,;-6.55,-8.11,;-5.46,-7.02,;-3.97,-7.42,;-1.18,-8.06,;-2.01,-5.61,;-3.5,-5.22,;-4.59,-6.3,;-6.08,-5.91,;-3.9,-3.73,;-2.81,-2.64,;-1.32,-3.04,;-.92,-4.53,;.56,-4.92,;1.65,-3.84,;6.03,-5.87,;7.57,-5.87,;8.34,-4.53,;7.57,-3.2,;8.34,-1.87,;6.03,-3.2,;5.26,-4.53,)|

BDBM270027

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-8.5,-21.53,;-7.01,-21.93,;-5.92,-20.84,;-6.32,-19.36,;-5.23,-18.27,;-3.74,-18.67,;-3.35,-20.15,;-4.43,-21.24,;-1.86,-20.55,;-.95,-21.8,;.51,-21.32,;.51,-19.78,;1.85,-19.01,;3.18,-19.78,;2.41,-21.12,;4.51,-20.55,;3.95,-18.45,;3.18,-17.11,;5.49,-18.45,;6.26,-19.78,;6.26,-17.11,;7.8,-17.11,;8.57,-15.78,;7.8,-14.45,;8.57,-13.11,;6.26,-14.45,;5.49,-15.78,;-.95,-19.31,;-1.78,-16.86,;-3.27,-16.46,;-4.36,-17.55,;-5.85,-17.15,;-3.67,-14.98,;-2.58,-13.89,;-1.09,-14.29,;-.7,-15.77,;.79,-16.17,;1.88,-15.08,)|

BDBM270028

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(C)cn2)nnc1-c1cccnc1 |r,wD:16.17,18.19,(-6.97,.3,;-5.49,-.1,;-4.4,.99,;-4.79,2.48,;-3.71,3.57,;-2.22,3.17,;-1.82,1.68,;-.33,1.28,;.76,2.37,;-2.91,.59,;-2.08,-1.85,;-.61,-2.33,;.72,-1.56,;2.05,-2.33,;1.28,-3.66,;3.39,-3.1,;2.82,-.99,;2.05,.34,;4.36,-.99,;5.13,-2.33,;5.13,.34,;6.67,.34,;7.44,1.67,;6.67,3.01,;7.44,4.34,;5.13,3.01,;4.36,1.67,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-5.56,-3.79,;-7.05,-3.39,;-7.44,-1.9,;-6.36,-.81,;-4.87,-1.21,)|

BDBM270029

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(-6.97,.3,;-5.49,-.1,;-4.4,.99,;-4.79,2.48,;-3.71,3.57,;-2.22,3.17,;-1.82,1.68,;-.33,1.28,;.76,2.37,;-2.91,.59,;-2.08,-1.85,;-.61,-2.33,;.72,-1.56,;2.05,-2.33,;1.28,-3.66,;3.39,-3.1,;2.82,-.99,;2.05,.34,;4.36,-.99,;5.13,-2.33,;5.13,.34,;6.67,.34,;7.44,1.67,;6.67,3.01,;7.44,4.34,;5.13,3.01,;4.36,1.67,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-5.56,-3.79,;-7.05,-3.39,;-7.44,-1.9,;-6.36,-.81,;-4.87,-1.21,)|

BDBM270030

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:4.4,3.2,(3.48,.48,;1.95,.31,;1.04,1.56,;-.49,1.4,;-1.4,2.65,;-2.93,2.48,;-.77,4.05,;-2.18,4.68,;.64,3.43,;-.14,5.46,;-1.05,6.7,;-2.59,6.7,;-3.06,8.17,;-1.82,9.07,;-1.82,10.61,;-.48,11.38,;-.48,12.92,;-1.82,13.69,;-3.15,12.92,;-4.49,13.69,;-5.82,12.92,;-3.15,11.38,;-.57,8.17,;.89,8.65,;2.04,7.61,;1.72,6.11,;2.86,5.08,;3.5,8.09,;3.82,9.6,;2.68,10.63,;1.21,10.15,;.07,11.18,;.39,12.69,;-1.12,-.01,;-.21,-1.25,;-.84,-2.66,;-2.37,-2.82,;-3,-4.23,;-3.27,-1.58,;-2.65,-.17,)|

BDBM270032

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-2.61,-5.95,;-1.7,-4.71,;-.17,-4.87,;.74,-3.62,;2.27,-3.78,;.11,-2.21,;-1.3,-2.84,;1.52,-1.59,;-.52,-.81,;.39,.44,;1.93,.44,;2.4,1.9,;1.16,2.81,;1.16,4.35,;2.49,5.12,;2.49,6.66,;1.16,7.43,;-.18,6.66,;-.18,5.12,;-.09,1.9,;-1.55,2.38,;-1.87,3.89,;-.73,4.92,;-1.05,6.42,;-3.34,4.36,;-4.48,3.33,;-4.16,1.83,;-2.7,1.35,;-2.38,-.16,;-3.52,-1.19,;.46,-6.27,;1.99,-6.43,;2.61,-7.84,;1.71,-9.09,;2.34,-10.49,;.18,-8.93,;-.45,-7.52,)|

BDBM270033

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(-2.61,-5.95,;-1.7,-4.71,;-.17,-4.87,;.74,-3.62,;2.27,-3.78,;.11,-2.21,;-1.3,-2.84,;1.52,-1.59,;-.52,-.81,;.39,.44,;1.93,.44,;2.4,1.9,;1.16,2.81,;1.16,4.35,;2.49,5.12,;2.49,6.66,;1.16,7.43,;-.18,6.66,;-.18,5.12,;-.09,1.9,;-1.55,2.38,;-1.87,3.89,;-.73,4.92,;-1.05,6.42,;-3.34,4.36,;-4.48,3.33,;-4.16,1.83,;-2.7,1.35,;-2.38,-.16,;-3.52,-1.19,;.46,-6.27,;1.99,-6.43,;2.61,-7.84,;1.71,-9.09,;2.34,-10.49,;.18,-8.93,;-.45,-7.52,)|

BDBM270034

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,wD:3.3,(-3.39,.65,;-2.48,1.89,;-.95,1.73,;-.04,2.98,;1.49,2.82,;-.67,4.39,;-2.08,3.76,;.74,5.01,;-1.3,5.79,;-.39,7.04,;1.15,7.04,;1.62,8.5,;.38,9.41,;.38,10.95,;1.71,11.72,;1.71,13.26,;.38,14.03,;-.95,13.26,;-.95,11.72,;-.87,8.5,;-2.33,8.98,;-2.65,10.49,;-1.51,11.52,;-1.83,13.02,;-4.12,10.96,;-5.26,9.93,;-4.94,8.42,;-3.48,7.95,;-3.16,6.44,;-4.3,5.41,;-.32,.33,;1.21,.17,;1.84,-1.24,;.93,-2.49,;1.56,-3.89,;-.6,-2.33,;-1.23,-.92,)|

BDBM270035

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,wD:2.1,(-1.92,-12.55,;-1.02,-11.3,;.51,-11.47,;1.42,-10.22,;2.95,-10.38,;.79,-8.81,;-.61,-9.44,;2.2,-8.19,;.17,-7.41,;1.07,-6.16,;2.61,-6.16,;3.09,-4.7,;1.84,-3.79,;1.84,-2.25,;3.18,-1.48,;3.18,.06,;1.84,.83,;.51,.06,;.51,-1.48,;.6,-4.7,;-.87,-4.22,;-1.19,-2.71,;-.04,-1.68,;-.37,-.18,;-2.65,-2.24,;-3.8,-3.27,;-3.48,-4.77,;-2.01,-5.25,;-1.69,-6.76,;-2.84,-7.79,;1.14,-12.87,;2.67,-13.03,;3.3,-14.44,;2.39,-15.69,;3.02,-17.09,;.86,-15.53,;.23,-14.12,)|

BDBM270036

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,wD:2.1,(-1.89,-23.6,;-.99,-22.35,;.54,-22.51,;1.45,-21.27,;2.98,-21.43,;.82,-19.86,;-.58,-20.48,;2.23,-19.23,;.2,-18.45,;1.1,-17.21,;2.64,-17.21,;3.12,-15.74,;1.87,-14.84,;1.87,-13.3,;.54,-12.53,;.54,-10.99,;1.87,-10.22,;3.21,-10.99,;4.54,-10.22,;4.54,-8.68,;3.21,-12.53,;.63,-15.74,;-.84,-15.27,;-1.16,-13.76,;-.01,-12.73,;-.33,-11.22,;-2.62,-13.28,;-3.77,-14.31,;-3.45,-15.82,;-1.98,-16.3,;-1.66,-17.8,;-2.81,-18.83,;1.17,-23.92,;2.7,-24.08,;3.33,-25.49,;2.42,-26.73,;3.05,-28.14,;.89,-26.57,;.27,-25.16,)|

BDBM270040

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:4.4,3.2,(4.81,-11.06,;3.28,-11.23,;2.37,-9.98,;.84,-10.14,;-.07,-8.89,;-1.6,-9.06,;.56,-7.49,;-.85,-6.86,;1.97,-8.11,;1.19,-6.08,;.28,-4.84,;-1.26,-4.84,;-1.73,-3.37,;-.49,-2.47,;-.49,-.93,;.85,-.16,;.85,1.38,;-.49,2.15,;-1.82,1.38,;-1.82,-.16,;.76,-3.37,;2.22,-2.89,;3.37,-3.93,;3.05,-5.43,;4.19,-6.46,;4.83,-3.45,;5.15,-1.94,;4.01,-.91,;2.54,-1.39,;1.4,-.36,;1.72,1.15,;.21,-11.55,;1.12,-12.79,;.49,-14.2,;-1.04,-14.36,;-1.67,-15.77,;-1.95,-13.12,;-1.32,-11.71,)|

BDBM270042

CCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,wD:4.4,(4.51,-17.86,;2.98,-18.03,;2.08,-16.78,;.55,-16.94,;-.36,-15.69,;-1.89,-15.86,;.27,-14.29,;-1.14,-13.66,;1.67,-14.91,;.89,-12.88,;-.01,-11.64,;-1.55,-11.64,;-2.03,-10.17,;-.78,-9.27,;-.78,-7.73,;.55,-6.96,;.55,-5.42,;-.78,-4.65,;-2.12,-5.42,;-2.12,-6.96,;.46,-10.17,;1.93,-9.69,;3.07,-10.73,;2.75,-12.23,;3.9,-13.26,;4.54,-10.25,;4.86,-8.74,;3.71,-7.71,;2.25,-8.19,;1.1,-7.16,;1.42,-5.65,;-.08,-18.35,;.82,-19.59,;.2,-21,;-1.33,-21.16,;-1.96,-22.57,;-2.24,-19.92,;-1.61,-18.51,)|

BDBM270045

CCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,wD:4.4,(4.61,-18,;3.08,-18.16,;2.17,-16.91,;.64,-17.07,;-.26,-15.83,;-1.79,-15.99,;.36,-14.42,;-1.04,-13.79,;1.77,-15.04,;.99,-13.01,;.08,-11.77,;-1.46,-11.77,;-1.93,-10.3,;-.69,-9.4,;-.69,-7.86,;-2.02,-7.09,;-2.02,-5.55,;-.69,-4.78,;.65,-5.55,;1.98,-4.78,;.65,-7.09,;.56,-10.3,;2.02,-9.83,;3.17,-10.86,;2.85,-12.36,;3.99,-13.39,;4.63,-10.38,;4.95,-8.87,;3.81,-7.84,;2.34,-8.32,;1.2,-7.29,;1.52,-5.78,;.02,-18.48,;.92,-19.72,;.29,-21.13,;-1.24,-21.29,;-1.86,-22.7,;-2.14,-20.05,;-1.52,-18.64,)|

BDBM270046

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:4.4,3.2,(-3.63,-6.15,;-2.1,-6.31,;-1.2,-5.06,;.34,-5.22,;1.24,-3.98,;2.77,-4.14,;.61,-2.57,;-.79,-3.2,;2.02,-1.94,;-.01,-1.16,;.89,.08,;2.43,.08,;2.91,1.55,;1.66,2.45,;1.66,3.99,;.33,4.76,;.33,6.3,;1.66,7.07,;3,6.3,;4.33,7.07,;3,4.76,;.42,1.55,;-1.05,2.02,;-1.37,3.53,;-.22,4.56,;-.54,6.07,;-2.83,4.01,;-3.98,2.98,;-3.66,1.47,;-2.19,.99,;-1.87,-.51,;-3.02,-1.54,;.96,-6.63,;2.49,-6.79,;3.12,-8.2,;2.21,-9.44,;2.84,-10.85,;.68,-9.28,;.06,-7.87,)|

BDBM270047

CCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:4.4,wD:3.2,(-2.71,-23.71,;-1.18,-23.87,;-.28,-22.62,;1.26,-22.78,;2.16,-21.54,;3.69,-21.7,;1.53,-20.13,;.13,-20.76,;2.94,-19.5,;.91,-18.72,;1.81,-17.48,;3.35,-17.48,;3.83,-16.01,;2.58,-15.11,;2.58,-13.57,;1.25,-12.8,;1.25,-11.26,;2.58,-10.49,;3.92,-11.26,;5.25,-10.49,;3.92,-12.8,;1.34,-16.01,;-.13,-15.54,;-.45,-14.03,;.7,-13,;.38,-11.49,;-1.91,-13.55,;-3.06,-14.58,;-2.74,-16.09,;-1.27,-16.57,;-.95,-18.07,;-2.1,-19.1,;1.88,-24.19,;3.41,-24.35,;4.04,-25.76,;3.14,-27,;3.76,-28.41,;1.6,-26.84,;.98,-25.43,)|

BDBM270049

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cnc(C)cn2)nnc1-c1cccnc1 |r,wU:18.19,16.17,(-6.52,3.37,;-5.19,2.6,;-3.86,3.37,;-3.86,4.91,;-2.52,5.68,;-1.19,4.91,;-1.19,3.37,;.14,2.6,;1.48,3.37,;-2.52,2.6,;-2.52,.59,;-1.28,-.31,;.06,.46,;1.15,-.63,;2.23,.46,;.06,-1.72,;2.23,-1.72,;1.84,-3.21,;3.72,-1.32,;4.12,.16,;4.81,-2.41,;4.41,-3.9,;5.5,-4.99,;6.99,-4.59,;8.08,-5.68,;7.39,-3.1,;6.3,-2.01,;-1.75,-1.78,;-3.29,-1.78,;-3.77,-.31,;-5.1,.46,;-5.5,1.94,;-6.99,2.34,;-8.08,1.25,;-7.68,-.24,;-6.19,-.63,)|

BDBM270050

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cnc(C)cn2)nnc1-c1cccnc1 |r,wD:18.19,16.17,(-6.52,3.37,;-5.19,2.6,;-3.86,3.37,;-3.86,4.91,;-2.52,5.68,;-1.19,4.91,;-1.19,3.37,;.14,2.6,;1.48,3.37,;-2.52,2.6,;-2.52,.59,;-1.28,-.31,;.06,.46,;1.15,-.63,;2.23,.46,;.06,-1.72,;2.23,-1.72,;1.84,-3.21,;3.72,-1.32,;4.12,.16,;4.81,-2.41,;4.41,-3.9,;5.5,-4.99,;6.99,-4.59,;8.08,-5.68,;7.39,-3.1,;6.3,-2.01,;-1.75,-1.78,;-3.29,-1.78,;-3.77,-.31,;-5.1,.46,;-5.5,1.94,;-6.99,2.34,;-8.08,1.25,;-7.68,-.24,;-6.19,-.63,)|

BDBM270051

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1cccnc1 |r,wU:18.19,16.17,(-5.6,-6.44,;-4.27,-7.21,;-2.94,-6.44,;-2.94,-4.9,;-1.6,-4.13,;-.27,-4.9,;-.27,-6.44,;1.06,-7.21,;2.4,-6.44,;-1.6,-7.21,;-1.6,-9.22,;-.36,-10.12,;.98,-9.35,;2.31,-10.12,;3.64,-10.89,;.98,-10.89,;3.64,-9.35,;3.64,-7.81,;4.98,-10.12,;4.98,-11.66,;6.31,-9.35,;6.31,-7.81,;7.65,-7.04,;8.98,-7.81,;10.31,-7.04,;8.98,-9.35,;7.65,-10.12,;-.83,-11.59,;-2.37,-11.59,;-2.85,-10.12,;-4.18,-9.35,;-4.95,-8.02,;-6.49,-8.02,;-7.26,-9.35,;-6.49,-10.69,;-4.95,-10.69,)|

BDBM270052

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wU:16.17,(-7.03,1.79,;-5.69,1.02,;-4.36,1.79,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;.98,1.79,;-3.02,1.02,;-3.02,-.52,;-1.78,-1.43,;-.45,-.66,;.89,-1.43,;.12,-2.76,;1.66,-2.76,;2.22,-.66,;2.22,.88,;3.56,-1.43,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,)|

BDBM270055

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1cncc(C)c1 |(-7.03,1.99,;-5.69,1.22,;-4.36,1.99,;-4.36,3.53,;-3.02,4.3,;-1.69,3.53,;-1.69,1.99,;-.36,1.22,;.98,1.99,;-3.02,1.22,;-3.02,-.32,;-1.78,-1.22,;-.45,-.45,;.89,-1.22,;1.66,-2.56,;.12,-2.56,;2.22,-.45,;3.56,-1.22,;4.89,-.45,;4.89,1.09,;6.22,1.86,;7.56,1.09,;8.89,1.86,;7.56,-.45,;6.22,-1.28,;6.22,-2.82,;6.22,-4.36,;-2.25,-2.69,;-3.79,-2.69,;-4.27,-1.22,;-5.81,-1.22,;-6.58,-2.56,;-8.12,-2.56,;-8.89,-1.22,;-8.12,.11,;-8.89,1.44,;-6.58,.11,)|

BDBM270056

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-6.52,3.5,;-5.19,2.73,;-3.86,3.5,;-3.86,5.04,;-2.52,5.81,;-1.19,5.04,;-1.19,3.5,;.14,2.73,;1.48,3.5,;-2.52,2.73,;-2.52,.46,;-1.28,-.44,;.06,.33,;1.15,-.76,;2.23,.33,;.06,-1.85,;2.23,-1.85,;1.84,-3.34,;3.72,-1.45,;4.12,.04,;4.81,-2.54,;4.41,-4.03,;5.5,-5.12,;6.99,-4.72,;8.08,-5.81,;7.39,-3.23,;6.3,-2.14,;-1.75,-1.91,;-3.29,-1.91,;-3.77,-.44,;-5.1,.33,;-6.19,-.76,;-7.68,-.36,;-8.08,1.13,;-6.99,2.22,;-7.39,3.7,;-5.5,1.82,)|

BDBM270057

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2Br)cc1 |r|

BDBM270058

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccnc1 |r,wD:16.17,18.19,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;1.58,-2.17,;.04,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;6.14,-2.38,;4.81,-4.69,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.93,-1.53,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-6.24,1.05,)|

BDBM270059

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccnc1 |r,wU:16.17,wD:18.19,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;1.58,-2.17,;.04,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;6.14,-2.38,;4.81,-4.69,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.93,-1.53,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-6.24,1.05,)|

BDBM270062

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.67,-2.33,;5.13,-2.33,;4.36,-.99,;2.82,-.99,;2.05,.34,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;.72,-1.56,;-.61,-2.33,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,;-2.08,-1.85,;-2.62,.26,;-4.1,.66,;-5.19,-.43,;-6.68,-.03,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;5.13,.34,;6.67,.34,;7.44,1.67,;6.67,3.01,;7.44,4.34,;5.13,3.01,;4.36,1.67,)|

BDBM270063

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.67,-2.33,;5.13,-2.33,;4.36,-.99,;2.82,-.99,;2.05,.34,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;.72,-1.56,;-.61,-2.33,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,;-2.08,-1.85,;-2.62,.26,;-4.1,.66,;-5.19,-.43,;-6.68,-.03,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;5.13,.34,;6.67,.34,;7.44,1.67,;6.67,3.01,;7.44,4.34,;5.13,3.01,;4.36,1.67,)|

BDBM270064

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1nc(C)cs1 |r,wU:3.3,2.1,(5.73,-4.99,;4.4,-4.22,;4.4,-2.68,;3.06,-1.91,;3.06,-.37,;1.73,-2.68,;.4,-3.45,;2.5,-4.01,;.96,-1.34,;-.58,-1.34,;-1.48,-2.59,;-2.95,-2.11,;-2.95,-.57,;-4.04,.27,;-3.64,1.75,;-4.73,2.84,;-6.22,2.44,;-6.61,.96,;-8.1,.56,;-5.53,-.13,;-1.48,-.1,;-.84,2.01,;-1.93,3.1,;-3.41,2.7,;-4.5,3.79,;-1.53,4.59,;-.04,4.99,;1.05,3.9,;.65,2.41,;1.74,1.32,;3.23,1.72,;5.73,-1.91,;5.73,-.37,;7.2,.11,;7.97,1.44,;8.1,-1.14,;7.2,-2.38,)|

BDBM270065

COc1cccc(OC)c1-n1c(nn(C)\c1=N/S(=O)(=O)[C@@H](C)[C@H](C)c1ncc(C)cn1)-c1cncc(C)c1 |r,wU:20.22,22.24,(2.02,-2.73,;.93,-3.81,;-.56,-3.42,;-.96,-1.93,;-2.44,-1.53,;-3.53,-2.62,;-3.14,-4.11,;-4.22,-5.19,;-5.71,-4.8,;-1.65,-4.5,;-.92,-7.21,;-1.83,-8.45,;-.92,-9.7,;.54,-9.22,;1.88,-9.99,;.54,-7.68,;1.88,-6.91,;3.21,-7.68,;2.44,-9.02,;4.54,-8.45,;3.98,-6.35,;3.21,-5.02,;5.52,-6.35,;6.29,-7.68,;6.29,-5.02,;5.52,-3.68,;6.29,-2.35,;7.83,-2.35,;8.6,-1.02,;8.6,-3.68,;7.83,-5.02,;-3.32,-8.05,;-3.71,-6.57,;-5.2,-6.17,;-6.29,-7.26,;-5.89,-8.75,;-6.98,-9.83,;-4.4,-9.14,)|

BDBM270066

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)o1 |r,wU:3.3,2.1,(4.99,-4.99,;3.65,-4.22,;3.65,-2.68,;2.32,-1.91,;2.32,-.37,;.99,-2.68,;-.35,-3.45,;1.76,-4.01,;.22,-1.34,;-1.32,-1.34,;-2.23,-2.59,;-3.69,-2.11,;-3.69,-.57,;-4.78,.27,;-4.38,1.75,;-5.47,2.84,;-6.96,2.44,;-7.36,.96,;-8.85,.56,;-6.27,-.13,;-2.23,-.1,;-1.58,2.01,;-2.67,3.1,;-4.16,2.7,;-5.25,3.79,;-2.27,4.59,;-.78,4.99,;.31,3.9,;-.09,2.41,;1,1.32,;2.48,1.72,;4.99,-1.91,;4.99,-.37,;6.45,.11,;7.36,-1.14,;8.85,-1.54,;6.45,-2.38,)|

BDBM270070

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)ccnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.46,-4.99,;4.13,-4.22,;4.13,-2.68,;2.79,-1.91,;2.79,-.37,;1.46,-2.68,;.13,-3.45,;2.23,-4.01,;.69,-1.34,;-.85,-1.34,;-1.76,-2.59,;-3.22,-2.11,;-3.22,-.57,;-4.31,.27,;-3.91,1.75,;-5,2.84,;-6.49,2.44,;-6.89,.96,;-8.37,.56,;-9.46,1.65,;-5.8,-.13,;-1.76,-.1,;-1.11,2.01,;.38,2.41,;1.47,1.32,;2.96,1.72,;.78,3.9,;-.31,4.99,;-1.8,4.59,;-2.2,3.1,;-3.68,2.7,;-4.77,3.79,;5.46,-1.91,;6.79,-2.68,;8.13,-1.91,;8.13,-.37,;9.46,.4,;6.79,.4,;5.46,-.37,)|

BDBM270071

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncnn1C |r,wD:3.3,2.1,(5.73,-4.99,;4.4,-4.22,;4.4,-2.68,;3.06,-1.91,;3.06,-.37,;1.73,-2.68,;.4,-3.45,;2.5,-4.01,;.96,-1.34,;-.58,-1.34,;-1.48,-2.59,;-2.95,-2.11,;-2.95,-.57,;-4.04,.27,;-3.64,1.75,;-4.73,2.84,;-6.22,2.44,;-6.61,.96,;-8.1,.56,;-5.53,-.13,;-1.48,-.1,;-.84,2.01,;-1.93,3.1,;-3.41,2.7,;-4.5,3.79,;-1.53,4.59,;-.04,4.99,;1.05,3.9,;.65,2.41,;1.74,1.32,;3.23,1.72,;5.73,-1.91,;5.73,-.37,;7.2,.11,;8.1,-1.14,;7.2,-2.38,;7.97,-3.72,)|

BDBM270072

COCCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:19.20,21.22,(-11.51,-5.43,;-10.74,-4.1,;-9.2,-4.1,;-8.43,-2.76,;-6.89,-2.76,;-6.12,-1.43,;-6.89,-.1,;-6.12,1.24,;-4.58,1.24,;-3.81,-.1,;-4.58,-1.43,;-2.27,-.1,;-1.79,-1.56,;-.25,-1.56,;.22,-.1,;1.56,.67,;2.89,-.1,;3.66,-1.43,;2.12,-1.43,;4.22,.67,;4.22,2.21,;5.56,-.1,;5.56,-1.64,;7.05,.3,;8.13,-.79,;9.62,-.39,;10.02,1.1,;11.51,1.5,;8.93,2.19,;7.44,1.79,;-1.02,.81,;-1.02,2.35,;-2.36,3.12,;-3.69,2.35,;-5.02,3.12,;-2.36,4.66,;-1.02,5.43,;.31,4.66,;.31,3.12,;1.64,2.35,;2.98,3.12,)|

BDBM270073

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)c(n2)[C@@H]2COCCO2)nnc1-c1cccc(OCC(O)(C(F)(F)F)C(F)(F)F)n1 |r,wU:16.17,18.19,27.28,(-5.41,2.51,;-4.07,1.74,;-2.74,2.51,;-2.74,4.05,;-1.41,4.82,;-.07,4.05,;-.07,2.51,;1.26,1.74,;2.59,2.51,;-1.41,1.74,;-1.41,.2,;-.16,-.71,;1.17,.06,;2.51,-.71,;3.28,-2.04,;1.74,-2.04,;3.84,.06,;3.84,1.6,;5.17,-.71,;5.17,-2.25,;6.66,-.31,;7.75,-1.4,;9.24,-1,;9.64,.49,;11.12,.89,;8.55,1.58,;7.06,1.18,;8.95,3.07,;10.43,3.46,;10.83,4.95,;9.74,6.04,;8.25,5.64,;7.86,4.15,;-.64,-2.17,;-2.18,-2.17,;-2.65,-.71,;-4.19,-.71,;-4.96,.63,;-6.5,.63,;-7.27,-.71,;-6.5,-2.04,;-7.27,-3.37,;-8.81,-3.37,;-9.58,-4.71,;-8.25,-5.48,;-11.12,-4.71,;-11.89,-3.37,;-11.89,-6.04,;-12.65,-4.87,;-10.35,-6.04,;-9.45,-7.29,;-11.69,-6.81,;-10.67,-7.55,;-4.96,-2.04,)|

BDBM270074

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)c(n2)[C@@H]2COCCO2)nnc1-c1cccc(OCC(O)(C(F)(F)F)C(F)(F)F)n1 |r,wU:16.17,18.19,27.28,(-5.41,2.51,;-4.07,1.74,;-2.74,2.51,;-2.74,4.05,;-1.41,4.82,;-.07,4.05,;-.07,2.51,;1.26,1.74,;2.59,2.51,;-1.41,1.74,;-1.41,.2,;-.16,-.71,;1.17,.06,;2.51,-.71,;3.28,-2.04,;1.74,-2.04,;3.84,.06,;3.84,1.6,;5.17,-.71,;5.17,-2.25,;6.66,-.31,;7.75,-1.4,;9.24,-1,;9.64,.49,;11.12,.89,;8.55,1.58,;7.06,1.18,;8.95,3.07,;10.43,3.46,;10.83,4.95,;9.74,6.04,;8.25,5.64,;7.86,4.15,;-.64,-2.17,;-2.18,-2.17,;-2.65,-.71,;-4.19,-.71,;-4.96,.63,;-6.5,.63,;-7.27,-.71,;-6.5,-2.04,;-7.27,-3.37,;-8.81,-3.37,;-9.58,-4.71,;-8.25,-5.48,;-10.35,-6.04,;-11.89,-6.04,;-9.58,-7.37,;-8.81,-6.04,;-11.12,-4.71,;-11.89,-3.37,;-10.35,-3.37,;-12.53,-5.33,;-4.96,-2.04,)|

BDBM270075

CNc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-9.97,-4.1,;-8.43,-4.1,;-7.66,-2.76,;-8.43,-1.43,;-7.66,-.1,;-6.12,-.1,;-5.35,-1.43,;-6.12,-2.76,;-3.81,-1.43,;-3.33,-2.89,;-1.79,-2.89,;-1.32,-1.43,;.02,-.66,;1.35,-1.43,;2.12,-2.76,;.58,-2.76,;2.68,-.66,;2.68,.88,;4.02,-1.43,;4.02,-2.97,;5.51,-1.03,;6.59,-2.12,;8.08,-1.72,;8.48,-.23,;9.97,.17,;7.39,.86,;5.9,.46,;-2.56,-.52,;-2.56,1.02,;-3.9,1.79,;-5.23,1.02,;-6.56,1.79,;-3.9,3.33,;-2.56,4.1,;-1.23,3.33,;-1.23,1.79,;.1,1.02,;1.44,1.79,)|

BDBM270076

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(Br)c(C)n2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(-7.33,1.22,;-6,.45,;-4.67,1.22,;-4.67,2.76,;-3.33,3.53,;-2,2.76,;-2,1.22,;-.67,.45,;.67,1.22,;-3.33,.45,;-3.33,-1.09,;-2.09,-1.99,;-.75,-1.22,;.58,-1.99,;1.35,-3.33,;-.19,-3.33,;1.91,-1.22,;1.91,.32,;3.25,-1.99,;3.25,-3.53,;4.74,-1.59,;5.13,-.11,;6.62,.29,;7.71,-.8,;9.2,-.4,;7.31,-2.28,;8.4,-3.37,;5.82,-2.68,;-2.56,-3.46,;-4.1,-3.46,;-4.58,-1.99,;-6.12,-1.99,;-6.89,-.66,;-8.43,-.66,;-9.2,-1.99,;-8.43,-3.33,;-6.89,-3.33,)|

BDBM270077

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCO[C@@H]2c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:16.16,21.23,(-5.03,3.53,;-3.69,2.76,;-2.36,3.53,;-2.36,5.07,;-1.02,5.84,;.31,5.07,;.31,3.53,;1.64,2.76,;2.98,3.53,;-1.02,2.76,;-1.02,1.22,;.22,.32,;1.56,1.09,;2.89,.32,;3.66,-1.02,;2.12,-1.02,;4.22,1.09,;4.22,2.63,;5.56,3.4,;6.89,2.63,;6.89,1.09,;5.56,.32,;5.56,-1.22,;4.22,-1.99,;4.22,-3.53,;5.56,-4.3,;5.56,-5.84,;6.89,-3.53,;6.89,-1.99,;-.25,-1.15,;-1.79,-1.15,;-2.27,.32,;-3.81,.32,;-4.58,-1.02,;-6.12,-1.02,;-6.89,.32,;-6.12,1.65,;-6.89,2.98,;-4.58,1.65,)|

BDBM270081

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)n2cc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-6.8,1.89,;-5.47,1.12,;-4.13,1.89,;-4.13,3.43,;-2.8,4.2,;-1.47,3.43,;-1.47,1.89,;-.13,1.12,;1.2,1.89,;-2.8,1.12,;-2.8,-.42,;-1.55,-1.33,;-.01,-1.33,;.76,-2.66,;1.15,-4.15,;-.58,-3.43,;2.09,-1.89,;2.09,-.35,;3.42,-2.66,;3.42,-4.2,;4.76,-1.89,;6.22,-2.37,;7.13,-1.12,;8.67,-1.12,;6.22,.13,;4.76,-.35,;-2.03,-2.79,;-3.57,-2.79,;-4.05,-1.33,;-5.59,-1.33,;-6.36,-2.66,;-7.9,-2.66,;-8.67,-1.33,;-7.9,.01,;-8.67,1.34,;-6.36,.01,)|

BDBM270082

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H]2CCCO[C@H]2c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.16,21.23,(-6.42,-3.12,;-7.19,-1.79,;-6.42,-.45,;-7.19,.88,;-6.42,2.21,;-4.88,2.21,;-4.11,.88,;-4.88,-.45,;-2.57,.88,;-2.09,-.59,;-.55,-.59,;-.08,.88,;1.46,.88,;2.23,-.45,;2.63,-1.94,;.9,-1.22,;3.57,.32,;3.57,1.86,;4.9,2.63,;6.24,1.86,;6.24,.32,;4.9,-.45,;5.3,-1.94,;4.21,-3.03,;4.61,-4.52,;6.1,-4.92,;6.5,-6.4,;7.19,-3.83,;6.79,-2.34,;-1.32,1.78,;-1.32,3.32,;-2.65,4.09,;-3.99,3.32,;-5.32,4.09,;-2.65,5.63,;-1.32,6.4,;.01,5.63,;.01,4.09,;1.35,3.32,;2.68,4.09,)|

BDBM270083

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)n2cc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-7.9,-4.76,;-8.67,-3.43,;-7.9,-2.1,;-8.67,-.76,;-7.9,.57,;-6.36,.57,;-5.59,-.76,;-6.36,-2.1,;-4.05,-.76,;-3.57,-2.23,;-2.03,-2.23,;-1.55,-.76,;-.01,-.76,;.76,-2.1,;1.15,-3.58,;-.58,-2.87,;2.09,-1.33,;2.09,.21,;3.42,-2.1,;3.42,-3.64,;4.76,-1.33,;6.22,-1.8,;7.13,-.56,;8.67,-.56,;6.22,.69,;4.76,.21,;-2.8,.14,;-2.8,1.68,;-4.13,2.45,;-5.47,1.68,;-6.8,2.45,;-4.13,3.99,;-2.8,4.76,;-1.47,3.99,;-1.47,2.45,;-.13,1.68,;1.2,2.45,)|

BDBM270084

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)n2cc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-6.8,1.89,;-5.47,1.12,;-4.13,1.89,;-4.13,3.43,;-2.8,4.2,;-1.47,3.43,;-1.47,1.89,;-.13,1.12,;1.2,1.89,;-2.8,1.12,;-2.8,-.42,;-1.55,-1.33,;-.01,-1.33,;.76,-2.66,;1.15,-4.15,;-.58,-3.43,;2.09,-1.89,;2.09,-.35,;3.42,-2.66,;3.42,-4.2,;4.76,-1.89,;6.22,-2.37,;7.13,-1.12,;8.67,-1.12,;6.22,.13,;4.76,-.35,;-2.03,-2.79,;-3.57,-2.79,;-4.05,-1.33,;-5.59,-1.33,;-6.36,-2.66,;-7.9,-2.66,;-8.67,-1.33,;-7.9,.01,;-8.67,1.34,;-6.36,.01,)|

BDBM270088

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2CCCO[C@@H]2c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:16.16,21.23,(-6.42,-3.12,;-7.19,-1.79,;-6.42,-.45,;-7.19,.88,;-6.42,2.21,;-4.88,2.21,;-4.11,.88,;-4.88,-.45,;-2.57,.88,;-2.09,-.59,;-.55,-.59,;-.08,.88,;1.46,.88,;2.23,-.45,;2.63,-1.94,;.9,-1.22,;3.57,.32,;3.57,1.86,;4.9,2.63,;6.24,1.86,;6.24,.32,;4.9,-.45,;5.3,-1.94,;4.21,-3.03,;4.61,-4.52,;6.1,-4.92,;6.5,-6.4,;7.19,-3.83,;6.79,-2.34,;-1.32,1.78,;-1.32,3.32,;-2.65,4.09,;-3.99,3.32,;-5.32,4.09,;-2.65,5.63,;-1.32,6.4,;.01,5.63,;.01,4.09,;1.35,3.32,;2.68,4.09,)|

BDBM270092

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](C)n2cc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-7.9,-4.76,;-8.67,-3.43,;-7.9,-2.1,;-8.67,-.76,;-7.9,.57,;-6.36,.57,;-5.59,-.76,;-6.36,-2.1,;-4.05,-.76,;-3.57,-2.23,;-2.03,-2.23,;-1.55,-.76,;-.01,-.76,;.76,-2.1,;1.15,-3.58,;-.58,-2.87,;2.09,-1.33,;2.09,.21,;3.42,-2.1,;3.42,-3.64,;4.76,-1.33,;6.22,-1.8,;7.13,-.56,;8.67,-.56,;6.22,.69,;4.76,.21,;-2.8,.14,;-2.8,1.68,;-4.13,2.45,;-5.47,1.68,;-6.8,2.45,;-4.13,3.99,;-2.8,4.76,;-1.47,3.99,;-1.47,2.45,;-.13,1.68,;1.2,2.45,)|

BDBM270096

CNc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-8.08,-4.76,;-8.85,-3.43,;-8.08,-2.1,;-8.85,-.76,;-8.08,.57,;-6.54,.57,;-5.77,-.76,;-6.54,-2.1,;-4.23,-.76,;-3.75,-2.23,;-2.21,-2.23,;-1.73,-.76,;-.4,.01,;.69,-1.08,;-.4,-2.17,;1.09,-2.57,;2.18,-1.48,;2.18,-3.02,;3.51,-.71,;4.84,-1.48,;4.84,-3.02,;6.18,-3.79,;7.51,-3.02,;8.85,-3.79,;7.51,-1.48,;6.18,-.71,;-2.98,.14,;-2.98,1.68,;-4.31,2.45,;-5.65,1.68,;-6.98,2.45,;-4.31,3.99,;-2.98,4.76,;-1.65,3.99,;-1.65,2.45,;-.31,1.68,;1.02,2.45,)|

BDBM270098

CCOc1cccc(OC)c1-n1c(NS(=O)(=O)C(C)C(OC)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |(-3.45,-3.99,.59;-2.74,-3.58,.59;-2.02,-3.99,.59;-1.35,-3.52,.59;-1.52,-2.66,.37;-.99,-2.23,-.22;-.29,-2.66,-.59;-.11,-3.52,-.37;.68,-3.73,-.37;1.27,-3.15,-.37;-.64,-3.95,.22;-.43,-4.74,.01;.35,-5,.01;1.07,-4.59,.01;1.78,-5,.01;1.37,-5.71,.01;2.5,-5.41,.01;2.19,-4.28,.01;1.78,-3.57,.01;3.02,-4.28,.01;3.43,-5,.01;4.26,-5,.01;3.43,-3.57,.01;4.26,-3.57,.01;4.67,-2.86,.01;4.26,-2.14,.01;4.67,-1.43,.01;3.43,-2.14,.01;3.02,-2.86,.01;.35,-5.82,.01;-.43,-6.08,.01;-.92,-5.41,.01;-1.74,-5.41,.01;-2.15,-4.7,.01;-2.98,-4.7,.01;-3.39,-5.41,.01;-2.98,-6.13,.01;-3.39,-6.84,.01;-4.22,-6.84,.01;-2.15,-6.13,.01)|

BDBM270100

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:2.1,3.3,(7.63,-2.14,;6.09,-2.14,;5.32,-.8,;3.78,-.8,;3.01,.53,;3.01,-2.14,;2.24,-3.47,;4.34,-2.91,;1.68,-1.37,;.34,-2.14,;.34,-3.68,;-1.12,-4.15,;-2.03,-2.91,;-3.51,-2.51,;-3.91,-1.02,;-5.4,-.62,;-6.49,-1.71,;-6.09,-3.2,;-6.86,-4.53,;-8.4,-4.53,;-4.6,-3.6,;-1.12,-1.66,;-1.81,.4,;-3.3,.8,;-4.39,-.29,;-5.87,.11,;-3.69,2.29,;-2.61,3.38,;-1.12,2.98,;-.72,1.49,;.77,1.09,;1.54,2.43,;3.08,2.43,;.77,3.76,;6.09,.53,;5.32,1.86,;6.09,3.2,;7.63,3.2,;8.4,4.53,;8.4,1.86,;7.63,.53,)|

BDBM270101

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.67,-2.33,;5.13,-2.33,;4.36,-.99,;2.82,-.99,;2.05,.34,;2.05,-2.33,;1.28,-3.66,;3.39,-3.1,;.72,-1.56,;-.61,-2.33,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,;-2.08,-1.85,;-2.76,.21,;-4.25,.61,;-5.34,-.48,;-6.83,-.08,;-4.65,2.1,;-3.56,3.19,;-2.07,2.79,;-1.68,1.3,;-.19,.9,;.58,2.24,;2.12,2.24,;-.19,3.57,;5.13,.34,;4.36,1.67,;5.13,3.01,;6.67,3.01,;7.44,4.34,;7.44,1.67,;6.67,.34,)|

BDBM270102

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:2.1,3.3,(7.16,-2.33,;5.62,-2.33,;4.85,-.99,;3.31,-.99,;2.54,.34,;2.54,-2.33,;1.77,-3.66,;3.88,-3.1,;1.21,-1.56,;-.13,-2.33,;-.13,-3.87,;-1.59,-4.34,;-2.49,-3.1,;-4.96,-2.63,;-6.05,-3.71,;-7.53,-3.32,;-7.93,-1.83,;-6.84,-.74,;-7.24,.75,;-5.36,-1.14,;-1.59,-1.85,;-2.28,.21,;-3.76,.61,;-4.85,-.48,;-6.34,-.08,;-4.16,2.1,;-3.07,3.19,;-1.59,2.79,;-1.19,1.3,;.3,.9,;1.07,2.24,;2.61,2.24,;.3,3.57,;5.62,.34,;4.85,1.67,;5.62,3.01,;7.16,3.01,;7.93,4.34,;7.93,1.67,;7.16,.34,)|

BDBM270103

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC(F)F)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.91,-2.33,;5.37,-2.33,;4.6,-.99,;3.06,-.99,;2.29,.34,;2.29,-2.33,;1.52,-3.66,;3.62,-3.1,;.96,-1.56,;-.38,-2.33,;-.38,-3.87,;-1.84,-4.34,;-2.75,-3.1,;-4.23,-2.7,;-4.63,-1.21,;-6.12,-.81,;-7.21,-1.9,;-6.81,-3.39,;-5.32,-3.79,;-1.84,-1.85,;-2.53,.21,;-4.02,.61,;-5.1,-.48,;-6.59,-.08,;-6.99,1.41,;-7.68,-1.17,;-4.41,2.1,;-3.33,3.19,;-1.84,2.79,;-1.44,1.3,;.05,.9,;.82,2.24,;.05,3.57,;2.36,2.24,;5.37,.34,;4.6,1.67,;5.37,3.01,;6.91,3.01,;7.68,4.34,;7.68,1.67,;6.91,.34,)|

BDBM270104

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC(F)F)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:2.1,3.3,(7.03,-2.26,;5.49,-2.26,;4.72,-.93,;3.18,-.93,;2.41,.41,;2.41,-2.26,;1.64,-3.59,;3.75,-3.03,;1.08,-1.49,;-.25,-2.26,;-.25,-3.8,;-1.72,-4.27,;-2.62,-3.03,;-4.11,-2.63,;-4.51,-1.14,;-6,-.74,;-7.09,-1.83,;-6.69,-3.32,;-7.78,-4.41,;-5.2,-3.72,;-1.72,-1.78,;-2.41,.28,;-3.89,.68,;-4.98,-.41,;-6.47,-.01,;-6.47,1.53,;-7.8,-.78,;-4.29,2.17,;-3.2,3.26,;-1.72,2.86,;-1.32,1.37,;.17,.97,;.94,2.31,;.17,3.64,;2.48,2.31,;5.49,.41,;4.72,1.74,;5.49,3.08,;7.03,3.08,;7.8,4.41,;7.8,1.74,;7.03,.41,)|

BDBM270105

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(.94,2.31,;.17,.97,;-1.32,1.37,;-1.72,2.86,;-3.2,3.26,;-4.29,2.17,;-3.89,.68,;-4.98,-.41,;-6.47,-.01,;-2.41,.28,;-1.72,-1.78,;-.25,-2.26,;1.08,-1.49,;2.41,-2.26,;1.64,-3.59,;3.75,-3.03,;3.18,-.93,;2.41,.41,;4.72,-.93,;5.49,-2.26,;5.49,.41,;4.72,1.74,;5.49,3.08,;7.03,3.08,;7.8,4.41,;7.8,1.74,;7.03,.41,;-.25,-3.8,;-1.72,-4.27,;-2.62,-3.03,;-4.11,-2.63,;-4.51,-1.14,;-6,-.74,;-7.09,-1.83,;-6.69,-3.32,;-7.78,-4.41,;-5.2,-3.72,)|

BDBM270106

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(6.86,.32,;5.53,1.09,;4.19,.32,;4.19,-1.22,;2.86,-1.99,;1.53,-1.22,;1.53,.32,;2.86,1.09,;.19,-1.99,;.19,-3.53,;-1.14,-1.22,;-1.14,.32,;-2.47,-1.99,;-3.24,-3.33,;-1.7,-3.33,;-3.81,-1.22,;-5.14,-1.99,;-5.62,-3.46,;-7.16,-3.46,;-7.63,-1.99,;-9.12,-1.59,;-9.52,-.11,;-11.01,.29,;-12.1,-.8,;-11.7,-2.28,;-10.21,-2.68,;-6.39,-1.09,;-6.39,.45,;-7.72,1.22,;-9.06,.45,;-10.39,1.22,;-7.72,2.76,;-6.39,3.53,;-5.05,2.76,;-5.05,1.22,;-3.72,.45,;-2.39,1.22,)|

BDBM270107

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(C)cccc1C)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.19,-3.92,;.85,-3.15,;.85,-1.61,;-.48,-.84,;-.48,.7,;-1.82,-1.61,;-2.59,-2.94,;-1.05,-2.94,;-3.15,-.84,;-4.48,-1.61,;-4.96,-3.07,;-6.5,-3.07,;-6.97,-1.61,;-8.46,-1.21,;-9.55,-2.3,;-11.04,-1.9,;-11.44,-.41,;-10.35,.68,;-10.75,2.16,;-8.86,.28,;-5.73,-.7,;-5.73,.84,;-7.06,1.61,;-8.4,.84,;-7.06,3.15,;-5.73,3.92,;-4.4,3.15,;-4.4,1.61,;-3.06,.84,;2.19,-.84,;3.52,-1.61,;4.85,-.84,;4.85,.7,;6.19,1.47,;3.52,1.47,;2.19,.7,)|

BDBM270108

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(F)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(3.28,-3.92,;1.95,-3.15,;1.95,-1.61,;.62,-.84,;.62,.7,;-.72,-1.61,;-1.49,-2.94,;.05,-2.94,;-2.05,-.84,;-3.39,-1.61,;-3.86,-3.07,;-5.4,-3.07,;-5.88,-1.61,;-7.36,-1.21,;-7.76,.28,;-9.25,.68,;-10.34,-.41,;-9.94,-1.9,;-11.03,-2.99,;-12.52,-2.59,;-8.45,-2.3,;-4.63,-.7,;-4.63,.84,;-5.96,1.61,;-7.3,.84,;-5.96,3.15,;-4.63,3.92,;-3.3,3.15,;-3.3,1.61,;-1.96,.84,;-.63,1.61,;3.28,-.84,;4.62,-1.61,;5.95,-.84,;5.95,.7,;7.28,1.47,;4.62,1.47,;3.28,.7,)|

BDBM270109

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(Cl)cccc1Cl)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.18,-3.92,;.85,-3.15,;.85,-1.61,;-.48,-.84,;-.48,.7,;-1.82,-1.61,;-2.59,-2.94,;-1.05,-2.94,;-3.15,-.84,;-4.48,-1.61,;-4.96,-3.07,;-6.5,-3.07,;-6.98,-1.61,;-8.46,-1.21,;-9.55,-2.3,;-11.04,-1.9,;-11.44,-.41,;-10.35,.68,;-10.75,2.16,;-8.86,.28,;-5.73,-.7,;-5.73,.84,;-7.06,1.61,;-8.4,.84,;-7.06,3.15,;-5.73,3.92,;-4.4,3.15,;-4.4,1.61,;-3.06,.84,;2.18,-.84,;3.52,-1.61,;4.85,-.84,;4.85,.7,;6.19,1.47,;3.52,1.47,;2.18,.7,)|

BDBM270110

Fc1cnc(CCS(Cl)(=O)=O)nc1

BDBM270111

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.18,-3.92,;.85,-3.15,;.85,-1.61,;-.48,-.84,;-.48,.7,;-1.82,-1.61,;-2.59,-2.94,;-1.05,-2.94,;-3.15,-.84,;-4.48,-1.61,;-4.96,-3.07,;-6.5,-3.07,;-6.98,-1.61,;-8.46,-1.21,;-9.55,-2.3,;-11.04,-1.9,;-11.44,-.41,;-10.35,.68,;-10.75,2.16,;-8.86,.28,;-5.73,-.7,;-5.73,.84,;-7.06,1.61,;-8.4,.84,;-7.06,3.15,;-5.73,3.92,;-4.4,3.15,;-4.4,1.61,;-3.06,.84,;2.18,-.84,;3.52,-1.61,;4.85,-.84,;4.85,.7,;6.19,1.47,;3.52,1.47,;2.18,.7,)|

BDBM270112

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(F)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.18,-3.92,;.85,-3.15,;.85,-1.61,;-.48,-.84,;-.48,.7,;-1.82,-1.61,;-2.59,-2.94,;-1.05,-2.94,;-3.15,-.84,;-4.48,-1.61,;-4.96,-3.07,;-6.5,-3.07,;-6.98,-1.61,;-8.46,-1.21,;-8.86,.28,;-10.35,.68,;-11.44,-.41,;-11.04,-1.9,;-12.13,-2.99,;-13.62,-2.59,;-9.55,-2.3,;-5.73,-.7,;-5.73,.84,;-7.06,1.61,;-8.4,.84,;-7.06,3.15,;-5.73,3.92,;-4.4,3.15,;-4.4,1.61,;-3.06,.84,;-1.73,1.61,;2.18,-.84,;3.52,-1.61,;4.85,-.84,;4.85,.7,;6.19,1.47,;3.52,1.47,;2.18,.7,)|

BDBM270113

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(F)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(2.18,-3.92,;.85,-3.15,;.85,-1.61,;-.48,-.84,;-.48,.7,;-1.82,-1.61,;-2.59,-2.94,;-1.05,-2.94,;-3.15,-.84,;-4.48,-1.61,;-4.96,-3.07,;-6.5,-3.07,;-6.98,-1.61,;-8.46,-1.21,;-8.86,.28,;-10.35,.68,;-11.44,-.41,;-11.04,-1.9,;-12.13,-2.99,;-13.62,-2.59,;-9.55,-2.3,;-5.73,-.7,;-5.73,.84,;-7.06,1.61,;-8.4,.84,;-7.06,3.15,;-5.73,3.92,;-4.4,3.15,;-4.4,1.61,;-3.06,.84,;-1.73,1.61,;2.18,-.84,;3.52,-1.61,;4.85,-.84,;4.85,.7,;6.19,1.47,;3.52,1.47,;2.18,.7,)|

BDBM270114

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.24,1.22,;-.09,.45,;-1.42,1.22,;-1.42,2.76,;-2.76,3.53,;-4.09,2.76,;-4.09,1.22,;-5.43,.45,;-6.76,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM270115

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.9,1.22,;-.44,.45,;-1.77,1.22,;-1.77,2.76,;-3.1,3.53,;-4.44,2.76,;-4.44,1.22,;-5.77,.45,;-7.1,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM270116

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(7.2,.32,;5.87,1.09,;4.54,.32,;4.54,-1.22,;3.2,-1.99,;1.87,-1.22,;1.87,.32,;3.2,1.09,;.54,-1.99,;.54,-3.53,;-.8,-1.22,;-.8,.32,;-2.13,-1.99,;-2.9,-3.33,;-1.36,-3.33,;-3.47,-1.22,;-4.8,-1.99,;-5.28,-3.46,;-6.82,-3.46,;-7.29,-1.99,;-8.78,-1.59,;-9.18,-.11,;-10.66,.29,;-11.75,-.8,;-11.35,-2.28,;-12.44,-3.37,;-9.87,-2.68,;-6.05,-1.09,;-6.05,.45,;-4.71,1.22,;-3.38,.45,;-2.04,1.22,;-4.71,2.76,;-6.05,3.53,;-7.38,2.76,;-7.38,1.22,;-8.71,.45,;-10.05,1.22,)|

BDBM270117

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r,wU:16.17,wD:18.19,(-2.04,1.22,;-3.38,.45,;-4.71,1.22,;-4.71,2.76,;-6.05,3.53,;-7.38,2.76,;-7.38,1.22,;-8.71,.45,;-10.05,1.22,;-6.05,.45,;-6.05,-1.09,;-4.8,-1.99,;-3.47,-1.22,;-2.13,-1.99,;-2.9,-3.33,;-1.36,-3.33,;-.8,-1.22,;-.8,.32,;.54,-1.99,;.54,-3.53,;1.87,-1.22,;3.2,-1.99,;4.54,-1.22,;4.54,.32,;5.87,1.09,;3.2,1.09,;1.87,.32,;-5.28,-3.46,;-6.82,-3.46,;-7.29,-1.99,;-8.78,-1.59,;-9.87,-2.68,;-11.35,-2.28,;-11.75,-.8,;-10.66,.29,;-9.18,-.11,)|

BDBM270118

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:3.3,2.1,(3.28,-3.92,;1.95,-3.15,;1.95,-1.61,;.61,-.84,;.61,.7,;-.72,-1.61,;-1.49,-2.94,;.05,-2.94,;-2.05,-.84,;-3.39,-1.61,;-3.86,-3.07,;-5.4,-3.07,;-5.88,-1.61,;-7.37,-1.21,;-7.76,.28,;-9.25,.68,;-10.34,-.41,;-9.94,-1.9,;-11.03,-2.99,;-12.52,-2.59,;-8.45,-2.3,;-4.63,-.7,;-4.63,.84,;-5.97,1.61,;-7.3,.84,;-5.97,3.15,;-4.63,3.92,;-3.3,3.15,;-3.3,1.61,;-1.97,.84,;3.28,-.84,;4.62,-1.61,;5.95,-.84,;5.95,.7,;7.28,1.47,;4.62,1.47,;3.28,.7,)|

BDBM270119

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(OC)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(3.28,-3.92,;1.95,-3.15,;1.95,-1.61,;.61,-.84,;.61,.7,;-.72,-1.61,;-1.49,-2.94,;.05,-2.94,;-2.05,-.84,;-3.39,-1.61,;-3.86,-3.07,;-5.4,-3.07,;-5.88,-1.61,;-7.37,-1.21,;-7.76,.28,;-9.25,.68,;-10.34,-.41,;-9.94,-1.9,;-11.03,-2.99,;-12.52,-2.59,;-8.45,-2.3,;-4.63,-.7,;-4.63,.84,;-3.3,1.61,;-1.97,.84,;-.63,1.61,;-3.3,3.15,;-4.63,3.92,;-5.97,3.15,;-5.97,1.61,;-7.3,.84,;-8.63,1.61,;3.28,-.84,;4.62,-1.61,;5.95,-.84,;5.95,.7,;7.28,1.47,;4.62,1.47,;3.28,.7,)|

BDBM270120

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-.63,1.61,;-1.97,.84,;-3.3,1.61,;-3.3,3.15,;-4.63,3.92,;-5.97,3.15,;-5.97,1.61,;-7.3,.84,;-8.63,1.61,;-4.63,.84,;-4.63,-.7,;-3.39,-1.61,;-2.05,-.84,;-.72,-1.61,;-1.49,-2.94,;.05,-2.94,;.61,-.84,;.61,.7,;1.95,-1.61,;1.95,-3.15,;3.28,-.84,;4.62,-1.61,;5.95,-.84,;5.95,.7,;7.28,1.47,;4.62,1.47,;3.28,.7,;-3.86,-3.07,;-5.4,-3.07,;-5.88,-1.61,;-7.37,-1.21,;-7.76,.28,;-9.25,.68,;-10.34,-.41,;-9.94,-1.9,;-11.03,-2.99,;-8.45,-2.3,)|

BDBM270121

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(OC)cn1 |r,wU:2.1,wD:3.3,(1.87,-3.92,;.54,-3.15,;.54,-1.61,;-.8,-.84,;-.8,.7,;-2.13,-1.61,;-2.9,-2.94,;-1.36,-2.94,;-3.47,-.84,;-4.8,-1.61,;-5.28,-3.07,;-6.82,-3.07,;-7.29,-1.61,;-8.78,-1.21,;-9.18,.28,;-10.67,.68,;-11.75,-.41,;-11.36,-1.9,;-12.44,-2.99,;-9.87,-2.3,;-6.05,-.7,;-6.05,.84,;-4.71,1.61,;-3.38,.84,;-2.04,1.61,;-4.71,3.15,;-6.05,3.92,;-7.38,3.15,;-7.38,1.61,;-8.71,.84,;-10.05,1.61,;1.87,-.84,;3.2,-1.61,;4.54,-.84,;4.54,.7,;5.87,1.47,;7.2,.7,;3.2,1.47,;1.87,.7,)|

BDBM270122

COc1cccc(F)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:15.16,17.18,(-1.38,1.22,;-2.71,.45,;-4.04,1.22,;-4.04,2.76,;-5.38,3.53,;-6.71,2.76,;-6.71,1.22,;-8.05,.45,;-5.38,.45,;-5.38,-1.09,;-4.13,-1.99,;-2.8,-1.22,;-1.46,-1.99,;-2.23,-3.33,;-.69,-3.33,;-.13,-1.22,;-.13,.32,;1.2,-1.99,;1.2,-3.53,;2.54,-1.22,;3.87,-1.99,;5.2,-1.22,;5.2,.32,;6.54,1.09,;3.87,1.09,;2.54,.32,;-4.61,-3.46,;-6.15,-3.46,;-6.62,-1.99,;-8.11,-1.59,;-8.51,-.11,;-10,.29,;-11.09,-.8,;-10.69,-2.28,;-11.78,-3.37,;-9.2,-2.68,)|

BDBM270123

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM270124

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC(F)F)c1ncc(C)cn1 |r,wD:2.1,3.3,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-10.64,-2.59,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;1.24,3.15,;-.09,2.38,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM270125

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-10.64,-2.59,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;1.24,3.15,;-.09,2.38,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM270126

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-1.42,1.61,;-.09,.84,;-1.42,3.15,;-2.76,3.92,;-4.09,3.15,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM270127

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(-6.76,1.61,;-5.43,.84,;-4.09,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;-2.76,.84,;-2.76,-.7,;-1.51,-1.61,;-.18,-.84,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;2.49,-.84,;2.49,.7,;3.82,-1.61,;3.82,-3.15,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-6.58,-2.3,;-8.07,-1.9,;-8.47,-.41,;-7.38,.68,;-5.89,.28,)|

BDBM270128

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@@H](C)[C@H](O[Si](C)(C)C(C)(C)C)c2ncc(C)cn2)cc1 |r|

BDBM270129

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)|

BDBM270130

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-8.76,8.36,;-7.43,7.59,;-6.1,8.36,;-6.1,9.9,;-4.76,10.67,;-3.43,9.9,;-3.43,8.36,;-2.1,7.59,;-.76,8.36,;-4.76,7.59,;-4.76,6.05,;-3.52,5.15,;-2.18,5.92,;-.85,5.15,;-1.62,3.82,;-.08,3.82,;.48,5.92,;.48,7.46,;1.82,5.15,;1.82,3.61,;3.15,5.92,;3.15,7.46,;4.48,8.23,;5.82,7.46,;7.15,8.23,;5.82,5.92,;4.48,5.15,;-3.99,3.68,;-5.53,3.68,;-6.01,5.15,;-7.55,5.15,;-8.32,6.48,;-9.86,6.48,;-10.63,5.15,;-9.86,3.82,;-10.63,2.48,;-8.32,3.82,)|

BDBM270131

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wD:3.3,2.1,(4.69,-4.74,;3.6,-3.65,;4,-2.16,;2.91,-1.08,;3.31,.41,;1.42,-1.47,;.33,-2.56,;1.82,-2.96,;.33,-.39,;-1.16,-.78,;-1.63,-2.25,;-3.17,-2.25,;-3.65,-.78,;-5.19,-.78,;-5.96,-2.12,;-7.5,-2.12,;-8.27,-.78,;-7.5,.55,;-5.96,.55,;-2.4,.12,;-2.4,1.66,;-1.07,2.43,;.26,1.66,;1.6,2.43,;-1.07,3.97,;-2.4,4.74,;-3.74,3.97,;-3.74,2.43,;-5.07,1.66,;-6.4,2.43,;5.48,-1.77,;6.73,-2.67,;7.97,-1.77,;7.5,-.3,;8.27,1.03,;5.96,-.3,)|

BDBM270132

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wU:3.3,2.1,(4.69,-4.74,;3.6,-3.65,;4,-2.16,;2.91,-1.08,;3.31,.41,;1.42,-1.47,;.33,-2.56,;1.82,-2.96,;.33,-.39,;-1.16,-.78,;-1.63,-2.25,;-3.17,-2.25,;-3.65,-.78,;-5.19,-.78,;-5.96,-2.12,;-7.5,-2.12,;-8.27,-.78,;-7.5,.55,;-5.96,.55,;-2.4,.12,;-2.4,1.66,;-1.07,2.43,;.26,1.66,;1.6,2.43,;-1.07,3.97,;-2.4,4.74,;-3.74,3.97,;-3.74,2.43,;-5.07,1.66,;-6.4,2.43,;5.48,-1.77,;6.73,-2.67,;7.97,-1.77,;7.5,-.3,;8.27,1.03,;5.96,-.3,)|

BDBM270134

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2cnc(C)cn2)nnc1-c1cccnc1 |r,wD:16.17,18.19,(.76,1.89,;-.57,1.12,;-1.91,1.89,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;-7.24,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.51,-3.11,;.98,-3.51,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.73,-3.4,;7.22,-3,;7.62,-1.51,;9.11,-1.11,;6.53,-.42,;5.04,-.82,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,-2.66,;-8.34,-2.66,;-9.11,-1.33,;-8.34,.01,;-6.8,.01,)|

BDBM270135

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.76,1.89,;-.57,1.12,;-1.91,1.89,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;-7.24,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.51,-3.11,;.98,-3.51,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.73,-3.4,;7.22,-3,;7.62,-1.51,;9.11,-1.11,;6.53,-.42,;5.04,-.82,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,-2.66,;-8.34,-2.66,;-9.11,-1.33,;-8.34,.01,;-6.8,.01,)|

BDBM270136

COc1cnc(cn1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(9.65,-2.2,;8.56,-1.11,;7.08,-1.51,;5.99,-.42,;4.5,-.82,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;2.61,-2.71,;2.21,-4.2,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,)|

BDBM270137

COc1cnc(cn1)[C@H](C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(9.65,-2.2,;8.56,-1.11,;7.08,-1.51,;5.99,-.42,;4.5,-.82,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;2.61,-2.71,;2.21,-4.2,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,)|

BDBM270138

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](C)c2cnc(OC)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-11.19,-4,;-9.65,-4,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-6.57,-1.33,;-7.34,-2.66,;-5.03,-1.33,;-4.56,-2.79,;-3.02,-2.79,;-2.54,-1.33,;-1.05,-.93,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;1.52,-1.62,;1.92,-.13,;2.61,-2.71,;2.21,-4.2,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;7.08,-1.51,;8.56,-1.11,;9.65,-2.2,;5.99,-.42,;4.5,-.82,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,)|

BDBM270140

COc1cnc(cn1)[C@H](O)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:10.11,wD:8.9,(9.65,-2.2,;8.56,-1.11,;7.08,-1.51,;5.99,-.42,;4.5,-.82,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;2.61,-2.71,;2.21,-4.2,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,)|

BDBM270142

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(-7.24,1.89,;-5.91,1.12,;-4.58,1.89,;-4.58,3.43,;-3.24,4.2,;-1.91,3.43,;-1.91,1.89,;-.57,1.12,;.76,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.19,-3.35,;1.35,-3.35,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.73,-3.4,;7.22,-3,;7.62,-1.51,;9.11,-1.11,;6.53,-.42,;5.04,-.82,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,-2.66,;-8.34,-2.66,;-9.11,-1.33,;-8.34,.01,;-6.8,.01,)|

BDBM270143

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wU:16.17,18.19,(-8.34,-4.76,;-9.11,-3.43,;-8.34,-2.1,;-9.11,-.76,;-8.34,.57,;-6.8,.57,;-6.03,-.76,;-6.8,-2.1,;-4.49,-.76,;-4.01,-2.23,;-2.47,-2.23,;-2,-.76,;-.51,-.36,;.58,-1.45,;-.19,-2.79,;1.35,-2.79,;2.07,-1.05,;2.47,.43,;3.16,-2.14,;2.76,-3.63,;4.64,-1.74,;5.73,-2.83,;7.22,-2.43,;7.62,-.95,;9.11,-.55,;6.53,.14,;5.04,-.26,;-3.24,.14,;-3.24,1.68,;-4.58,2.45,;-5.91,1.68,;-7.24,2.45,;-4.58,3.99,;-3.24,4.76,;-1.91,3.99,;-1.91,2.45,;-.57,1.68,;.76,2.45,)|

BDBM270144

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(.73,-4.6,;2.21,-4.2,;2.61,-2.71,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;7.08,-1.51,;8.56,-1.11,;5.99,-.42,;4.5,-.82,)|

BDBM270145

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ccnc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(.73,-4.6,;2.21,-4.2,;2.61,-2.71,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;7.08,-1.51,;8.56,-1.11,;5.99,-.42,;4.5,-.82,)|

BDBM270146

COc1ccnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.22,1.89,;-1.12,1.12,;-2.45,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,;-3.79,1.12,;-3.79,-.42,;-2.54,-1.33,;-1.05,-.93,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;1.52,-1.62,;1.92,-.13,;2.61,-2.71,;2.21,-4.2,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;7.08,-1.51,;8.56,-1.11,;5.99,-.42,;4.5,-.82,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,)|

BDBM270149

COc1cnc(cn1)[C@H](C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(8.96,.37,;8.56,-1.11,;7.08,-1.51,;5.99,-.42,;4.5,-.82,;4.1,-2.31,;5.19,-3.4,;6.68,-3,;2.61,-2.71,;2.21,-4.2,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;-1.05,-3.11,;.43,-3.51,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,-2.66,;-8.88,-2.66,;-9.65,-1.33,;-8.88,.01,;-7.34,.01,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,)|

BDBM270152

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)C1CCC1 |r,wU:3.3,wD:2.1,(5.28,-8.94,;3.95,-8.17,;3.95,-6.63,;2.61,-5.86,;2.61,-4.32,;1.28,-6.63,;.51,-7.97,;2.05,-7.97,;-.05,-5.86,;-1.39,-6.63,;-1.86,-8.1,;-3.4,-8.1,;-3.88,-6.63,;-5.37,-6.23,;-6.46,-7.32,;-7.94,-6.92,;-8.34,-5.44,;-7.25,-4.35,;-7.65,-2.86,;-5.77,-4.75,;-2.63,-5.73,;-2.63,-4.16,;-3.97,-3.39,;-5.3,-4.16,;-6.63,-3.39,;-3.97,-1.85,;-2.63,-1.08,;-1.3,-1.85,;-1.3,-3.39,;.03,-4.16,;1.37,-3.39,;5.28,-5.86,;6.77,-6.26,;7.17,-4.77,;5.68,-4.37,)|

BDBM270153

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)C2CC(F)(F)C2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-10.52,-7.61,;-9.03,-8.01,;-7.94,-6.92,;-8.34,-5.44,;-7.25,-4.35,;-5.77,-4.75,;-5.37,-6.23,;-6.46,-7.32,;-3.88,-6.63,;-3.4,-8.1,;-1.86,-8.1,;-1.39,-6.63,;-.05,-5.86,;1.28,-6.63,;.51,-7.97,;2.05,-7.97,;2.61,-5.86,;2.61,-4.32,;3.95,-6.63,;3.95,-8.17,;5.28,-5.86,;6.77,-6.26,;7.17,-4.77,;8.5,-4,;8.39,-5.71,;5.68,-4.37,;-2.63,-5.73,;-2.63,-4.16,;-3.97,-3.39,;-5.3,-4.16,;-6.63,-3.39,;-3.97,-1.85,;-2.63,-1.08,;-1.3,-1.85,;-1.3,-3.39,;.03,-4.16,;1.37,-3.39,)|

BDBM270154

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)C2CC(F)(F)C2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-20.27,-8.26,;-18.78,-8.66,;-17.69,-7.57,;-18.09,-6.09,;-17,-5,;-15.51,-5.4,;-15.12,-6.88,;-16.21,-7.97,;-13.63,-7.28,;-13.15,-8.75,;-11.61,-8.75,;-11.14,-7.28,;-9.8,-6.51,;-8.47,-7.28,;-9.24,-8.62,;-7.7,-8.62,;-7.14,-6.51,;-7.14,-4.97,;-5.8,-7.28,;-5.8,-8.82,;-4.47,-6.51,;-2.98,-6.91,;-2.58,-5.42,;-1.04,-5.42,;-1.81,-4.09,;-4.07,-5.02,;-12.38,-6.38,;-12.38,-4.84,;-11.05,-4.07,;-9.72,-4.84,;-8.38,-4.07,;-11.05,-2.53,;-12.38,-1.76,;-13.72,-2.53,;-13.72,-4.07,;-15.05,-4.84,;-16.38,-4.07,)|

BDBM270156

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)C1CC(F)(F)C1 |r,wU:3.3,2.1,(-7.14,-9.59,;-5.8,-8.82,;-5.8,-7.28,;-7.14,-6.51,;-7.14,-4.97,;-8.47,-7.28,;-9.24,-8.62,;-7.7,-8.62,;-9.8,-6.51,;-11.14,-7.28,;-11.61,-8.75,;-13.15,-8.75,;-13.63,-7.28,;-15.12,-6.88,;-15.51,-5.4,;-17,-5,;-18.09,-6.09,;-17.69,-7.57,;-18.78,-8.66,;-16.21,-7.97,;-12.38,-6.38,;-12.38,-4.84,;-11.05,-4.07,;-9.72,-4.84,;-8.38,-4.07,;-11.05,-2.53,;-12.38,-1.76,;-13.72,-2.53,;-13.72,-4.07,;-15.05,-4.84,;-16.38,-4.07,;-4.47,-6.51,;-2.98,-6.91,;-2.58,-5.42,;-1.04,-5.42,;-1.81,-4.09,;-4.07,-5.02,)|

BDBM270157

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)cnn2)n1-c1c(OC)cccc1OC)C1CC(C)(C)C1 |r,wU:3.3,2.1,(-4.52,.88,;-5.86,1.65,;-5.86,3.19,;-7.19,3.96,;-7.19,5.5,;-8.52,3.19,;-9.29,1.86,;-7.75,1.86,;-9.86,3.96,;-11.19,3.19,;-11.67,1.73,;-13.21,1.73,;-13.68,3.19,;-15.17,3.59,;-15.57,5.08,;-17.06,5.48,;-17.46,6.97,;-18.15,4.39,;-17.75,2.9,;-16.26,2.5,;-12.44,4.1,;-12.44,5.64,;-11.1,6.41,;-9.77,5.64,;-8.44,6.41,;-11.1,7.95,;-12.44,8.72,;-13.77,7.95,;-13.77,6.41,;-15.1,5.64,;-16.44,6.41,;-4.52,3.96,;-3.04,3.57,;-2.64,5.05,;-1.1,5.05,;-1.87,6.39,;-4.12,5.45,)|

BDBM270158

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)C1CC(C)(C)C1 |r,wU:3.3,2.1,(-4.52,.88,;-5.86,1.65,;-5.86,3.19,;-7.19,3.96,;-7.19,5.5,;-8.52,3.19,;-9.29,1.86,;-7.75,1.86,;-9.86,3.96,;-11.19,3.19,;-11.67,1.73,;-13.21,1.73,;-13.68,3.19,;-15.17,3.59,;-16.26,2.5,;-17.75,2.9,;-18.15,4.39,;-17.06,5.48,;-17.46,6.97,;-15.57,5.08,;-12.44,4.1,;-12.44,5.64,;-11.1,6.41,;-9.77,5.64,;-8.44,6.41,;-11.1,7.95,;-12.44,8.72,;-13.77,7.95,;-13.77,6.41,;-15.1,5.64,;-16.44,6.41,;-4.52,3.96,;-3.04,3.57,;-2.64,5.05,;-1.1,5.05,;-1.87,6.39,;-4.12,5.45,)|

BDBM270160

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:17.18,(-8.44,6.41,;-9.77,5.64,;-11.1,6.41,;-11.1,7.95,;-12.44,8.72,;-13.77,7.95,;-13.77,6.41,;-15.1,5.64,;-16.44,6.41,;-12.44,5.64,;-12.44,4.1,;-11.19,3.19,;-9.86,3.96,;-8.52,3.19,;-9.29,1.86,;-7.75,1.86,;-7.19,3.96,;-5.86,3.19,;-5.86,1.65,;-4.52,3.96,;-3.19,3.19,;-1.86,3.96,;-1.85,5.5,;-.52,6.27,;-3.19,6.27,;-4.52,5.5,;-11.67,1.73,;-13.21,1.73,;-13.68,3.19,;-15.17,3.59,;-16.26,2.5,;-17.75,2.9,;-18.15,4.39,;-17.06,5.48,;-17.46,6.97,;-15.57,5.08,)|

BDBM270161

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wD:17.18,(.86,-3.29,;-.47,-4.06,;-1.81,-3.29,;-1.81,-1.75,;-3.14,-.98,;-4.48,-1.75,;-4.48,-3.29,;-5.81,-4.06,;-7.14,-3.29,;-3.14,-4.06,;-3.14,-5.6,;-1.9,-6.5,;-.56,-5.73,;.77,-6.5,;0,-7.84,;1.54,-7.84,;2.11,-5.73,;3.44,-6.5,;3.44,-8.04,;4.77,-5.73,;6.11,-6.5,;7.44,-5.73,;7.44,-4.19,;8.77,-3.42,;6.11,-3.42,;4.77,-4.19,;-2.37,-7.97,;-3.91,-7.97,;-4.39,-6.5,;-5.87,-6.11,;-6.96,-7.19,;-8.45,-6.8,;-8.85,-5.31,;-7.76,-4.22,;-8.16,-2.73,;-6.27,-4.62,)|

BDBM270162

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)ncnc1OC)C1CC(C)(C)C1 |r,wU:2.1,wD:3.3,(17.04,-8.7,;15.7,-7.93,;15.7,-6.39,;14.37,-5.62,;14.37,-4.08,;13.03,-6.39,;12.26,-7.72,;13.8,-7.72,;11.7,-5.62,;10.37,-6.39,;9.89,-7.85,;8.35,-7.85,;7.88,-6.39,;6.39,-5.99,;5.99,-4.5,;4.5,-4.1,;3.41,-5.19,;3.81,-6.68,;2.72,-7.77,;1.23,-7.37,;5.3,-7.08,;9.12,-5.48,;9.12,-3.94,;10.46,-3.17,;11.79,-3.94,;13.12,-3.17,;10.46,-1.63,;9.12,-.86,;7.79,-1.63,;7.79,-3.17,;6.45,-3.94,;5.12,-3.17,;17.04,-5.62,;18.52,-6.02,;18.92,-4.53,;20.46,-4.53,;19.69,-3.2,;17.43,-4.13,)|

BDBM270163

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)ncnc1OC)C1CC(C)(C)C1 |r,wU:2.1,3.3,(-4.08,1,;-5.41,1.77,;-5.41,3.31,;-6.74,4.08,;-6.74,5.62,;-8.08,3.31,;-8.85,1.97,;-7.31,1.97,;-9.41,4.08,;-10.74,3.31,;-11.22,1.84,;-12.76,1.84,;-13.24,3.31,;-14.72,3.7,;-15.12,5.19,;-16.61,5.59,;-17.7,4.5,;-17.3,3.01,;-18.39,1.93,;-19.88,2.32,;-15.81,2.62,;-11.99,4.21,;-11.99,5.75,;-10.66,6.52,;-9.32,5.75,;-7.99,6.52,;-10.66,8.06,;-11.99,8.83,;-13.32,8.06,;-13.32,6.52,;-14.66,5.75,;-15.99,6.52,;-4.08,4.08,;-2.59,3.68,;-2.19,5.17,;-.65,5.17,;-1.42,6.5,;-3.68,5.56,)|

BDBM270164

COc1c(Br)cc(Br)c(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:20.21,18.19,(2.4,-5.29,;1.07,-6.06,;-.27,-5.29,;-.27,-3.75,;1.07,-2.98,;-1.6,-2.98,;-2.94,-3.75,;-4.27,-2.98,;-2.94,-5.29,;-4.27,-6.06,;-5.6,-5.29,;-1.6,-6.06,;-1.6,-7.6,;-.36,-8.51,;.98,-7.74,;2.31,-8.51,;1.54,-9.84,;3.08,-9.84,;3.64,-7.74,;3.64,-6.2,;4.98,-8.51,;4.98,-10.05,;6.31,-7.74,;7.65,-8.51,;8.98,-7.74,;8.98,-6.2,;10.31,-5.43,;7.65,-5.43,;6.31,-6.2,;-.83,-9.97,;-2.37,-9.97,;-2.85,-8.51,;-4.34,-8.11,;-5.42,-9.2,;-6.91,-8.8,;-7.31,-7.31,;-6.22,-6.22,;-6.62,-4.74,;-4.73,-6.62,)|

BDBM270165

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(Br)c1 |r,wU:18.19,16.17,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.93,-2.68,;-8.41,-2.28,;-8.81,-.8,;-7.72,.29,;-8.12,1.78,;-6.24,-.11,)|

BDBM270166

COc1c(Br)cc(Br)c(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(c1)C1CC1 |r,wU:20.21,18.19,(2.4,-5.29,;1.07,-6.06,;-.27,-5.29,;-.27,-3.75,;1.07,-2.98,;-1.6,-2.98,;-2.94,-3.75,;-4.27,-2.98,;-2.94,-5.29,;-4.27,-6.06,;-5.6,-5.29,;-1.6,-6.06,;-1.6,-7.6,;-.36,-8.51,;.98,-7.74,;2.31,-8.51,;1.54,-9.84,;3.08,-9.84,;3.64,-7.74,;3.64,-6.2,;4.98,-8.51,;4.98,-10.05,;6.31,-7.74,;7.65,-8.51,;8.98,-7.74,;8.98,-6.2,;10.31,-5.43,;7.65,-5.43,;6.31,-6.2,;-.83,-9.97,;-2.37,-9.97,;-2.85,-8.51,;-4.34,-8.11,;-5.42,-9.2,;-6.91,-8.8,;-7.31,-7.31,;-6.22,-6.22,;-4.73,-6.62,;-6.62,-4.74,;-6.22,-3.25,;-7.71,-3.65,)|

BDBM270167

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cn3ccccc3n2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(2.4,-5.29,;1.07,-6.06,;-.27,-5.29,;-.27,-3.75,;-1.6,-2.98,;-2.94,-3.75,;-2.94,-5.29,;-4.27,-6.06,;-5.6,-5.29,;-1.6,-6.06,;-1.6,-7.6,;-.36,-8.51,;.98,-7.74,;2.31,-8.51,;1.54,-9.84,;3.08,-9.84,;3.64,-7.74,;3.64,-6.2,;4.98,-8.51,;4.98,-10.05,;6.31,-7.74,;6.47,-6.21,;7.98,-5.89,;8.75,-4.55,;10.29,-4.55,;11.06,-5.89,;10.29,-7.22,;8.75,-7.22,;7.72,-8.37,;-.83,-9.97,;-2.37,-9.97,;-2.85,-8.51,;-4.34,-8.11,;-4.73,-6.62,;-6.22,-6.22,;-7.31,-7.31,;-6.91,-8.8,;-5.42,-9.2,)|

BDBM270168

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cn3ccccc3n2)nnc1-c1cccnc1 |r,wU:18.19,16.17,(.09,-3.44,;-1.24,-4.21,;-2.57,-3.44,;-2.57,-1.9,;-3.91,-1.13,;-5.24,-1.9,;-5.24,-3.44,;-6.57,-4.21,;-7.91,-3.44,;-3.91,-4.21,;-3.91,-5.75,;-2.66,-6.66,;-1.33,-5.89,;.01,-6.66,;-.76,-7.99,;.78,-7.99,;1.34,-5.89,;1.34,-4.35,;2.67,-6.66,;2.67,-8.2,;4.01,-5.89,;4.17,-4.36,;5.67,-4.04,;6.44,-2.7,;7.98,-2.7,;8.75,-4.04,;7.98,-5.37,;6.44,-5.37,;5.41,-6.52,;-3.14,-8.12,;-4.68,-8.12,;-5.15,-6.66,;-6.64,-6.26,;-7.04,-4.77,;-8.53,-4.38,;-9.62,-5.46,;-9.22,-6.95,;-7.73,-7.35,)|

BDBM270169

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:3.2,4.4,(1.34,-10.51,;1.34,-8.97,;2.67,-8.2,;2.67,-6.66,;1.34,-5.89,;1.34,-4.35,;.01,-6.66,;-.76,-7.99,;.78,-7.99,;-1.33,-5.89,;-2.66,-6.66,;-3.14,-8.12,;-4.68,-8.12,;-5.15,-6.66,;-6.64,-6.26,;-7.73,-7.35,;-9.22,-6.95,;-9.62,-5.46,;-8.53,-4.38,;-8.93,-2.89,;-7.04,-4.77,;-3.91,-5.75,;-3.91,-4.21,;-2.57,-3.44,;-1.24,-4.21,;-2.57,-1.9,;-3.91,-1.13,;-5.24,-1.9,;-5.24,-3.44,;-6.57,-4.21,;4.01,-5.89,;5.34,-6.66,;6.67,-5.89,;6.67,-4.35,;8.01,-3.58,;5.34,-3.58,;4.01,-4.35,)|

BDBM270170

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccc(C)n1 |r,wU:16.17,wD:18.19,(-6.76,2.38,;-5.43,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;5.16,-4.69,;6.49,-2.38,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM270171

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(O)ncnc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.16,-3.15,;3.82,-2.38,;3.82,-.84,;2.49,-.07,;2.49,1.47,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;-.18,-.07,;-1.51,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-10.64,-1.82,;-6.58,-1.53,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-5.43,1.61,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,)|

BDBM270173

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccnc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.16,-3.15,;3.82,-2.38,;3.82,-.84,;2.49,-.07,;2.49,1.47,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;-.18,-.07,;-1.51,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-10.64,-1.82,;-6.58,-1.53,;-2.76,.07,;-2.76,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,)|

BDBM270174

COc1cnc(nc1)[C@@H](OC(C)C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:8.9,wD:13.14,(9.16,3.78,;9.16,2.24,;7.82,1.47,;7.82,-.07,;6.49,-.84,;5.16,-.07,;5.16,1.47,;6.49,2.24,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;5.16,-4.69,;6.49,-2.38,;2.49,-.07,;2.49,1.47,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;-.18,-.07,;-1.51,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,;-2.76,.07,;-2.76,1.61,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-1.42,3.92,;-2.76,4.69,;-4.09,3.92,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,)|

BDBM270175

COc1cnc(nc1)[C@H](OC(C)C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:13.14,wD:8.9,(9.16,3.78,;9.16,2.24,;7.82,1.47,;7.82,-.07,;6.49,-.84,;5.16,-.07,;5.16,1.47,;6.49,2.24,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;5.16,-4.69,;6.49,-2.38,;2.49,-.07,;2.49,1.47,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;-.18,-.07,;-1.51,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,;-2.76,.07,;-2.76,1.61,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-1.42,3.92,;-2.76,4.69,;-4.09,3.92,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,)|

BDBM270176

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ccc(Cl)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(1.24,2.38,;-.09,1.61,;-1.42,2.38,;-1.42,3.92,;-2.76,4.69,;-4.09,3.92,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;5.16,-4.69,;6.49,-2.38,;5.16,-.07,;5.16,1.47,;6.49,2.24,;7.82,1.47,;9.16,2.24,;7.82,-.07,;6.49,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM270177

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2ccc(Cl)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(1.24,2.38,;-.09,1.61,;-1.42,2.38,;-1.42,3.92,;-2.76,4.69,;-4.09,3.92,;-4.09,2.38,;-5.43,1.61,;-6.76,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;5.16,-4.69,;6.49,-2.38,;5.16,-.07,;5.16,1.47,;6.49,2.24,;7.82,1.47,;9.16,2.24,;7.82,-.07,;6.49,-.84,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)|

BDBM270178

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;1.58,-2.17,;.04,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;6.14,-2.38,;4.81,-4.69,;4.81,-.07,;4.81,1.47,;6.14,2.24,;7.48,1.47,;8.81,2.24,;7.48,-.07,;6.14,-.84,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.93,-1.53,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-8.12,2.93,;-6.24,1.05,)|

BDBM270180

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;1.58,-2.17,;.04,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.93,-1.53,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-8.12,2.93,;-6.24,1.05,)|

BDBM270181

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(cn1)C1=CCOCC1 |r,wU:2.1,3.3,t:41,(3.42,-3.85,;2.08,-3.08,;2.08,-1.54,;.75,-.77,;.75,.77,;-.58,-1.54,;-1.35,-2.87,;.19,-2.87,;-1.92,-.77,;-3.25,-1.54,;-3.25,-3.08,;-4.72,-3.56,;-5.62,-2.31,;-7.11,-1.91,;-8.2,-3,;-9.69,-2.6,;-10.08,-1.11,;-9,-.03,;-9.39,1.46,;-7.51,-.42,;-4.72,-1.06,;-5.12,.42,;-4.03,1.51,;-2.54,1.11,;-1.45,2.2,;-4.43,3,;-5.91,3.4,;-7,2.31,;-6.6,.82,;-8.09,.42,;-8.49,1.91,;3.42,-.77,;4.75,-1.54,;6.08,-.77,;6.08,.77,;4.75,1.54,;3.42,.77,;7.42,1.54,;7.42,3.08,;8.75,3.85,;10.08,3.08,;10.08,1.54,;8.75,.77,)|

BDBM270182

COC1CN(C1)[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(C2=CC=CN(C2)OC)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:6.6,7.8,c:20,t:18,(5.53,-14.42,;4.2,-13.65,;4.2,-12.11,;3.11,-11.02,;4.2,-9.93,;5.29,-11.02,;4.2,-8.39,;2.87,-7.62,;2.87,-6.08,;1.53,-8.39,;.76,-9.72,;2.3,-9.72,;.2,-7.62,;-1.13,-8.39,;-1.13,-9.93,;-2.6,-10.4,;-3.5,-9.16,;-5.04,-9.16,;-5.81,-7.82,;-7.35,-7.82,;-8.12,-9.16,;-7.35,-10.49,;-5.81,-10.49,;-8.12,-11.83,;-9.66,-11.83,;-2.6,-7.91,;-3,-6.43,;-1.91,-5.34,;-.42,-5.73,;.67,-4.65,;-2.31,-3.85,;-3.79,-3.45,;-4.88,-4.54,;-4.49,-6.03,;-5.97,-6.43,;-6.37,-4.94,;5.53,-7.62,;6.87,-8.39,;8.2,-7.62,;8.2,-6.08,;9.53,-5.31,;6.87,-5.31,;5.53,-6.08,)|

BDBM270183

COC1CN(C1)[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(C2=CC=CN(C2)OC)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,wD:7.8,c:20,t:18,(5.53,-14.42,;4.2,-13.65,;4.2,-12.11,;3.11,-11.02,;4.2,-9.93,;5.29,-11.02,;4.2,-8.39,;2.87,-7.62,;2.87,-6.08,;1.53,-8.39,;.76,-9.72,;2.3,-9.72,;.2,-7.62,;-1.13,-8.39,;-1.13,-9.93,;-2.6,-10.4,;-3.5,-9.16,;-5.04,-9.16,;-5.81,-7.82,;-7.35,-7.82,;-8.12,-9.16,;-7.35,-10.49,;-5.81,-10.49,;-8.12,-11.83,;-9.66,-11.83,;-2.6,-7.91,;-3,-6.43,;-1.91,-5.34,;-.42,-5.73,;.67,-4.65,;-2.31,-3.85,;-3.79,-3.45,;-4.88,-4.54,;-4.49,-6.03,;-5.97,-6.43,;-6.37,-4.94,;5.53,-7.62,;6.87,-8.39,;8.2,-7.62,;8.2,-6.08,;9.53,-5.31,;6.87,-5.31,;5.53,-6.08,)|

BDBM270184

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(cn1)-c1cccnc1 |r,wU:2.1,3.3,(3.43,-3.85,;2.08,-3.08,;2.08,-1.54,;.75,-.77,;.75,.77,;-.58,-1.54,;-1.35,-2.87,;.19,-2.87,;-1.92,-.77,;-3.25,-1.54,;-3.25,-3.08,;-4.72,-3.56,;-5.62,-2.31,;-7.11,-1.91,;-8.2,-3,;-9.69,-2.6,;-10.08,-1.11,;-9,-.03,;-9.39,1.46,;-7.51,-.42,;-4.72,-1.06,;-5.12,.42,;-4.03,1.51,;-2.54,1.11,;-1.45,2.2,;-4.43,3,;-5.91,3.4,;-7,2.31,;-6.6,.82,;-8.09,.42,;-8.49,1.91,;3.42,-.77,;4.75,-1.54,;6.08,-.77,;6.08,.77,;4.75,1.54,;3.42,.77,;7.42,1.54,;7.42,3.08,;8.75,3.85,;10.08,3.08,;10.08,1.54,;8.75,.77,)|

BDBM270185

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(3.43,-3.85,;2.08,-3.08,;2.08,-1.54,;.75,-.77,;.75,.77,;-.58,-1.54,;-1.35,-2.87,;.19,-2.87,;-1.92,-.77,;-3.25,-1.54,;-3.25,-3.08,;-4.72,-3.56,;-5.62,-2.31,;-7.11,-1.91,;-8.2,-3,;-9.69,-2.6,;-10.08,-1.11,;-9,-.03,;-9.39,1.46,;-7.51,-.42,;-4.72,-1.06,;-5.12,.42,;-4.03,1.51,;-2.54,1.11,;-1.45,2.2,;-4.43,3,;-5.91,3.4,;-7,2.31,;-6.6,.82,;-8.09,.42,;-8.49,1.91,;3.42,-.77,;4.75,-1.54,;6.08,-.77,;6.08,.77,;7.42,1.54,;4.75,1.54,;3.42,.77,)|

BDBM270186

CN[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,wD:2.1,(4.34,4.79,;3,5.56,;3,7.1,;1.67,7.87,;1.67,9.41,;.33,7.1,;-.44,5.76,;1.1,5.76,;-1,7.87,;-2.33,7.1,;-2.81,5.63,;-4.35,5.63,;-4.82,7.1,;-6.36,7.1,;-7.13,5.76,;-8.67,5.76,;-9.44,7.1,;-8.67,8.43,;-9.44,9.76,;-7.13,8.43,;-3.58,8,;-3.98,9.49,;-5.47,9.89,;-6.95,9.49,;-7.72,10.82,;-5.86,11.38,;-4.77,12.47,;-3.29,12.07,;-2.89,10.58,;-1.4,10.18,;-.07,10.95,;4.34,7.87,;5.67,7.1,;7,7.87,;7,9.41,;8.34,10.18,;5.67,10.18,;4.34,9.41,)|

BDBM270187

CN[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:2.1,3.3,(4.79,-8.7,;3.46,-7.93,;3.46,-6.39,;2.12,-5.62,;2.12,-4.08,;.79,-6.39,;.02,-7.72,;1.56,-7.72,;-.54,-5.62,;-1.88,-6.39,;-1.88,-7.93,;-3.34,-8.4,;-4.25,-7.16,;-5.79,-7.16,;-6.56,-8.49,;-8.1,-8.49,;-8.87,-7.16,;-8.1,-5.82,;-8.87,-4.49,;-6.56,-5.82,;-3.34,-5.91,;-3.74,-4.42,;-2.65,-3.33,;-1.16,-3.73,;-.08,-2.64,;-3.05,-1.85,;-4.54,-1.45,;-5.63,-2.54,;-5.23,-4.02,;-6.72,-4.42,;-7.11,-2.94,;4.79,-5.62,;6.12,-6.39,;7.46,-5.62,;7.46,-4.08,;8.79,-3.31,;6.12,-3.31,;4.79,-4.08,)|

BDBM270189

CN[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,wD:2.1,(4.79,-8.7,;3.46,-7.93,;3.46,-6.39,;2.12,-5.62,;2.12,-4.08,;.79,-6.39,;.02,-7.72,;1.56,-7.72,;-.54,-5.62,;-1.88,-6.39,;-1.88,-7.93,;-3.34,-8.4,;-4.25,-7.16,;-5.79,-7.16,;-6.56,-8.49,;-8.1,-8.49,;-8.87,-7.16,;-8.1,-5.82,;-8.87,-4.49,;-6.56,-5.82,;-3.34,-5.91,;-3.74,-4.42,;-2.65,-3.33,;-1.16,-3.73,;-.08,-2.64,;-3.05,-1.85,;-4.54,-1.45,;-5.63,-2.54,;-5.23,-4.02,;-6.72,-4.42,;-7.11,-2.94,;4.79,-5.62,;6.12,-6.39,;7.46,-5.62,;7.46,-4.08,;8.79,-3.31,;6.12,-3.31,;4.79,-4.08,)|

BDBM270190

CN[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,wD:2.1,(4.46,4.79,;3.13,5.56,;3.13,7.1,;1.8,7.87,;1.8,9.41,;.46,7.1,;-.31,5.76,;1.23,5.76,;-.87,7.87,;-2.21,7.1,;-2.68,5.63,;-4.22,5.63,;-4.7,7.1,;-6.24,7.1,;-7.01,5.76,;-8.55,5.76,;-9.32,7.1,;-8.55,8.43,;-9.32,9.76,;-7.01,8.43,;-3.45,8,;-3.85,9.49,;-5.34,9.89,;-6.82,9.49,;-7.59,10.82,;-5.74,11.38,;-4.65,12.47,;-3.16,12.07,;-2.76,10.58,;-1.27,10.18,;.06,10.95,;4.46,7.87,;5.8,7.1,;7.13,7.87,;7.13,9.41,;8.46,10.18,;5.8,10.18,;4.46,9.41,)|

BDBM270191

COC1CN(C1)[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:6.6,7.8,(2.89,-14.2,;4.23,-13.43,;4.23,-11.89,;3.14,-10.8,;4.23,-9.71,;5.32,-10.8,;4.23,-8.17,;2.89,-7.4,;2.89,-5.86,;1.56,-8.17,;.79,-9.5,;2.33,-9.5,;.23,-7.4,;-1.11,-8.17,;-1.11,-9.71,;-2.57,-10.18,;-3.48,-8.94,;-5.02,-8.94,;-5.79,-7.6,;-7.33,-7.6,;-8.1,-8.94,;-7.33,-10.27,;-8.1,-11.6,;-9.64,-11.6,;-5.79,-10.27,;-2.57,-7.69,;-2.97,-6.2,;-1.88,-5.11,;-.39,-5.51,;.69,-4.42,;-2.28,-3.63,;-3.77,-3.23,;-4.86,-4.32,;-4.46,-5.81,;-5.95,-6.2,;-6.34,-4.72,;5.56,-7.4,;6.89,-8.17,;8.23,-7.4,;8.23,-5.86,;9.56,-5.09,;6.89,-5.09,;5.56,-5.86,)|

BDBM270193

COC1CN(C1)[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,wD:7.8,(2.89,-14.2,;4.23,-13.43,;4.23,-11.89,;3.14,-10.8,;4.23,-9.71,;5.32,-10.8,;4.23,-8.17,;2.89,-7.4,;2.89,-5.86,;1.56,-8.17,;.79,-9.5,;2.33,-9.5,;.23,-7.4,;-1.11,-8.17,;-1.11,-9.71,;-2.57,-10.18,;-3.48,-8.94,;-5.02,-8.94,;-5.79,-7.6,;-7.33,-7.6,;-8.1,-8.94,;-7.33,-10.27,;-8.1,-11.6,;-9.64,-11.6,;-5.79,-10.27,;-2.57,-7.69,;-2.97,-6.2,;-1.88,-5.11,;-.39,-5.51,;.69,-4.42,;-2.28,-3.63,;-3.77,-3.23,;-4.86,-4.32,;-4.46,-5.81,;-5.95,-6.2,;-6.34,-4.72,;5.56,-7.4,;6.89,-8.17,;8.23,-7.4,;8.23,-5.86,;9.56,-5.09,;6.89,-5.09,;5.56,-5.86,)|

BDBM270195

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC(F)F)cccc1OC(F)F)c1ncc(C)cn1 |r,wU:1.0,2.2,(3.56,-3.34,;3.56,-1.8,;2.22,-1.03,;2.22,.51,;.89,-1.8,;.12,-3.14,;1.66,-3.14,;-.45,-1.03,;-1.78,-1.8,;-2.25,-3.27,;-3.79,-3.27,;-4.27,-1.8,;-5.81,-1.8,;-6.58,-.47,;-8.12,-.47,;-8.89,-1.8,;-8.12,-3.14,;-8.89,-4.47,;-6.58,-3.14,;-3.02,-.9,;-3.02,1.39,;-1.69,2.16,;-.36,1.39,;.98,2.16,;2.31,1.39,;.98,3.7,;-1.69,3.7,;-3.02,4.47,;-4.36,3.7,;-4.36,2.16,;-5.69,1.39,;-7.03,2.16,;-8.36,1.39,;-7.03,3.7,;4.89,-1.03,;6.22,-1.8,;7.56,-1.03,;7.56,.51,;8.89,1.28,;6.22,1.28,;4.89,.51,)|

BDBM270196

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)C#CC)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(.98,2.16,;-.36,1.39,;-1.69,2.16,;-1.69,3.7,;-3.02,4.47,;-4.36,3.7,;-4.36,2.16,;-5.69,1.39,;-7.03,2.16,;-3.02,1.39,;-3.02,-.9,;-1.78,-1.8,;-.45,-1.03,;.89,-1.8,;.12,-3.14,;1.66,-3.14,;2.22,-1.03,;2.22,.51,;3.56,-1.8,;3.56,-3.34,;4.89,-1.03,;6.22,-.26,;7.56,.51,;-2.25,-3.27,;-3.79,-3.27,;-4.27,-1.8,;-5.81,-1.8,;-6.58,-.47,;-8.12,-.47,;-8.89,-1.8,;-8.12,-3.14,;-8.89,-4.47,;-6.58,-3.14,)|

BDBM270197

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(C)nn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(.98,2.16,;-.36,1.39,;-1.69,2.16,;-1.69,3.7,;-3.02,4.47,;-4.36,3.7,;-4.36,2.16,;-5.69,1.39,;-7.03,2.16,;-3.02,1.39,;-3.02,-.9,;-1.78,-1.8,;-.45,-1.03,;.89,-1.8,;.12,-3.14,;1.66,-3.14,;2.22,-1.03,;2.22,.51,;3.56,-1.8,;3.56,-3.34,;4.89,-1.03,;6.22,-1.8,;7.56,-1.03,;7.56,.51,;8.89,1.28,;6.22,1.28,;4.89,.51,;-2.25,-3.27,;-3.79,-3.27,;-4.27,-1.8,;-5.81,-1.8,;-6.58,-.47,;-8.12,-.47,;-8.89,-1.8,;-8.12,-3.14,;-8.89,-4.47,;-6.58,-3.14,)|

BDBM270198

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(C)nn2)nnc1-c1cncc(C)c1 |r,wD:18.19,16.17,(.23,-2.85,;-.86,-3.94,;-2.35,-3.54,;-2.74,-2.06,;-4.23,-1.66,;-5.32,-2.75,;-4.92,-4.23,;-6.41,-4.63,;-6.81,-3.14,;-3.43,-4.63,;-3.04,-6.12,;-1.57,-6.6,;-.24,-5.83,;1.1,-6.6,;.33,-7.93,;1.87,-7.93,;2.43,-5.83,;2.43,-4.29,;3.76,-6.6,;3.76,-8.14,;5.1,-5.83,;6.43,-6.6,;7.76,-5.83,;7.76,-4.29,;9.1,-3.52,;6.43,-3.52,;5.1,-4.29,;-1.57,-8.14,;-3.04,-8.61,;-3.94,-7.37,;-5.43,-6.97,;-6.52,-8.06,;-8.01,-7.66,;-8.4,-6.17,;-7.32,-5.08,;-7.71,-3.59,;-5.83,-5.48,)|

BDBM270199

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(C)nn2)nnc1-c1cccnc1 |r,wD:18.19,16.17,(-.18,-2.85,;-1.27,-3.94,;-2.76,-3.54,;-3.16,-2.06,;-4.64,-1.66,;-5.73,-2.75,;-5.33,-4.23,;-6.82,-4.63,;-7.22,-3.14,;-3.85,-4.63,;-3.45,-6.12,;-1.98,-6.6,;-.65,-5.83,;.68,-6.6,;-.09,-7.93,;1.45,-7.93,;2.02,-5.83,;2.02,-4.29,;3.35,-6.6,;3.35,-8.14,;4.68,-5.83,;6.02,-6.6,;7.35,-5.83,;7.35,-4.29,;8.69,-3.52,;6.02,-3.52,;4.68,-4.29,;-1.98,-8.14,;-3.45,-8.61,;-4.35,-7.37,;-5.84,-6.97,;-6.24,-5.48,;-7.73,-5.08,;-8.82,-6.17,;-8.42,-7.66,;-6.93,-8.06,)|

BDBM270200

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(C)nn2)nnc1-c1cccnc1 |r,wD:16.17,18.19,(-6.61,-3,;-5.28,-3.77,;-3.94,-3,;-3.94,-1.46,;-2.61,-.69,;-1.27,-1.46,;-1.27,-3,;.06,-3.77,;1.39,-3,;-2.61,-3.77,;-2.61,-5.31,;-1.36,-6.21,;-.03,-5.44,;1.31,-6.21,;2.08,-7.55,;.54,-7.55,;2.64,-5.44,;2.64,-3.9,;3.97,-6.21,;3.97,-7.75,;5.31,-5.44,;6.64,-6.21,;7.97,-5.44,;7.97,-3.9,;9.31,-3.13,;6.64,-3.13,;5.31,-3.9,;-1.84,-7.68,;-3.38,-7.68,;-3.85,-6.21,;-5.34,-5.81,;-5.74,-4.33,;-7.23,-3.93,;-8.32,-5.02,;-7.92,-6.5,;-6.43,-6.9,)|

BDBM270201

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(C)nn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-6.61,-3,;-5.28,-3.77,;-3.94,-3,;-3.94,-1.46,;-2.61,-.69,;-1.27,-1.46,;-1.27,-3,;.06,-3.77,;1.39,-3,;-2.61,-3.77,;-2.61,-5.31,;-1.36,-6.21,;-.03,-5.44,;1.31,-6.21,;2.08,-7.55,;.54,-7.55,;2.64,-5.44,;2.64,-3.9,;3.97,-6.21,;3.97,-7.75,;5.31,-5.44,;6.64,-6.21,;7.97,-5.44,;7.97,-3.9,;9.31,-3.13,;6.64,-3.13,;5.31,-3.9,;-1.84,-7.68,;-3.38,-7.68,;-3.85,-6.21,;-5.34,-5.81,;-5.74,-4.33,;-7.23,-3.93,;-8.32,-5.02,;-7.92,-6.5,;-9.01,-7.59,;-6.43,-6.9,)|

BDBM270202

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(C)nn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-6.67,-3.11,;-5.34,-3.88,;-4,-3.11,;-4,-1.57,;-2.67,-.8,;-1.34,-1.57,;-1.34,-3.11,;-0,-3.88,;1.33,-3.11,;-2.67,-3.88,;-2.67,-5.42,;-1.43,-6.32,;-.09,-5.55,;1.24,-6.32,;2.01,-7.66,;.47,-7.66,;2.58,-5.55,;2.58,-4.01,;3.91,-6.32,;3.91,-7.86,;5.24,-5.55,;6.58,-6.32,;7.91,-5.55,;7.91,-4.01,;9.24,-3.24,;6.58,-3.24,;5.24,-4.01,;-1.9,-7.79,;-3.44,-7.79,;-3.92,-6.32,;-5.4,-5.93,;-6.49,-7.01,;-7.98,-6.62,;-8.38,-5.13,;-7.29,-4.04,;-7.69,-2.55,;-5.8,-4.44,)|

BDBM270203

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)ccnc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(7.76,-2.26,;6.22,-2.26,;5.45,-.93,;3.91,-.93,;3.14,.41,;3.14,-2.26,;4.48,-3.03,;2.37,-3.59,;1.81,-1.49,;.48,-2.26,;.48,-3.8,;-.99,-4.27,;-1.89,-3.03,;-3.38,-2.63,;-3.78,-1.14,;-5.27,-.74,;-6.36,-1.83,;-5.96,-3.32,;-7.05,-4.41,;-8.53,-4.01,;-4.47,-3.72,;-.99,-1.78,;-1.53,.33,;-.44,1.42,;1.05,1.02,;2.14,2.11,;-.84,2.9,;-2.32,3.3,;-3.41,2.21,;-3.02,.73,;-4.1,-.36,;-5.59,.04,;6.22,.41,;7.76,.41,;8.53,1.74,;7.76,3.08,;8.53,4.41,;6.22,3.08,;5.45,1.74,)|

BDBM270205

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccccn1 |r,wU:18.19,16.17,(-6.68,-.03,;-5.19,-.43,;-4.1,.66,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;-2.62,.26,;-2.08,-1.85,;-.61,-2.33,;.72,-1.56,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;2.82,-.99,;2.05,.34,;4.36,-.99,;5.13,-2.33,;5.13,.34,;4.36,1.67,;5.13,3.01,;6.67,3.01,;7.44,4.34,;7.44,1.67,;6.67,.34,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,)|

BDBM270206

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccccn1 |r,wU:18.19,16.17,(-6.68,-.03,;-5.19,-.43,;-4.1,.66,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;-2.62,.26,;-2.08,-1.85,;-.61,-2.33,;.72,-1.56,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;2.82,-.99,;2.05,.34,;4.36,-.99,;5.13,-2.33,;5.13,.34,;4.36,1.67,;5.13,3.01,;6.67,3.01,;7.44,4.34,;7.44,1.67,;6.67,.34,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,)|

BDBM270207

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccccn1 |r,wU:18.19,16.17,(-6.68,-.03,;-5.19,-.43,;-4.1,.66,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;-2.62,.26,;-2.08,-1.85,;-.61,-2.33,;.72,-1.56,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;2.82,-.99,;2.05,.34,;4.36,-.99,;5.13,-2.33,;5.13,.34,;6.67,.34,;7.44,1.67,;6.67,3.01,;7.44,4.34,;5.13,3.01,;4.36,1.67,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,)|

BDBM270208

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccccn1 |r,wU:18.19,16.17,(-6.68,-.03,;-5.19,-.43,;-4.1,.66,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;-2.62,.26,;-2.08,-1.85,;-.61,-2.33,;.72,-1.56,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;2.82,-.99,;2.05,.34,;4.36,-.99,;5.13,-2.33,;5.13,.34,;6.67,.34,;7.44,1.67,;6.67,3.01,;7.44,4.34,;5.13,3.01,;4.36,1.67,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,)|

BDBM270209

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccccn1 |r,wU:16.17,wD:18.19,(-.53,6.44,;-.21,4.93,;-1.36,3.9,;-2.82,4.38,;-3.97,3.35,;-3.65,1.84,;-2.18,1.36,;-1.86,-.14,;-3.01,-1.17,;-1.04,2.4,;.43,1.92,;.9,.45,;-0,-.79,;.62,-2.2,;-.78,-2.82,;2.03,-1.57,;1.25,-3.6,;2.78,-3.77,;.35,-4.85,;-1.19,-4.69,;-2.09,-5.94,;-1.46,-7.34,;-3.62,-5.77,;.97,-6.26,;2.5,-6.42,;3.13,-7.83,;2.22,-9.07,;2.85,-10.48,;.69,-8.91,;.07,-7.5,;2.44,.45,;2.92,1.92,;1.67,2.82,;1.67,4.36,;3.01,5.13,;3.01,6.67,;1.67,7.44,;.34,6.67,;.34,5.13,)|

BDBM270210

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccccn1 |r,wU:16.17,wD:18.19,(-.53,6.44,;-.21,4.93,;-1.36,3.9,;-2.82,4.38,;-3.97,3.35,;-3.65,1.84,;-2.18,1.36,;-1.86,-.14,;-3.01,-1.17,;-1.04,2.4,;.43,1.92,;.9,.45,;-0,-.79,;.62,-2.2,;-.78,-2.82,;2.03,-1.57,;1.25,-3.6,;2.78,-3.77,;.35,-4.85,;-1.19,-4.69,;-2.09,-5.94,;-1.46,-7.34,;-3.62,-5.77,;.97,-6.26,;2.5,-6.42,;3.13,-7.83,;2.22,-9.07,;2.85,-10.48,;.69,-8.91,;.07,-7.5,;2.44,.45,;2.92,1.92,;1.67,2.82,;1.67,4.36,;3.01,5.13,;3.01,6.67,;1.67,7.44,;.34,6.67,;.34,5.13,)|

BDBM270211

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1-c1c(OC)ncnc1OC)c1cnc(C)cn1 |r,wU:2.1,3.3,(6.67,-2.33,;5.13,-2.33,;4.36,-.99,;2.82,-.99,;2.05,.34,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;.72,-1.56,;-.61,-2.33,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,;-2.08,-1.85,;-2.62,.26,;-4.1,.66,;-5.19,-.43,;-6.68,-.03,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;5.13,.34,;4.36,1.67,;5.13,3.01,;6.67,3.01,;7.44,4.34,;7.44,1.67,;6.67,.34,)|

BDBM270212

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:2.1,3.3,(6.67,-2.33,;5.13,-2.33,;4.36,-.99,;2.82,-.99,;2.05,.34,;2.05,-2.33,;3.39,-3.1,;1.28,-3.66,;.72,-1.56,;-.61,-2.33,;-.61,-3.87,;-2.08,-4.34,;-2.98,-3.1,;-4.47,-2.7,;-4.87,-1.21,;-6.36,-.81,;-7.44,-1.9,;-7.05,-3.39,;-5.56,-3.79,;-2.08,-1.85,;-2.62,.26,;-4.1,.66,;-5.19,-.43,;-6.68,-.03,;-4.5,2.15,;-3.41,3.23,;-1.93,2.84,;-1.53,1.35,;-.04,.95,;1.05,2.04,;5.13,.34,;4.36,1.67,;5.13,3.01,;6.67,3.01,;7.44,4.34,;7.44,1.67,;6.67,.34,)|

BDBM270213

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncnn1C |r,wU:3.3,2.1,(-4.15,-3.38,;-2.62,-3.22,;-1.71,-4.47,;-.18,-4.3,;.72,-5.55,;.44,-2.9,;1.85,-3.52,;-.96,-2.27,;1.07,-1.49,;.16,-.24,;-1.38,-.24,;-1.85,1.22,;-.61,2.12,;-.61,3.66,;.73,4.43,;.73,5.97,;-.61,6.74,;-1.94,5.97,;-3.27,6.74,;-1.94,4.43,;.64,1.22,;2.11,1.7,;3.25,.67,;2.93,-.84,;4.07,-1.87,;4.71,1.14,;5.03,2.65,;3.89,3.68,;2.43,3.2,;1.28,4.23,;1.6,5.74,;-2.34,-5.87,;-1.57,-7.21,;-2.6,-8.35,;-4.01,-7.72,;-3.85,-6.19,;-4.99,-5.16,)|

BDBM270215

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,(3.56,-2.97,;3.56,-1.43,;2.22,-.66,;2.22,.88,;.89,-1.43,;1.66,-2.76,;.12,-2.76,;-.45,-.66,;-1.78,-1.43,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,;-3.02,-.52,;-3.02,1.02,;-4.36,1.79,;-5.69,1.02,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,)|

BDBM270216

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(F)cccc1F |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;1.66,-2.1,;.12,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,)|

BDBM270217

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,(3.56,-3.53,;3.56,-1.99,;2.22,-1.22,;2.22,.32,;.89,-1.99,;1.66,-3.33,;.12,-3.33,;-.45,-1.22,;-1.78,-1.99,;-2.25,-3.46,;-3.79,-3.46,;-4.27,-1.99,;-5.81,-1.99,;-6.58,-.66,;-8.12,-.66,;-8.89,-1.99,;-8.12,-3.33,;-6.58,-3.33,;-3.02,-1.09,;-3.02,.45,;-4.36,1.22,;-5.69,.45,;-4.36,2.76,;-3.02,3.53,;-1.69,2.76,;-1.69,1.22,;-.36,.45,;4.89,-1.22,;6.22,-1.99,;7.56,-1.22,;7.56,.32,;8.89,1.09,;6.22,1.09,;4.89,.32,)|

BDBM270218

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(F)cccc1F |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;1.66,-2.1,;.12,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,)|

BDBM270219

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)n1-c1c(F)cccc1F |r,wU:16.17,18.19,(-8.79,-4.76,;-9.56,-3.43,;-8.79,-2.1,;-9.56,-.76,;-8.79,.57,;-7.25,.57,;-6.48,-.76,;-7.25,-2.1,;-4.94,-.76,;-4.46,-2.23,;-2.92,-2.23,;-2.45,-.76,;-1.11,.01,;.22,-.76,;.99,-2.1,;-.55,-2.1,;1.56,.01,;1.56,1.55,;2.89,-.76,;2.89,-2.3,;4.22,.01,;4.22,1.55,;5.56,2.32,;6.89,1.55,;8.22,2.32,;9.56,1.55,;6.89,.01,;5.56,-.76,;-3.69,.14,;-3.69,1.68,;-5.03,2.45,;-6.36,1.68,;-5.03,3.99,;-3.69,4.76,;-2.36,3.99,;-2.36,2.45,;-1.02,1.68,)|

BDBM270220

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(F)cccc1F)c1ncc(Cl)cn1 |r,wU:2.2,1.0,(3.56,-2.97,;3.56,-1.43,;2.22,-.66,;2.22,.88,;.89,-1.43,;1.66,-2.76,;.12,-2.76,;-.45,-.66,;-1.78,-1.43,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,;-3.02,-.52,;-3.02,1.02,;-4.36,1.79,;-5.69,1.02,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,)|

BDBM270221

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)n1-c1c(F)cccc1F |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;1.66,-2.1,;.12,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;4.89,1.55,;6.22,2.32,;7.56,1.55,;8.89,2.32,;7.56,.01,;6.22,-.76,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,)|

BDBM270222

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1-c1c(F)cccc1F)c1cnc(C)cn1 |r,wU:2.2,1.0,(3.56,-2.97,;3.56,-1.43,;2.22,-.66,;2.22,.88,;.89,-1.43,;1.66,-2.76,;.12,-2.76,;-.45,-.66,;-1.78,-1.43,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,;-3.02,-.52,;-3.02,1.02,;-4.36,1.79,;-5.69,1.02,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;4.89,-.66,;4.89,.88,;6.22,1.65,;7.56,.88,;8.89,1.65,;7.56,-.66,;6.22,-1.43,)|

BDBM270223

CNc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(F)cccc1F |r,wU:16.17,18.19,(-7.63,-4.76,;-8.4,-3.43,;-7.63,-2.1,;-8.4,-.76,;-7.63,.57,;-6.09,.57,;-5.32,-.76,;-6.09,-2.1,;-3.78,-.76,;-3.31,-2.23,;-1.77,-2.23,;-1.29,-.76,;.04,.01,;1.38,-.76,;2.15,-2.1,;.61,-2.1,;2.71,.01,;2.71,1.55,;4.05,-.76,;4.44,-2.25,;5.13,.33,;6.62,-.07,;7.71,1.02,;7.31,2.5,;8.4,3.59,;5.82,2.9,;4.74,1.81,;-2.54,.14,;-2.54,1.68,;-3.87,2.45,;-5.2,1.68,;-3.87,3.99,;-2.54,4.76,;-1.2,3.99,;-1.2,2.45,;.13,1.68,)|

BDBM270224

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wD:3.3,2.1,(5.93,-2.65,;4.44,-2.25,;4.05,-.76,;2.71,.01,;2.71,1.55,;1.38,-.76,;2.15,-2.1,;.61,-2.1,;.04,.01,;-1.29,-.76,;-1.77,-2.23,;-3.31,-2.23,;-3.78,-.76,;-5.32,-.76,;-6.09,.57,;-7.63,.57,;-8.4,-.76,;-7.63,-2.1,;-8.4,-3.43,;-7.63,-4.76,;-6.09,-2.1,;-2.54,.14,;-2.54,1.68,;-3.87,2.45,;-5.2,1.68,;-3.87,3.99,;-2.54,4.76,;-1.2,3.99,;-1.2,2.45,;.13,1.68,;5.13,.33,;6.62,-.07,;7.71,1.02,;7.31,2.5,;8.4,3.59,;5.82,2.9,;4.74,1.81,)|

BDBM270225

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,(3.56,-3.53,;3.56,-1.99,;2.22,-1.22,;2.22,.32,;.89,-1.99,;1.66,-3.33,;.12,-3.33,;-.45,-1.22,;-1.78,-1.99,;-2.25,-3.46,;-3.79,-3.46,;-4.27,-1.99,;-5.81,-1.99,;-6.58,-.66,;-8.12,-.66,;-8.89,-1.99,;-8.12,-3.33,;-6.58,-3.33,;-3.02,-1.09,;-3.02,.45,;-4.36,1.22,;-5.69,.45,;-4.36,2.76,;-3.02,3.53,;-1.69,2.76,;-1.69,1.22,;-.36,.45,;4.89,-1.22,;6.22,-1.99,;7.56,-1.22,;7.56,.32,;8.89,1.09,;6.22,1.09,;4.89,.32,)|

BDBM270226

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F |r,wU:10.11,8.9,(9.56,.88,;8.22,1.65,;6.89,.88,;6.89,-.66,;5.56,-1.43,;4.22,-.66,;4.22,.88,;5.56,1.65,;2.89,-1.43,;2.89,-2.97,;1.56,-.66,;1.56,.88,;.22,-1.43,;.99,-2.76,;-.55,-2.76,;-1.11,-.66,;-2.45,-1.43,;-2.92,-2.89,;-4.46,-2.89,;-4.94,-1.43,;-6.48,-1.43,;-7.25,-.1,;-8.79,-.1,;-9.56,-1.43,;-8.79,-2.76,;-9.56,-4.1,;-7.25,-2.76,;-3.69,-.52,;-3.69,1.02,;-5.03,1.79,;-6.36,1.02,;-5.03,3.33,;-3.69,4.1,;-2.36,3.33,;-2.36,1.79,;-1.02,1.02,)|

BDBM270227

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1cnc(C)cn1 |r,wU:2.2,1.0,(3.56,-2.97,;3.56,-1.43,;2.22,-.66,;2.22,.88,;.89,-1.43,;1.66,-2.76,;.12,-2.76,;-.45,-.66,;-1.78,-1.43,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,;-3.02,-.52,;-3.02,1.02,;-4.36,1.79,;-5.69,1.02,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;4.89,-.66,;4.89,.88,;6.22,1.65,;7.56,.88,;8.89,1.65,;7.56,-.66,;6.22,-1.43,)|

BDBM270228

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1ncc(Cl)cn1 |r,wU:2.2,1.0,(3.56,-2.97,;3.56,-1.43,;2.22,-.66,;2.22,.88,;.89,-1.43,;1.66,-2.76,;.12,-2.76,;-.45,-.66,;-1.78,-1.43,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,;-3.02,-.52,;-3.02,1.02,;-4.36,1.79,;-5.69,1.02,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,)|

BDBM270229

COc1ccccc1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:14.15,16.17,(-7.03,1.79,;-5.69,1.02,;-4.36,1.79,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-3.02,1.02,;-3.02,-.52,;-1.78,-1.43,;-.45,-.66,;.89,-1.43,;1.66,-2.76,;.12,-2.76,;2.22,-.66,;2.22,.88,;3.56,-1.43,;3.56,-2.97,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,)|

BDBM270230

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1nc(Br)ccc1OC |r,wU:16.17,18.19,(-9.8,-4.1,;-8.26,-4.1,;-7.49,-2.76,;-8.26,-1.43,;-7.49,-.1,;-5.95,-.1,;-5.18,-1.43,;-5.95,-2.76,;-3.64,-1.43,;-3.16,-2.89,;-1.62,-2.89,;-1.15,-1.43,;.18,-.66,;1.27,-1.75,;2.04,-3.08,;.5,-3.08,;2.76,-1.35,;3.16,.14,;3.85,-2.44,;3.45,-3.93,;5.34,-2.04,;6.43,-3.13,;7.91,-2.73,;8.31,-1.24,;9.8,-.84,;7.22,-.15,;5.74,-.55,;-2.39,-.52,;-2.39,1.02,;-1.06,1.79,;-1.06,3.33,;.27,4.1,;-2.39,4.1,;-3.73,3.33,;-3.73,1.79,;-5.06,1.02,;-6.4,1.79,)|

BDBM270231

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)n1-c1c(OC)ncnc1OC |r,wU:18.19,16.17,(-7.39,-5.15,;-7.79,-3.67,;-6.7,-2.58,;-7.1,-1.09,;-6.01,-0,;-4.52,-.4,;-4.12,-1.89,;-5.21,-2.98,;-2.64,-2.28,;-1.73,-3.53,;-.27,-3.05,;-.27,-1.51,;1.07,-.74,;2.4,-1.51,;3.73,-2.28,;1.63,-2.85,;3.17,-.18,;2.4,1.15,;4.71,-.18,;5.48,-1.51,;5.48,1.15,;7.02,1.15,;7.79,2.49,;7.02,3.82,;7.79,5.15,;5.48,3.82,;4.71,2.49,;-1.73,-1.04,;-2.33,1.38,;-3.82,1.78,;-4.91,.69,;-6.4,1.09,;-4.22,3.27,;-3.13,4.36,;-1.64,3.96,;-1.24,2.47,;.24,2.07,;1.33,3.16,)|

BDBM270232

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(F)cccc1F |r,wD:16.16,18.19,(-8.28,-4.09,;-9.05,-2.76,;-8.28,-1.43,;-9.05,-.09,;-8.28,1.24,;-6.74,1.24,;-5.97,-.09,;-6.74,-1.43,;-4.43,-.09,;-3.96,-1.56,;-2.42,-1.56,;-1.94,-.09,;-.45,.31,;.63,-.78,;1.4,-2.12,;-.14,-2.12,;2.12,-.39,;2.52,1.1,;4.01,1.5,;4.41,2.99,;5.1,.41,;4.7,-1.08,;3.21,-1.47,;5.79,-2.16,;5.39,-3.65,;6.48,-4.74,;7.97,-4.34,;9.05,-5.43,;8.36,-2.86,;7.27,-1.77,;-3.19,.81,;-3.19,2.35,;-4.52,3.12,;-5.86,2.35,;-4.52,4.66,;-3.19,5.43,;-1.85,4.66,;-1.85,3.12,;-.52,2.35,)|

BDBM270234

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.76,1.89,;-.57,1.12,;-1.91,1.89,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;-7.24,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;1.35,-3.35,;-.19,-3.35,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.04,-.82,;6.53,-.42,;7.62,-1.51,;9.11,-1.11,;7.22,-3,;5.73,-3.4,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,.01,;-8.34,.01,;-9.11,-1.33,;-8.34,-2.66,;-6.8,-2.66,)|

BDBM270235

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wU:10.11,8.9,(9.65,-2.2,;8.56,-1.11,;7.08,-1.51,;6.68,-3,;5.19,-3.4,;4.1,-2.31,;4.5,-.82,;5.99,-.42,;2.61,-2.71,;2.21,-4.2,;1.52,-1.62,;1.92,-.13,;.04,-2.02,;.81,-3.35,;-.73,-3.35,;-1.05,-.93,;-2.54,-1.33,;-3.02,-2.79,;-4.56,-2.79,;-5.03,-1.33,;-6.57,-1.33,;-7.34,.01,;-8.88,.01,;-9.65,-1.33,;-8.88,-2.66,;-7.34,-2.66,;-3.79,-.42,;-3.79,1.12,;-2.45,1.89,;-1.12,1.12,;.22,1.89,;-2.45,3.43,;-3.79,4.2,;-5.12,3.43,;-5.12,1.89,;-6.45,1.12,;-7.79,1.89,)|

BDBM270236

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC)c1cnc(OC)cn1 |r,wD:3.3,2.1,(3.3,-4.74,;2.21,-3.65,;2.61,-2.16,;1.52,-1.08,;1.92,.41,;.04,-1.47,;.81,-2.81,;-.73,-2.81,;-1.05,-.39,;-2.54,-.78,;-3.02,-2.25,;-4.56,-2.25,;-5.03,-.78,;-6.57,-.78,;-7.34,.55,;-8.88,.55,;-9.65,-.78,;-8.88,-2.12,;-7.34,-2.12,;-3.79,.12,;-3.79,1.66,;-2.45,2.43,;-1.12,1.66,;.22,2.43,;-2.45,3.97,;-3.79,4.74,;-5.12,3.97,;-5.12,2.43,;-6.45,1.66,;-7.79,2.43,;4.1,-1.77,;5.19,-2.86,;6.68,-2.46,;7.08,-.97,;8.56,-.57,;9.65,-1.66,;5.99,.12,;4.5,-.28,)|

BDBM270237

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wU:16.16,18.19,(-6.68,-2.69,;-5.35,-3.46,;-4.01,-2.69,;-4.01,-1.15,;-2.68,-.38,;-1.35,-1.15,;-1.35,-2.69,;-.01,-3.46,;1.32,-2.69,;-2.68,-3.46,;-2.68,-5,;-1.43,-5.9,;.05,-5.5,;1.14,-6.59,;.37,-7.92,;1.91,-7.92,;2.63,-6.19,;3.03,-4.7,;4.52,-4.31,;4.92,-2.82,;5.61,-5.39,;5.21,-6.88,;3.72,-7.28,;6.3,-7.97,;5.9,-9.46,;6.99,-10.55,;8.47,-10.15,;9.56,-11.24,;8.87,-8.66,;7.78,-7.57,;-1.91,-7.36,;-3.45,-7.36,;-3.92,-5.9,;-5.46,-5.9,;-6.23,-4.57,;-7.77,-4.57,;-8.54,-5.9,;-7.77,-7.23,;-6.23,-7.23,)|

BDBM270238

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(-7.24,1.89,;-5.91,1.12,;-4.58,1.89,;-4.58,3.43,;-3.24,4.2,;-1.91,3.43,;-1.91,1.89,;-.57,1.12,;.76,1.89,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.19,-3.35,;1.35,-3.35,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.04,-.82,;6.53,-.42,;7.62,-1.51,;9.11,-1.11,;7.22,-3,;5.73,-3.4,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,.01,;-8.34,.01,;-9.11,-1.33,;-8.34,-2.66,;-6.8,-2.66,)|

BDBM270239

COc1nc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1cccnc1 |r,wU:15.16,17.18,(-6.74,-2.68,;-5.41,-3.45,;-4.08,-2.68,;-4.08,-1.14,;-2.74,-.37,;-1.41,-1.14,;-1.41,-2.68,;-.08,-3.45,;-2.74,-3.45,;-2.74,-4.99,;-1.5,-5.89,;-.01,-5.5,;1.08,-6.58,;.31,-7.92,;1.85,-7.92,;2.57,-6.19,;2.97,-4.7,;3.66,-7.28,;3.26,-8.76,;5.14,-6.88,;5.54,-5.39,;7.03,-4.99,;8.12,-6.08,;9.61,-5.68,;7.72,-7.57,;6.23,-7.97,;-1.97,-7.36,;-3.51,-7.36,;-3.99,-5.89,;-5.53,-5.89,;-6.3,-4.56,;-7.84,-4.56,;-8.61,-5.89,;-7.84,-7.23,;-6.3,-7.23,)|

BDBM270240

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wD:16.16,18.19,(-7.19,3.12,;-5.86,2.35,;-4.52,3.12,;-4.52,4.66,;-3.19,5.43,;-1.85,4.66,;-1.85,3.12,;-.52,2.35,;.81,3.12,;-3.19,2.35,;-3.19,.81,;-1.94,-.09,;-.45,.31,;.63,-.78,;-.14,-2.12,;1.4,-2.12,;2.12,-.39,;2.52,1.1,;4.01,1.5,;4.41,2.99,;5.1,.41,;4.7,-1.08,;3.21,-1.47,;5.79,-2.16,;5.39,-3.65,;6.48,-4.74,;7.97,-4.34,;9.05,-5.43,;8.36,-2.86,;7.27,-1.77,;-2.42,-1.56,;-3.96,-1.56,;-4.43,-.09,;-5.97,-.09,;-6.74,1.24,;-8.28,1.24,;-9.05,-.09,;-8.28,-1.43,;-6.74,-1.43,)|

BDBM270242

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(O)nc[nH]c1=O)c1ccc(Cl)cn1 |r,wU:2.2,1.0,(2.76,-4.2,;3.16,-2.71,;2.07,-1.62,;2.47,-.13,;.58,-2.02,;-.19,-3.35,;1.35,-3.35,;-.51,-.93,;-2,-1.33,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,.01,;-8.34,.01,;-9.11,-1.33,;-8.34,-2.66,;-6.8,-2.66,;-3.24,-.42,;-3.24,1.12,;-1.91,1.89,;-.57,1.12,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;4.64,-2.31,;5.04,-.82,;6.53,-.42,;7.62,-1.51,;9.11,-1.11,;7.22,-3,;5.73,-3.4,)|

BDBM270243

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC)c1cnc(OC)cn1 |r,wD:3.3,2.1,(3.3,-4.74,;2.21,-3.65,;2.61,-2.16,;1.52,-1.08,;1.92,.41,;.04,-1.47,;-.73,-2.81,;.81,-2.81,;-1.05,-.39,;-2.54,-.78,;-3.02,-2.25,;-4.56,-2.25,;-5.03,-.78,;-6.57,-.78,;-7.34,.55,;-8.88,.55,;-9.65,-.78,;-8.88,-2.12,;-7.34,-2.12,;-3.79,.12,;-3.79,1.66,;-5.12,2.43,;-6.45,1.66,;-7.79,2.43,;-5.12,3.97,;-3.79,4.74,;-2.45,3.97,;-2.45,2.43,;-1.12,1.66,;.22,2.43,;4.1,-1.77,;5.19,-2.86,;6.68,-2.46,;7.08,-.97,;8.56,-.57,;9.65,-1.66,;5.99,.12,;4.5,-.28,)|

BDBM270244

CO[C@@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wU:2.1,wD:4.16,(3.32,4.08,;4.41,2.99,;4.01,1.5,;2.52,1.1,;2.12,-.39,;3.21,-1.47,;4.7,-1.08,;5.1,.41,;5.79,-2.16,;5.39,-3.65,;6.48,-4.74,;7.97,-4.34,;9.05,-5.43,;8.36,-2.86,;7.27,-1.77,;.63,-.78,;-.14,-2.12,;1.4,-2.12,;-.45,.31,;-1.94,-.09,;-2.42,-1.56,;-3.96,-1.56,;-4.43,-.09,;-5.97,-.09,;-6.74,1.24,;-8.28,1.24,;-9.05,-.09,;-8.28,-1.43,;-6.74,-1.43,;-3.19,.81,;-3.19,2.35,;-4.52,3.12,;-5.86,2.35,;-7.19,3.12,;-4.52,4.66,;-3.19,5.43,;-1.85,4.66,;-1.85,3.12,;-.52,2.35,;.81,3.12,)|

BDBM270245

CO[C@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wD:4.16,2.1,(3.32,4.08,;4.41,2.99,;4.01,1.5,;2.52,1.1,;2.12,-.39,;3.21,-1.47,;4.7,-1.08,;5.1,.41,;5.79,-2.16,;5.39,-3.65,;6.48,-4.74,;7.97,-4.34,;9.05,-5.43,;8.36,-2.86,;7.27,-1.77,;.63,-.78,;-.14,-2.12,;1.4,-2.12,;-.45,.31,;-1.94,-.09,;-2.42,-1.56,;-3.96,-1.56,;-4.43,-.09,;-5.97,-.09,;-6.74,1.24,;-8.28,1.24,;-9.05,-.09,;-8.28,-1.43,;-6.74,-1.43,;-3.19,.81,;-3.19,2.35,;-4.52,3.12,;-5.86,2.35,;-7.19,3.12,;-4.52,4.66,;-3.19,5.43,;-1.85,4.66,;-1.85,3.12,;-.52,2.35,;.81,3.12,)|

BDBM270248

CO[C@@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:2.1,wD:4.16,(3.32,4.08,;4.41,2.99,;4.01,1.5,;2.52,1.1,;2.12,-.39,;3.21,-1.47,;4.7,-1.08,;5.1,.41,;5.79,-2.16,;5.39,-3.65,;6.48,-4.74,;7.97,-4.34,;9.05,-5.43,;8.36,-2.86,;7.27,-1.77,;.63,-.78,;-.14,-2.12,;1.4,-2.12,;-.45,.31,;-1.94,-.09,;-2.42,-1.56,;-3.96,-1.56,;-4.43,-.09,;-5.97,-.09,;-6.74,1.24,;-8.28,1.24,;-9.05,-.09,;-8.28,-1.43,;-6.74,-1.43,;-3.19,.81,;-3.19,2.35,;-4.52,3.12,;-5.86,2.35,;-7.19,3.12,;-4.52,4.66,;-3.19,5.43,;-1.85,4.66,;-1.85,3.12,;-.52,2.35,;.81,3.12,)|

BDBM270249

CO[C@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wD:4.16,2.1,(3.32,4.08,;4.41,2.99,;4.01,1.5,;2.52,1.1,;2.12,-.39,;3.21,-1.47,;4.7,-1.08,;5.1,.41,;5.79,-2.16,;5.39,-3.65,;6.48,-4.74,;7.97,-4.34,;9.05,-5.43,;8.36,-2.86,;7.27,-1.77,;.63,-.78,;-.14,-2.12,;1.4,-2.12,;-.45,.31,;-1.94,-.09,;-2.42,-1.56,;-3.96,-1.56,;-4.43,-.09,;-5.97,-.09,;-6.74,1.24,;-8.28,1.24,;-9.05,-.09,;-8.28,-1.43,;-6.74,-1.43,;-3.19,.81,;-3.19,2.35,;-4.52,3.12,;-5.86,2.35,;-7.19,3.12,;-4.52,4.66,;-3.19,5.43,;-1.85,4.66,;-1.85,3.12,;-.52,2.35,;.81,3.12,)|

BDBM270252

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1-c1cccnc1 |r,wU:16.16,18.31,(-6.81,-2.69,;-5.47,-3.46,;-4.14,-2.69,;-4.14,-1.15,;-2.81,-.38,;-1.47,-1.15,;-1.47,-2.69,;-.14,-3.46,;1.19,-2.69,;-2.81,-3.46,;-2.81,-5,;-1.56,-5.9,;-.07,-5.5,;1.02,-6.59,;.25,-7.92,;1.79,-7.92,;2.5,-6.19,;2.9,-4.7,;4.39,-4.31,;5.48,-5.39,;5.08,-6.88,;3.59,-7.28,;6.17,-7.97,;5.77,-9.46,;6.86,-10.55,;8.35,-10.15,;9.44,-11.24,;8.75,-8.66,;7.66,-7.57,;4.79,-2.82,;6.28,-2.42,;6.67,-.93,;7.36,-3.51,;-2.04,-7.36,;-3.58,-7.36,;-4.05,-5.9,;-5.59,-5.9,;-6.36,-4.57,;-7.9,-4.57,;-8.67,-5.9,;-7.9,-7.23,;-6.36,-7.23,)|

BDBM270254

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1-c1cccnc1 |r,wU:18.31,wD:16.16,(-6.81,-2.69,;-5.47,-3.46,;-4.14,-2.69,;-4.14,-1.15,;-2.81,-.38,;-1.47,-1.15,;-1.47,-2.69,;-.14,-3.46,;1.19,-2.69,;-2.81,-3.46,;-2.81,-5,;-1.56,-5.9,;-.07,-5.5,;1.02,-6.59,;.25,-7.92,;1.79,-7.92,;2.5,-6.19,;2.9,-4.7,;4.39,-4.31,;5.48,-5.39,;5.08,-6.88,;3.59,-7.28,;6.17,-7.97,;5.77,-9.46,;6.86,-10.55,;8.35,-10.15,;9.44,-11.24,;8.75,-8.66,;7.66,-7.57,;4.79,-2.82,;6.28,-2.42,;6.67,-.93,;7.36,-3.51,;-2.04,-7.36,;-3.58,-7.36,;-4.05,-5.9,;-5.59,-5.9,;-6.36,-4.57,;-7.9,-4.57,;-8.67,-5.9,;-7.9,-7.23,;-6.36,-7.23,)|

BDBM270256

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cccc(C)n1 |r,wU:16.17,wD:18.19,(-6.39,-2.63,;-5.06,-3.4,;-3.73,-2.63,;-3.73,-1.09,;-2.39,-.32,;-1.06,-1.09,;-1.06,-2.63,;.27,-3.4,;1.61,-2.63,;-2.39,-3.4,;-2.39,-4.94,;-1.15,-5.85,;.19,-5.08,;1.52,-5.85,;.75,-7.18,;2.29,-7.18,;2.85,-5.08,;2.85,-3.54,;4.19,-5.85,;4.19,-7.39,;5.52,-8.16,;5.52,-9.7,;6.85,-7.39,;5.52,-5.08,;5.52,-3.54,;6.85,-2.77,;8.19,-3.54,;9.52,-2.77,;8.19,-5.08,;6.85,-5.85,;-1.62,-7.31,;-3.16,-7.31,;-3.64,-5.85,;-5.13,-5.45,;-5.52,-3.96,;-7.01,-3.56,;-8.1,-4.65,;-7.7,-6.14,;-8.79,-7.23,;-6.22,-6.54,)|

BDBM270257

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-9.54,-6.83,;-8.05,-7.23,;-6.96,-6.14,;-7.36,-4.65,;-6.27,-3.56,;-4.78,-3.96,;-4.38,-5.45,;-5.47,-6.54,;-2.9,-5.85,;-2.42,-7.31,;-.88,-7.31,;-.4,-5.85,;.93,-5.08,;2.26,-5.85,;1.49,-7.18,;3.03,-7.18,;3.6,-5.08,;3.6,-3.54,;4.93,-5.85,;4.93,-7.39,;6.26,-8.16,;6.26,-9.7,;7.6,-7.39,;6.26,-5.08,;6.26,-3.54,;7.6,-2.77,;8.93,-3.54,;10.27,-2.77,;8.93,-5.08,;7.6,-5.85,;-1.65,-4.94,;-1.65,-3.4,;-2.98,-2.63,;-4.32,-3.4,;-5.65,-2.63,;-2.98,-1.09,;-1.65,-.32,;-.32,-1.09,;-.32,-2.63,;1.02,-3.4,;2.35,-2.63,)|

BDBM270258

C[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wD:2.2,1.0,(3.84,-7.46,;3.84,-5.92,;2.51,-5.15,;2.51,-3.61,;1.18,-5.92,;.41,-7.25,;1.95,-7.25,;-.16,-5.15,;-1.49,-5.92,;-1.97,-7.38,;-3.51,-7.38,;-3.98,-5.92,;-5.47,-5.52,;-6.56,-6.61,;-8.05,-6.21,;-8.45,-4.72,;-7.36,-3.63,;-7.76,-2.15,;-5.87,-4.03,;-2.74,-5.01,;-2.74,-3.47,;-4.07,-2.7,;-5.41,-3.47,;-4.07,-1.16,;-2.74,-.39,;-1.4,-1.16,;-1.4,-2.7,;-.07,-3.47,;5.18,-5.15,;6.51,-5.92,;7.84,-5.15,;7.84,-3.61,;9.18,-2.84,;6.51,-2.84,;5.18,-3.61,)|

BDBM270259

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2cn3ccccc3n2)nnc1-c1cccnc1 |r,wU:18.19,wD:16.17,(-7.6,3.18,;-6.27,2.41,;-4.94,3.18,;-4.94,4.72,;-3.6,5.49,;-2.27,4.72,;-2.27,3.18,;-.94,2.41,;.4,3.18,;-3.6,2.41,;-3.6,.87,;-2.36,-.04,;-.87,.36,;.22,-.73,;-1.27,-1.13,;1.31,-1.82,;1.71,-.33,;2.11,1.16,;2.8,-1.42,;2.4,-2.91,;3.49,-4,;4.97,-3.6,;3.09,-5.49,;4.28,-1.02,;4.76,.44,;6.3,.44,;7.33,1.59,;8.84,1.27,;9.31,-.2,;8.28,-1.34,;6.77,-1.02,;5.53,-1.93,;-2.83,-1.5,;-4.37,-1.5,;-4.85,-.04,;-6.34,.36,;-6.74,1.85,;-8.22,2.24,;-9.31,1.16,;-8.91,-.33,;-7.43,-.73,)|

BDBM270261

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;.04,-2.17,;1.58,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;6.14,-2.38,;4.81,-4.69,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.93,-1.53,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-8.12,2.93,;-6.24,1.05,)|

BDBM270262

CCc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wU:16.16,(-10.99,-1.82,;-9.5,-2.22,;-8.41,-1.13,;-8.81,.36,;-7.72,1.45,;-6.24,1.05,;-5.84,-.44,;-6.93,-1.53,;-4.35,-.84,;-3.87,-2.3,;-2.33,-2.3,;-1.86,-.84,;-.52,-.07,;.81,-.84,;.04,-2.17,;1.58,-2.17,;2.14,-.07,;2.14,1.47,;3.48,2.24,;4.81,1.47,;4.81,-.07,;3.48,-.84,;6.14,-.84,;6.14,-2.38,;7.48,-3.15,;8.81,-2.38,;10.15,-3.15,;8.81,-.84,;7.48,-.07,;-3.1,.07,;-3.1,1.61,;-4.44,2.38,;-5.77,1.61,;-7.1,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,)|

BDBM270263

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2CCCN(C2)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wD:16.16,(-10.92,-8.18,;-9.44,-8.58,;-8.35,-7.49,;-8.75,-6,;-7.66,-4.91,;-6.17,-5.31,;-5.77,-6.8,;-6.86,-7.89,;-4.28,-7.2,;-3.81,-8.66,;-2.27,-8.66,;-1.79,-7.2,;-.3,-6.8,;.79,-7.89,;-.3,-8.98,;1.87,-8.98,;1.87,-6.8,;1.48,-5.31,;2.56,-4.22,;4.05,-4.62,;4.45,-6.11,;3.36,-7.2,;5.94,-6.51,;6.34,-7.99,;7.82,-8.39,;8.91,-7.3,;10.4,-7.7,;8.51,-5.82,;7.03,-5.42,;-3.04,-6.29,;-3.04,-4.75,;-4.37,-3.98,;-5.7,-4.75,;-7.04,-3.98,;-4.37,-2.44,;-3.04,-1.67,;-1.7,-2.44,;-1.7,-3.98,;-.37,-4.75,;.96,-3.98,)|

BDBM270264

COc1cccc(n1)-c1nnc(NS(=O)(=O)CC2CC2)n1-c1c(OC)cccc1OC |(-6.11,-4.76,;-6.88,-3.43,;-6.11,-2.1,;-6.88,-.76,;-6.11,.57,;-4.57,.57,;-3.8,-.76,;-4.57,-2.1,;-2.26,-.76,;-1.78,-2.23,;-.24,-2.23,;.24,-.76,;1.72,-.36,;2.81,-1.45,;2.04,-2.79,;3.58,-2.79,;4.3,-1.05,;5.39,-2.14,;5.79,-3.63,;6.88,-2.54,;-1.01,.14,;-1.01,1.68,;-2.34,2.45,;-3.68,1.68,;-5.01,2.45,;-2.34,3.99,;-1.01,4.76,;.32,3.99,;.32,2.45,;1.66,1.68,;2.99,2.45,)|

BDBM270265

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(Br)c1 |r,wU:16.17,18.19,(-8.61,8.32,;-7.27,7.55,;-5.94,8.32,;-5.94,9.86,;-4.6,10.63,;-3.27,9.86,;-3.27,8.32,;-1.94,7.55,;-.6,8.32,;-4.6,7.55,;-4.6,6.01,;-3.36,5.1,;-2.02,5.87,;-.69,5.1,;-1.46,3.77,;.08,3.77,;.64,5.87,;.64,7.41,;1.98,5.1,;1.98,3.56,;3.31,5.87,;4.64,5.1,;5.98,5.87,;5.98,7.41,;7.31,8.18,;4.64,8.18,;3.31,7.41,;-3.83,3.64,;-5.37,3.64,;-5.85,5.1,;-7.34,5.5,;-8.43,4.41,;-9.91,4.81,;-10.31,6.3,;-9.22,7.39,;-9.62,8.87,;-7.74,6.99,)|

BDBM270266

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(c1)C#N |r,wU:16.17,18.19,(-8.61,8.32,;-7.27,7.55,;-5.94,8.32,;-5.94,9.86,;-4.6,10.63,;-3.27,9.86,;-3.27,8.32,;-1.94,7.55,;-.6,8.32,;-4.6,7.55,;-4.6,6.01,;-3.36,5.1,;-2.02,5.87,;-.69,5.1,;-1.46,3.77,;.08,3.77,;.64,5.87,;.64,7.41,;1.98,5.1,;1.98,3.56,;3.31,5.87,;4.64,5.1,;5.98,5.87,;5.98,7.41,;7.31,8.18,;4.64,8.18,;3.31,7.41,;-3.83,3.64,;-5.37,3.64,;-5.85,5.1,;-7.34,5.5,;-8.43,4.41,;-9.91,4.81,;-10.31,6.3,;-9.22,7.5,;-7.74,6.99,;-9.6,8.99,;-9.98,10.48,)|

BDBM270267

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1C1CCOCC1 |r|

BDBM270268

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM270269

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1C1CCOCC1 |r|

BDBM270270

COc1nc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1cccnc1 |r,wU:15.16,17.18,(.76,1.89,;-.57,1.12,;-1.91,1.89,;-1.91,3.43,;-3.24,4.2,;-4.58,3.43,;-4.58,1.89,;-5.91,1.12,;-3.24,1.12,;-3.24,-.42,;-2,-1.33,;-.51,-.93,;.58,-2.02,;-.19,-3.35,;1.35,-3.35,;2.07,-1.62,;2.47,-.13,;3.16,-2.71,;2.76,-4.2,;4.64,-2.31,;5.04,-.82,;6.53,-.42,;7.62,-1.51,;9.11,-1.11,;7.22,-3,;5.73,-3.4,;-2.47,-2.79,;-4.01,-2.79,;-4.49,-1.33,;-6.03,-1.33,;-6.8,.01,;-8.34,.01,;-9.11,-1.33,;-8.34,-2.66,;-6.8,-2.66,)|

BDBM270272

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)n1C1CCOCC1 |r|

BDBM270273

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCOCC1)c1ccc(Cl)cn1 |r|

BDBM270274

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCOCC1 |r|

BDBM270275

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)n1C1CCOCC1 |r|

BDBM270276

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)n1C1CCOCC1 |r|

BDBM270277

COc1ccc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCOCC1 |r|

BDBM270278

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(CO)c1 |r,wU:16.17,18.19,(-5.6,-5.22,;-4.27,-5.99,;-2.94,-5.22,;-2.94,-3.68,;-1.6,-2.91,;-.27,-3.68,;-.27,-5.22,;1.07,-5.99,;2.4,-5.22,;-1.6,-5.99,;-1.6,-7.53,;-.36,-8.43,;.98,-7.66,;2.31,-8.43,;1.54,-9.77,;3.08,-9.77,;3.64,-7.66,;3.64,-6.12,;4.98,-8.43,;4.98,-9.97,;6.31,-7.66,;7.65,-8.43,;8.98,-7.66,;8.98,-6.12,;10.31,-5.35,;7.65,-5.35,;6.31,-6.12,;-.83,-9.9,;-2.37,-9.9,;-2.85,-8.43,;-4.34,-8.03,;-5.42,-9.12,;-6.91,-8.73,;-7.31,-7.24,;-6.22,-6.15,;-6.62,-4.66,;-8.11,-4.26,;-4.73,-6.55,)|

BDBM310222

CO[C@@H]1CCC[C@H](OC)[C@H]1n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCCO1 |r|

BDBM310224

CO[C@@H]1CCC[C@H](OC)[C@H]1n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@@H]1CCOC1 |r|

BDBM310226

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1[C@@H]1CCOC1 |r,wU:29.31,wD:16.17,(.66,-12.82,;-.67,-13.59,;-2,-12.82,;-2,-11.28,;-3.34,-10.51,;-4.67,-11.28,;-4.67,-12.82,;-6,-13.59,;-7.34,-12.82,;-3.34,-13.59,;-3.34,-15.13,;-2.09,-16.03,;-.76,-15.26,;.58,-16.03,;-.76,-16.8,;1.91,-16.8,;1.91,-15.26,;1.91,-13.72,;3.24,-16.03,;4.58,-15.26,;5.91,-16.03,;7.25,-15.26,;7.25,-13.72,;8.58,-12.95,;5.91,-12.95,;4.58,-13.72,;-2.57,-17.5,;-4.11,-17.5,;-4.58,-16.03,;-6.12,-16.03,;-7.03,-14.79,;-8.49,-15.26,;-8.49,-16.8,;-7.03,-17.28,)|

BDBM310227

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1[C@@H]1CCOC1 |r,wD:28.30,(-7.01,-3.89,;-5.68,-4.66,;-4.34,-3.89,;-4.34,-2.35,;-3.01,-1.58,;-1.67,-2.35,;-1.67,-3.89,;-.34,-4.66,;.99,-3.89,;-3.01,-4.66,;-3.01,-6.2,;-1.76,-7.11,;-.3,-6.63,;1.04,-7.4,;1.81,-8.74,;.27,-8.74,;2.37,-6.63,;3.7,-7.4,;5.04,-6.63,;6.37,-7.4,;7.7,-6.63,;7.7,-5.09,;9.04,-4.32,;6.37,-4.32,;5.04,-5.09,;-2.24,-8.57,;-3.78,-8.57,;-4.25,-7.11,;-5.72,-6.63,;-6.96,-7.54,;-8.21,-6.63,;-7.73,-5.17,;-6.19,-5.17,)|

BDBM310228

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1C1CCOCC1 |r,wU:16.17,(-7.03,5.8,;-5.69,5.03,;-4.36,5.8,;-4.36,7.34,;-3.02,8.11,;-1.69,7.34,;-1.69,5.8,;-.36,5.03,;.98,5.8,;-3.02,5.03,;-3.02,3.49,;-1.78,2.59,;-.45,3.36,;.89,2.59,;2.22,1.82,;-.45,1.82,;2.22,3.36,;2.22,4.9,;3.56,2.59,;4.89,3.36,;6.22,2.59,;7.56,3.36,;7.56,4.9,;8.89,5.67,;6.22,5.67,;4.89,4.9,;-2.25,1.13,;-3.79,1.13,;-4.27,2.59,;-5.81,2.59,;-6.58,3.92,;-8.12,3.92,;-8.89,2.59,;-8.12,1.26,;-6.58,1.26,)|

BDBM310231

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,wD:12.11,(3.2,-3.53,;3.2,-1.99,;1.87,-1.22,;1.87,.32,;.53,-1.99,;1.87,-2.76,;-.8,-2.76,;-.8,-1.22,;-2.13,-1.99,;-2.61,-3.46,;-4.15,-3.46,;-4.63,-1.99,;-6.17,-1.99,;-7.07,-3.24,;-8.54,-2.76,;-8.54,-1.22,;-7.07,-.75,;-3.38,-1.09,;-3.38,.45,;-4.71,1.22,;-6.05,.45,;-4.71,2.76,;-3.38,3.53,;-2.05,2.76,;-2.05,1.22,;-.71,.45,;4.53,-1.22,;5.87,-1.99,;7.2,-1.22,;7.2,.32,;8.54,1.09,;5.87,1.09,;4.53,.32,)|

BDBM310232

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:12.11,2.2,1.0,(3.2,-3.53,;3.2,-1.99,;1.87,-1.22,;1.87,.32,;.53,-1.99,;1.87,-2.76,;-.8,-2.76,;-.8,-1.22,;-2.13,-1.99,;-2.61,-3.46,;-4.15,-3.46,;-4.63,-1.99,;-6.17,-1.99,;-7.07,-3.24,;-8.54,-2.76,;-8.54,-1.22,;-7.07,-.75,;-3.38,-1.09,;-3.38,.45,;-4.71,1.22,;-6.05,.45,;-4.71,2.76,;-3.38,3.53,;-2.05,2.76,;-2.05,1.22,;-.71,.45,;4.53,-1.22,;5.87,-1.99,;7.2,-1.22,;7.2,.32,;8.54,1.09,;5.87,1.09,;4.53,.32,)|

BDBM310233

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCOC2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:12.11,2.2,1.0,(3.2,1.09,;3.2,2.63,;1.87,3.4,;1.87,4.94,;.53,2.63,;1.87,1.86,;-.8,1.86,;-.8,3.4,;-2.13,2.63,;-2.61,1.16,;-4.15,1.16,;-4.63,2.63,;-6.17,2.63,;-7.07,1.38,;-8.54,1.86,;-8.54,3.4,;-7.07,3.87,;-3.38,3.53,;-3.38,5.07,;-4.71,5.84,;-6.05,5.07,;-4.71,7.38,;-3.38,8.15,;-2.05,7.38,;-2.05,5.84,;-.71,5.07,;4.53,3.4,;5.87,2.63,;7.2,3.4,;7.2,4.94,;8.54,5.71,;5.87,5.71,;4.53,4.94,)|

BDBM310235

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCOC2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,wD:12.11,(3.56,1.09,;3.56,2.63,;2.22,3.4,;2.22,4.94,;.89,2.63,;2.22,1.86,;-.45,1.86,;-.45,3.4,;-1.78,2.63,;-2.25,1.16,;-3.79,1.16,;-4.27,2.63,;-5.81,2.63,;-6.58,1.29,;-8.12,1.29,;-8.89,2.63,;-8.12,3.96,;-6.58,3.96,;-3.02,3.53,;-3.02,5.07,;-4.36,5.84,;-5.69,5.07,;-4.36,7.38,;-3.02,8.15,;-1.69,7.38,;-1.69,5.84,;-.36,5.07,;4.89,3.4,;6.22,2.63,;7.56,3.4,;7.56,4.94,;8.89,5.71,;6.22,5.71,;4.89,4.94,)|

BDBM310237

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CCCO1 |r,wU:16.17,18.19,30.32,(-9.4,16.25,;-8.07,15.48,;-6.74,16.25,;-6.74,17.79,;-5.4,18.56,;-4.07,17.79,;-4.07,16.25,;-2.74,15.48,;-1.4,16.25,;-5.4,15.48,;-5.4,13.94,;-4.16,13.03,;-2.82,13.8,;-1.49,13.03,;-.16,12.26,;-2.82,12.26,;-.16,13.8,;-.16,15.34,;1.18,13.03,;1.18,11.49,;2.51,13.8,;3.84,13.03,;5.18,13.8,;5.18,15.34,;6.51,16.11,;3.84,16.11,;2.51,15.34,;-4.63,11.57,;-6.17,11.57,;-6.65,13.03,;-8.14,13.43,;-8.61,14.89,;-10.15,14.89,;-10.63,13.43,;-9.38,12.52,)|

BDBM310238

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1c(F)cncc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,wD:12.11,(3.2,-3.53,;3.2,-1.99,;1.87,-1.22,;1.87,.32,;.53,-1.99,;1.87,-2.76,;-.8,-2.76,;-.8,-1.22,;-2.13,-1.99,;-2.61,-3.46,;-4.15,-3.46,;-4.63,-1.99,;-6.17,-1.99,;-7.07,-3.24,;-8.54,-2.76,;-8.54,-1.22,;-7.07,-.75,;-3.38,-1.09,;-3.38,.45,;-4.71,1.22,;-6.05,.45,;-4.71,2.76,;-3.38,3.53,;-2.05,2.76,;-2.05,1.22,;-.71,.45,;4.53,-1.22,;5.87,-1.99,;7.2,-1.22,;7.2,.32,;8.54,1.09,;5.87,1.09,;4.53,.32,)|

BDBM310239

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1-c1c(F)cncc1F)c1ncc(C)cn1 |r,wU:12.11,2.2,1.0,(3.2,-3.53,;3.2,-1.99,;1.87,-1.22,;1.87,.32,;.53,-1.99,;1.87,-2.76,;-.8,-2.76,;-.8,-1.22,;-2.13,-1.99,;-2.61,-3.46,;-4.15,-3.46,;-4.63,-1.99,;-6.17,-1.99,;-7.07,-3.24,;-8.54,-2.76,;-8.54,-1.22,;-7.07,-.75,;-3.38,-1.09,;-3.38,.45,;-4.71,1.22,;-6.05,.45,;-4.71,2.76,;-3.38,3.53,;-2.05,2.76,;-2.05,1.22,;-.71,.45,;4.53,-1.22,;5.87,-1.99,;7.2,-1.22,;7.2,.32,;8.54,1.09,;5.87,1.09,;4.53,.32,)|

BDBM310240

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1COC1 |r,wU:16.17,18.19,(-7.74,1.54,;-6.41,.77,;-5.07,1.54,;-5.07,3.08,;-3.74,3.85,;-2.4,3.08,;-2.4,1.54,;-1.07,.77,;.26,1.54,;-3.74,.77,;-3.74,-.77,;-2.49,-1.67,;-1.16,-.9,;.18,-1.67,;-.59,-3.01,;.95,-3.01,;1.66,-1.28,;2.06,.21,;2.75,-2.36,;2.35,-3.85,;4.24,-1.97,;5.33,-3.05,;6.82,-2.66,;7.21,-1.17,;8.7,-.77,;6.13,-.08,;4.64,-.48,;-2.97,-3.14,;-4.51,-3.14,;-4.98,-1.67,;-6.52,-1.67,;-7.61,-.58,;-8.7,-1.67,;-7.61,-2.76,)|

BDBM310241

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1COC1 |r,wU:16.17,18.19,(-7.74,1.54,;-6.41,.77,;-5.07,1.54,;-5.07,3.08,;-3.74,3.85,;-2.4,3.08,;-2.4,1.54,;-1.07,.77,;.26,1.54,;-3.74,.77,;-3.74,-.77,;-2.49,-1.67,;-1.16,-.9,;.18,-1.67,;-.59,-3.01,;.95,-3.01,;1.66,-1.28,;2.06,.21,;2.75,-2.36,;2.35,-3.85,;4.24,-1.97,;5.33,-3.05,;6.82,-2.66,;7.21,-1.17,;8.7,-.77,;6.13,-.08,;4.64,-.48,;-2.97,-3.14,;-4.51,-3.14,;-4.98,-1.67,;-6.52,-1.67,;-7.61,-.58,;-8.7,-1.67,;-7.61,-2.76,)|

BDBM310242

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1[C@@H]1CCOC1 |r,wU:30.32,16.17,18.19,(-7.64,1.54,;-6.31,.77,;-4.98,1.54,;-4.98,3.08,;-3.64,3.85,;-2.31,3.08,;-2.31,1.54,;-.97,.77,;.36,1.54,;-3.64,.77,;-3.64,-.77,;-2.4,-1.67,;-1.06,-.9,;.27,-1.67,;-.5,-3.01,;1.04,-3.01,;1.76,-1.28,;2.16,.21,;2.85,-2.36,;2.45,-3.85,;4.34,-1.97,;4.73,-.48,;6.22,-.08,;7.31,-1.17,;8.8,-.77,;6.91,-2.66,;5.42,-3.05,;-2.87,-3.14,;-4.41,-3.14,;-4.89,-1.67,;-6.43,-1.67,;-7.33,-.43,;-8.8,-.9,;-8.8,-2.44,;-7.33,-2.92,)|

BDBM310243

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.64,1.54,;-6.31,.77,;-4.98,1.54,;-4.98,3.08,;-3.64,3.85,;-2.31,3.08,;-2.31,1.54,;-.97,.77,;.36,1.54,;-3.64,.77,;-3.64,-.77,;-2.4,-1.67,;-1.06,-.9,;.27,-1.67,;-.5,-3.01,;1.04,-3.01,;1.76,-1.28,;2.16,.21,;2.85,-2.36,;2.45,-3.85,;4.34,-1.97,;4.73,-.48,;6.22,-.08,;7.31,-1.17,;8.8,-.77,;6.91,-2.66,;5.42,-3.05,;-2.87,-3.14,;-4.41,-3.14,;-4.89,-1.67,;-6.43,-1.67,;-7.33,-.43,;-8.8,-.9,;-8.8,-2.44,;-7.33,-2.92,)|

BDBM310244

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.29,1.54,;-5.95,.77,;-4.62,1.54,;-4.62,3.08,;-3.29,3.85,;-1.95,3.08,;-1.95,1.54,;-.62,.77,;.71,1.54,;-3.29,.77,;-3.29,-.77,;-2.04,-1.67,;-.71,-.9,;.63,-1.67,;-.14,-3.01,;1.4,-3.01,;2.11,-1.28,;2.51,.21,;3.2,-2.36,;2.8,-3.85,;4.69,-1.97,;5.78,-3.05,;7.27,-2.66,;7.67,-1.17,;9.15,-.77,;6.58,-.08,;5.09,-.48,;-2.52,-3.14,;-4.06,-3.14,;-4.53,-1.67,;-6.07,-1.67,;-6.84,-.34,;-8.38,-.34,;-9.15,-1.67,;-8.38,-3.01,;-6.84,-3.01,)|

BDBM310245

COc1cccc(OC)c1-n1c(NS(=N)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.29,1.54,;-5.95,.77,;-4.62,1.54,;-4.62,3.08,;-3.29,3.85,;-1.95,3.08,;-1.95,1.54,;-.62,.77,;.71,1.54,;-3.29,.77,;-3.29,-.77,;-2.04,-1.67,;-.71,-.9,;.63,-1.67,;-.14,-3.01,;1.4,-3.01,;2.11,-1.28,;2.51,.21,;3.2,-2.36,;2.8,-3.85,;4.69,-1.97,;5.78,-3.05,;7.27,-2.66,;7.67,-1.17,;9.15,-.77,;6.58,-.08,;5.09,-.48,;-2.52,-3.14,;-4.06,-3.14,;-4.53,-1.67,;-6.07,-1.67,;-6.84,-.34,;-8.38,-.34,;-9.15,-1.67,;-8.38,-3.01,;-6.84,-3.01,)|

BDBM310246

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CCN(C1)C(=O)OC(C)(C)C |r,wU:30.32,16.17,18.19,(-5.07,2.47,;-3.73,1.7,;-2.4,2.47,;-2.4,4.01,;-1.07,4.78,;.27,4.01,;.27,2.47,;1.6,1.7,;2.94,2.47,;-1.07,1.7,;-1.07,.16,;.18,-.74,;1.51,.03,;2.85,-.74,;2.08,-2.08,;3.62,-2.08,;4.34,-.35,;4.73,1.14,;5.42,-1.43,;5.03,-2.92,;6.91,-1.04,;8,-2.12,;9.49,-1.73,;9.89,-.24,;11.37,.16,;8.8,.85,;7.31,.45,;-.3,-2.21,;-1.84,-2.21,;-2.31,-.74,;-3.85,-.74,;-4.76,.5,;-6.22,.03,;-6.22,-1.51,;-4.76,-1.99,;-7.31,-2.6,;-6.91,-4.09,;-8.8,-2.2,;-9.89,-3.29,;-11.37,-2.89,;-9.49,-4.78,;-10.98,-4.38,)|

BDBM310247

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCN(C1)C(=O)OC(C)(C)C |r,wU:16.17,18.19,wD:30.32,(-5.07,2.47,;-3.73,1.7,;-2.4,2.47,;-2.4,4.01,;-1.07,4.78,;.27,4.01,;.27,2.47,;1.6,1.7,;2.94,2.47,;-1.07,1.7,;-1.07,.16,;.18,-.74,;1.51,.03,;2.85,-.74,;2.08,-2.08,;3.62,-2.08,;4.34,-.35,;4.73,1.14,;5.42,-1.43,;5.03,-2.92,;6.91,-1.04,;8,-2.12,;9.49,-1.73,;9.89,-.24,;11.37,.16,;8.8,.85,;7.31,.45,;-.3,-2.21,;-1.84,-2.21,;-2.31,-.74,;-3.85,-.74,;-4.76,.5,;-6.22,.03,;-6.22,-1.51,;-4.76,-1.99,;-7.31,-2.6,;-6.91,-4.09,;-8.8,-2.2,;-9.89,-3.29,;-11.37,-2.89,;-9.49,-4.78,;-10.98,-4.38,)|

BDBM310248

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1[C@H]1CCC(=O)N1 |r,wU:30.32,(-6.71,1.18,;-5.38,.41,;-4.05,1.18,;-4.05,2.72,;-2.71,3.49,;-1.38,2.72,;-1.38,1.18,;-.05,.41,;1.29,1.18,;-2.71,.41,;-2.71,-1.13,;-1.47,-2.03,;-.13,-1.26,;1.2,-2.03,;.43,-3.36,;1.97,-3.36,;2.53,-1.26,;3.87,-2.03,;5.2,-1.26,;6.54,-2.03,;7.87,-1.26,;7.87,.28,;9.2,1.05,;6.54,1.05,;5.1,.29,;3.76,1.04,;2.42,1.79,;-1.94,-3.49,;-3.48,-3.49,;-3.96,-2.03,;-5.5,-2.03,;-6.4,-3.28,;-7.87,-2.8,;-7.87,-1.26,;-9.2,-.49,;-6.4,-.78,)|

BDBM310249

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1[C@@H]1CCC(=O)N1 |r,wD:30.32,(-6.71,1.18,;-5.38,.41,;-4.05,1.18,;-4.05,2.72,;-2.71,3.49,;-1.38,2.72,;-1.38,1.18,;-.05,.41,;1.29,1.18,;-2.71,.41,;-2.71,-1.13,;-1.47,-2.03,;-.13,-1.26,;1.2,-2.03,;.43,-3.36,;1.97,-3.36,;2.53,-1.26,;3.87,-2.03,;5.2,-1.26,;6.54,-2.03,;7.87,-1.26,;7.87,.28,;9.2,1.05,;6.54,1.05,;5.1,.29,;3.76,1.04,;2.42,1.79,;-1.94,-3.49,;-3.48,-3.49,;-3.96,-2.03,;-5.5,-2.03,;-6.4,-3.28,;-7.87,-2.8,;-7.87,-1.26,;-9.2,-.49,;-6.4,-.78,)|

BDBM310250

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCNC2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:13.12,3.3,2.1,(4.3,1.33,;2.96,2.1,;2.96,3.64,;1.63,4.41,;1.63,5.95,;.3,3.64,;-.47,2.3,;1.07,2.3,;-1.04,4.41,;-2.37,3.64,;-2.85,2.17,;-4.39,2.17,;-4.86,3.64,;-6.35,4.04,;-6.83,5.5,;-8.37,5.5,;-8.84,4.04,;-7.6,3.13,;-3.62,4.54,;-3.62,6.08,;-4.95,6.85,;-6.28,6.08,;-7.62,6.85,;-4.95,8.39,;-3.62,9.16,;-2.28,8.39,;-2.28,6.85,;-.95,6.08,;.39,6.85,;4.3,4.41,;5.63,3.64,;6.97,4.41,;6.97,5.95,;8.3,6.72,;5.63,6.72,;4.3,5.95,)|

BDBM310251

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310252

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310255

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.84,-.84,;-2.18,-1.61,;-2.65,-3.07,;-4.19,-3.07,;-4.67,-1.61,;-6,-.84,;-6.48,.63,;-8.02,.63,;-8.49,-.84,;-7.25,-1.74,;-3.42,-.7,;-3.42,.84,;-4.76,1.61,;-6.09,.84,;-7.42,1.61,;-4.76,3.15,;-3.42,3.92,;-2.09,3.15,;-2.09,1.61,;-.75,.84,;.58,1.61,;4.49,-.84,;5.83,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;5.83,1.47,;4.49,.7,)|

BDBM310258

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310260

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCOC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.84,-.84,;-2.18,-1.61,;-2.65,-3.07,;-4.19,-3.07,;-4.67,-1.61,;-6,-.84,;-6.48,.63,;-8.02,.63,;-8.49,-.84,;-7.25,-1.74,;-3.42,-.7,;-3.42,.84,;-4.76,1.61,;-6.09,.84,;-7.42,1.61,;-4.76,3.15,;-3.42,3.92,;-2.09,3.15,;-2.09,1.61,;-.75,.84,;.58,1.61,;4.49,-.84,;5.83,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;5.83,1.47,;4.49,.7,)|

BDBM310262

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310264

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310266

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310268

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCOC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM310270

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,wD:33.35,18.19,(-7.42,2.38,;-6.09,1.61,;-4.76,2.38,;-4.76,3.92,;-3.42,4.69,;-2.09,3.92,;-2.09,2.38,;-.75,1.61,;.58,2.38,;-3.42,1.61,;-3.42,.07,;-2.18,-.84,;-.84,-.07,;.49,-.84,;-.28,-2.17,;1.26,-2.17,;1.82,-.07,;1.82,1.47,;3.16,-.84,;3.16,-2.38,;4.49,-3.15,;4.49,-4.69,;5.83,-2.38,;4.49,-.07,;4.49,1.47,;5.83,2.24,;7.16,1.47,;8.49,2.24,;7.16,-.07,;5.83,-.84,;-2.65,-2.3,;-4.19,-2.3,;-4.67,-.84,;-6,-.07,;-6.48,1.4,;-8.02,1.4,;-8.49,-.07,;-7.25,-.97,)|

BDBM310272

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1OCC[C@H]1C |r,wU:16.17,18.19,wD:30.32,34.38,(-7.5,1.65,;-6.16,.88,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.92,;-.84,-1.15,;.49,-1.92,;-.28,-3.26,;1.26,-3.26,;1.82,-1.16,;1.82,.39,;3.16,-1.93,;3.16,-3.46,;4.49,-1.15,;5.83,-1.92,;7.16,-1.15,;7.16,.39,;8.49,1.16,;5.83,1.16,;4.49,.39,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.92,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310273

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310275

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1OCC[C@H]1C |r,wU:16.17,18.19,wD:30.32,34.38,(-7.42,1.58,;-6.09,.81,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.92,;-.84,-1.15,;.49,-1.92,;-.28,-3.26,;1.26,-3.26,;1.82,-1.16,;1.82,.39,;3.16,-1.93,;3.16,-3.46,;4.49,-1.15,;5.83,-1.92,;7.16,-1.15,;7.16,.39,;8.49,1.16,;5.83,1.16,;4.49,.39,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.92,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310277

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2OCC[C@H]2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,17.18,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.84,-.84,;-2.18,-1.61,;-2.65,-3.07,;-4.19,-3.07,;-4.67,-1.61,;-6,-.84,;-6.48,.63,;-8.02,.63,;-8.49,-.84,;-7.25,-1.74,;-7.25,-3.28,;-3.42,-.7,;-3.42,.84,;-4.76,1.61,;-6.09,1.13,;-7.42,1.9,;-4.76,3.15,;-3.42,3.92,;-2.09,3.15,;-2.09,1.61,;-.75,.84,;.58,1.61,;4.49,-.84,;5.83,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;5.83,1.47,;4.49,.7,)|

BDBM310279

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1OCC[C@H]1C |r,wU:16.17,18.19,wD:30.32,34.38,(-7.42,1.58,;-6.09,.81,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.92,;-.84,-1.15,;.49,-1.92,;-.28,-3.26,;1.26,-3.26,;1.82,-1.16,;1.82,.39,;3.16,-1.93,;3.16,-3.46,;4.49,-1.15,;5.83,-1.92,;7.16,-1.15,;7.16,.39,;8.49,1.16,;5.83,1.16,;4.49,.39,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.92,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310281

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H](C)O2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,16.16,(5.16,-3.92,;3.83,-3.15,;3.83,-1.61,;2.49,-.84,;2.49,.7,;1.16,-1.61,;.39,-2.94,;1.93,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.33,-.84,;-5.81,.63,;-7.35,.63,;-7.83,-.84,;-9.16,-1.61,;-6.58,-1.74,;-2.76,-.7,;-2.76,.84,;-1.42,1.61,;-.09,.84,;1.25,1.61,;-1.42,3.15,;-2.76,3.92,;-4.09,3.15,;-4.09,1.61,;-5.42,.98,;-6.76,1.75,;5.16,-.84,;6.49,-1.61,;7.83,-.84,;7.83,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM310283

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.84,-.84,;-2.18,-1.61,;-2.65,-3.07,;-4.19,-3.07,;-4.67,-1.61,;-6,-.84,;-6.48,.63,;-8.02,.63,;-8.49,-.84,;-7.25,-1.74,;-3.42,-.7,;-3.42,.84,;-4.76,1.61,;-6.09,.84,;-7.42,1.61,;-4.76,3.15,;-3.42,3.92,;-2.09,3.15,;-2.09,1.61,;-.75,.84,;.58,1.61,;4.49,-.84,;5.83,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;5.83,1.47,;4.49,.7,)|

BDBM310285

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310287

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCCO2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM310289

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310291

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310293

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;4.49,.32,;5.83,1.09,;7.16,.32,;8.49,1.09,;7.16,-1.22,;5.83,-1.99,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310295

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCOC2)n1-c1c(OC)ncnc1OC)c1cnc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;4.81,.7,;6.14,1.47,;7.48,.7,;8.81,1.47,;7.48,-.84,;6.14,-1.61,)|

BDBM310296

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCOC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM310297

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310299

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,wD:18.19,33.35,(-7.42,2.38,;-6.09,1.61,;-4.76,2.38,;-4.76,3.92,;-3.42,4.69,;-2.09,3.92,;-2.09,2.38,;-.75,1.61,;.58,2.38,;-3.42,1.61,;-3.42,.07,;-2.18,-.84,;-.84,-.07,;.49,-.84,;-.28,-2.17,;1.26,-2.17,;1.82,-.07,;1.82,1.47,;3.16,-.84,;3.16,-2.38,;4.49,-3.15,;5.83,-2.38,;4.49,-4.69,;4.49,-.07,;5.83,-.84,;7.16,-.07,;7.16,1.47,;8.49,2.24,;5.83,2.24,;4.49,1.47,;-2.65,-2.3,;-4.19,-2.3,;-4.67,-.84,;-6,-.07,;-6.48,1.4,;-8.02,1.4,;-8.49,-.07,;-7.25,-.97,)|

BDBM310301

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,wD:18.19,33.35,(-7.42,2.38,;-6.09,1.61,;-4.76,2.38,;-4.76,3.92,;-3.42,4.69,;-2.09,3.92,;-2.09,2.38,;-.75,1.61,;.58,2.38,;-3.42,1.61,;-3.42,.07,;-2.18,-.84,;-.84,-.07,;.49,-.84,;-.28,-2.17,;1.26,-2.17,;1.82,-.07,;1.82,1.47,;3.16,-.84,;3.16,-2.38,;4.49,-3.15,;5.83,-2.38,;4.49,-4.69,;4.49,-.07,;5.83,-.84,;7.16,-.07,;7.16,1.47,;8.49,2.24,;5.83,2.24,;4.49,1.47,;-2.65,-2.3,;-4.19,-2.3,;-4.67,-.84,;-6,-.07,;-6.48,1.4,;-8.02,1.4,;-8.49,-.07,;-7.25,-.97,)|

BDBM310303

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,wD:18.19,33.35,(-7.42,2.38,;-6.09,1.61,;-4.76,2.38,;-4.76,3.92,;-3.42,4.69,;-2.09,3.92,;-2.09,2.38,;-.75,1.61,;.58,2.38,;-3.42,1.61,;-3.42,.07,;-2.18,-.84,;-.84,-.07,;.49,-.84,;-.28,-2.17,;1.26,-2.17,;1.82,-.07,;1.82,1.47,;3.16,-.84,;3.16,-2.38,;4.49,-3.15,;5.83,-2.38,;4.49,-4.69,;4.49,-.07,;5.83,-.84,;7.16,-.07,;7.16,1.47,;8.49,2.24,;5.83,2.24,;4.49,1.47,;-2.65,-2.3,;-4.19,-2.3,;-4.67,-.84,;-6,-.07,;-6.48,1.4,;-8.02,1.4,;-8.49,-.07,;-7.25,-.97,)|

BDBM310305

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310307

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCOCC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM310308

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1[C@H]1CCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;4.49,.32,;5.83,1.09,;7.16,.32,;8.49,1.09,;7.16,-1.22,;5.83,-1.99,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310310

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1[C@H]1CCCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;4.81,.32,;6.14,1.09,;7.48,.32,;8.81,1.09,;7.48,-1.22,;6.14,-1.99,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310312

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCC(C)(C)O2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(5.16,-3.92,;3.83,-3.15,;3.83,-1.61,;2.49,-.84,;2.49,.7,;1.16,-1.61,;.39,-2.94,;1.93,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.33,-.84,;-5.81,.63,;-7.35,.63,;-7.83,-.84,;-9.16,-1.61,;-9.16,-.07,;-6.58,-1.74,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.42,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.25,1.61,;5.16,-.84,;6.49,-1.61,;7.83,-.84,;7.83,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM310314

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM310316

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCCO2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM310318

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCO[C@@H]2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,17.18,wD:13.12,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.84,-.84,;-2.18,-1.61,;-2.65,-3.07,;-4.19,-3.07,;-4.67,-1.61,;-6,-.84,;-6.48,.63,;-8.02,.63,;-8.49,-.84,;-7.25,-1.74,;-7.25,-3.28,;-3.42,-.7,;-3.42,.84,;-4.76,1.61,;-6.09,.84,;-7.42,1.61,;-4.76,3.15,;-3.42,3.92,;-2.09,3.15,;-2.09,1.61,;-.75,.84,;.58,1.61,;4.49,-.84,;5.83,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;5.83,1.47,;4.49,.7,)|

BDBM310320

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCO[C@H]2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,17.18,(4.49,-3.92,;3.16,-3.15,;3.16,-1.61,;1.82,-.84,;1.82,.7,;.49,-1.61,;-.28,-2.94,;1.26,-2.94,;-.84,-.84,;-2.18,-1.61,;-2.65,-3.07,;-4.19,-3.07,;-4.67,-1.61,;-6,-.84,;-6.48,.63,;-8.02,.63,;-8.49,-.84,;-7.25,-1.74,;-7.25,-3.28,;-3.42,-.7,;-3.42,.84,;-4.76,1.61,;-6.09,.84,;-7.42,1.61,;-4.76,3.15,;-3.42,3.92,;-2.09,3.15,;-2.09,1.61,;-.75,.84,;.58,1.61,;4.49,-.84,;5.83,-1.61,;7.16,-.84,;7.16,.7,;8.49,1.47,;5.83,1.47,;4.49,.7,)|

BDBM310321

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCO[C@@H]1C |r,wU:16.17,18.19,34.38,wD:30.32,(-7.42,1.29,;-6.09,.52,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.93,;-.84,-1.15,;.49,-1.93,;-.28,-3.26,;1.26,-3.26,;1.82,-1.15,;1.82,.38,;3.16,-1.93,;3.16,-3.47,;4.49,-1.15,;5.83,-1.93,;7.16,-1.15,;7.16,.38,;8.49,1.15,;5.83,1.15,;4.49,.38,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.93,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310322

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CCO[C@@H]1C |r,wU:30.32,16.17,18.19,34.38,(-7.42,1.29,;-6.09,.52,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.93,;-.84,-1.15,;.49,-1.93,;-.28,-3.26,;1.26,-3.26,;1.82,-1.15,;1.82,.38,;3.16,-1.93,;3.16,-3.47,;4.49,-1.15,;5.83,-1.93,;7.16,-1.15,;7.16,.38,;8.49,1.15,;5.83,1.15,;4.49,.38,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.93,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310324

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCO[C@@H]1C |r,wU:16.17,18.19,34.38,wD:30.32,(-7.42,1.29,;-6.09,.52,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.93,;-.84,-1.15,;.49,-1.93,;-.28,-3.26,;1.26,-3.26,;1.82,-1.15,;1.82,.38,;3.16,-1.93,;3.16,-3.47,;4.49,-1.15,;5.83,-1.93,;7.16,-1.15,;7.16,.38,;8.49,1.15,;5.83,1.15,;4.49,.38,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.93,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310325

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@@H]1CCO[C@@H]1C |r,wU:30.32,16.17,18.19,34.38,(-7.42,1.29,;-6.09,.52,;-4.76,1.29,;-4.76,2.83,;-3.42,3.6,;-2.09,2.83,;-2.09,1.29,;-.75,.52,;.58,1.29,;-3.42,.52,;-3.42,-1.02,;-2.18,-1.93,;-.84,-1.15,;.49,-1.93,;-.28,-3.26,;1.26,-3.26,;1.82,-1.15,;1.82,.38,;3.16,-1.93,;3.16,-3.47,;4.49,-1.15,;5.83,-1.93,;7.16,-1.15,;7.16,.38,;8.49,1.15,;5.83,1.15,;4.49,.38,;-2.65,-3.39,;-4.19,-3.39,;-4.67,-1.93,;-6,-1.15,;-6.48,.31,;-8.02,.31,;-8.49,-1.15,;-7.25,-2.06,;-7.25,-3.6,)|

BDBM310328

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCOC2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM310330

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCOC2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM310332

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCOC2)n1C1(C)CC1)c1cnc(C)cn1 |r|

BDBM310334

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCOC2)n1C1(C)CC1)c1cnc(C)cn1 |r|

BDBM310336

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;4.49,.32,;5.83,1.09,;7.16,.32,;8.49,1.09,;7.16,-1.22,;5.83,-1.99,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310338

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1[C@H]1CCCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;4.81,.32,;6.14,1.09,;7.48,.32,;8.81,1.09,;7.48,-1.22,;6.14,-1.99,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310340

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1CCCOC1 |r,wU:16.17,wD:33.35,18.19,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;.04,-2.17,;1.58,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;4.81,-4.69,;6.14,-2.38,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.24,1.05,;-7.72,1.45,;-8.81,.36,;-8.41,-1.13,;-6.93,-1.53,)|

BDBM310342

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCC(C)(C)O2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(5.16,-3.92,;3.83,-3.15,;3.83,-1.61,;2.49,-.84,;2.49,.7,;1.16,-1.61,;.39,-2.94,;1.93,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.33,-.84,;-5.81,.63,;-7.35,.63,;-7.83,-.84,;-9.16,-1.61,;-9.16,-.07,;-6.58,-1.74,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.42,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.25,1.61,;5.16,-.84,;6.49,-1.61,;7.83,-.84,;7.83,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM310344

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(.36,2.43,;-.97,1.66,;-2.31,2.43,;-2.31,3.97,;-3.64,4.74,;-4.97,3.97,;-4.97,2.43,;-6.31,1.66,;-7.64,2.43,;-3.64,1.66,;-3.64,-.96,;-2.39,-1.87,;-.91,-1.47,;.18,-2.56,;-.91,-3.65,;.58,-4.05,;1.67,-2.16,;2.07,-.67,;2.76,-3.25,;2.36,-4.74,;4.25,-2.85,;5.34,-3.94,;6.82,-3.54,;7.22,-2.05,;8.71,-1.66,;6.13,-.97,;4.65,-1.36,;-2.87,-3.33,;-4.41,-3.33,;-4.88,-1.87,;-6.22,-1.1,;-6.69,.36,;-8.23,.36,;-8.71,-1.1,;-7.46,-2,)|

BDBM310346

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCO1 |r,wU:16.17,18.19,wD:30.32,(.06,2.12,;-1.27,1.35,;-2.61,2.12,;-2.61,3.66,;-3.94,4.43,;-5.28,3.66,;-5.28,2.12,;-6.61,1.35,;-7.94,2.12,;-3.94,1.35,;-3.94,-.65,;-2.7,-1.56,;-1.21,-1.16,;-.12,-2.25,;-1.21,-3.34,;.28,-3.74,;1.37,-1.85,;1.77,-.36,;2.46,-2.94,;2.06,-4.43,;3.94,-2.54,;5.03,-3.63,;6.52,-3.23,;6.92,-1.74,;8.41,-1.35,;5.83,-.65,;4.34,-1.05,;-3.17,-3.02,;-4.71,-3.02,;-5.19,-1.56,;-6.52,-.79,;-6.92,.7,;-8.41,.3,;-8.01,-1.19,)|

BDBM310347

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1[C@H]1CCCO1 |r,wD:28.30,(.96,-4.59,;-.37,-5.36,;-1.71,-4.59,;-1.71,-3.05,;-3.04,-2.28,;-4.37,-3.05,;-4.37,-4.59,;-5.71,-5.36,;-7.04,-4.59,;-3.04,-5.36,;-3.04,-6.9,;-1.79,-7.81,;-.31,-7.41,;.78,-8.5,;1.18,-9.99,;-.31,-9.59,;2.27,-8.1,;3.36,-9.19,;4.85,-8.79,;5.94,-9.88,;7.42,-9.48,;7.82,-7.99,;9.31,-7.6,;6.73,-6.91,;5.24,-7.3,;-2.27,-9.27,;-3.81,-9.27,;-4.29,-7.81,;-5.75,-7.33,;-6.23,-5.87,;-7.77,-5.87,;-8.24,-7.33,;-7,-8.24,)|

BDBM310348

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1[C@H]1CCCO1 |r,wD:28.30,(.83,-4.59,;-.5,-5.36,;-1.83,-4.59,;-1.83,-3.05,;-3.17,-2.28,;-4.5,-3.05,;-4.5,-4.59,;-5.84,-5.36,;-7.17,-4.59,;-3.17,-5.36,;-3.17,-6.9,;-1.92,-7.81,;-.43,-7.41,;.65,-8.5,;1.05,-9.99,;-.43,-9.59,;2.14,-8.1,;3.23,-9.19,;4.72,-8.79,;5.81,-9.88,;7.3,-9.48,;7.69,-7.99,;9.18,-7.6,;6.6,-6.91,;5.12,-7.3,;-2.4,-9.27,;-3.94,-9.27,;-4.41,-7.81,;-5.88,-7.33,;-6.35,-5.87,;-7.89,-5.87,;-8.37,-7.33,;-7.12,-8.24,)|

BDBM310350

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1[C@H]1CCCO1 |r,wD:30.32,(1.29,-6.57,;-.05,-7.34,;-1.38,-6.57,;-1.38,-5.03,;-2.71,-4.26,;-4.05,-5.03,;-4.05,-6.57,;-5.38,-7.34,;-6.72,-6.57,;-2.71,-7.34,;-2.71,-8.88,;-1.47,-9.79,;.02,-9.39,;1.11,-10.48,;1.88,-11.81,;.34,-11.81,;2.44,-9.71,;3.78,-10.48,;5.11,-9.71,;6.44,-10.48,;7.78,-9.71,;7.78,-8.17,;9.11,-7.4,;6.44,-7.4,;5.06,-8.14,;3.73,-7.37,;2.39,-6.6,;-1.94,-11.25,;-3.48,-11.25,;-3.96,-9.79,;-5.42,-9.31,;-5.9,-7.85,;-7.44,-7.85,;-7.92,-9.31,;-6.67,-10.22,)|

BDBM310351

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2[N+]#[C-])nnc1[C@H]1CCCO1 |r,wD:30.32,(1.16,-6.57,;-.17,-7.34,;-1.51,-6.57,;-1.51,-5.03,;-2.84,-4.26,;-4.18,-5.03,;-4.18,-6.57,;-5.51,-7.34,;-6.84,-6.57,;-2.84,-7.34,;-2.84,-8.88,;-1.6,-9.79,;-.11,-9.39,;.98,-10.48,;1.75,-11.81,;.21,-11.81,;2.31,-9.71,;3.65,-10.48,;4.98,-9.71,;6.32,-10.48,;7.65,-9.71,;7.65,-8.17,;8.98,-7.4,;6.32,-7.4,;4.93,-8.14,;3.6,-7.37,;2.27,-6.6,;-2.07,-11.25,;-3.61,-11.25,;-4.09,-9.79,;-5.55,-9.31,;-6.03,-7.85,;-7.57,-7.85,;-8.04,-9.31,;-6.8,-10.22,)|

BDBM310353

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(cn2)C#N)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:31.33,(-8.09,6.51,;-6.76,5.74,;-5.42,6.51,;-5.42,8.05,;-4.09,8.82,;-2.76,8.05,;-2.76,6.51,;-1.42,5.74,;-.09,6.51,;-4.09,5.74,;-4.09,4.2,;-2.84,3.3,;-1.51,4.07,;-.18,3.3,;-.95,1.96,;.59,1.96,;1.16,4.07,;1.16,5.61,;2.49,3.3,;2.49,1.76,;3.83,4.07,;5.16,3.3,;6.49,4.07,;6.54,5.63,;5.16,6.38,;3.83,5.61,;7.87,6.4,;9.21,7.17,;-3.32,1.83,;-4.86,1.83,;-5.33,3.3,;-6.67,4.07,;-7.3,5.38,;-8.68,5.53,;-9.16,4.07,;-7.91,3.16,)|

BDBM310355

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC |r,wU:20.20,10.11,8.9,(9.65,3.52,;8.56,4.61,;7.08,4.21,;6.68,2.72,;5.19,2.32,;4.1,3.41,;4.5,4.9,;5.99,5.3,;2.61,3.01,;2.21,1.52,;1.52,4.1,;1.92,5.59,;.04,3.7,;.43,2.21,;-1.05,2.61,;-1.05,4.79,;-2.54,4.39,;-3.02,2.93,;-4.56,2.93,;-5.03,4.39,;-6.57,4.39,;-7.34,5.73,;-8.88,5.73,;-9.65,4.39,;-8.88,3.06,;-7.34,3.06,;-3.79,5.3,;-3.79,6.84,;-5.12,7.61,;-6.45,6.84,;-7.79,7.61,;-5.12,9.15,;-3.79,9.92,;-2.45,9.15,;-2.45,7.61,;-1.12,6.84,;.22,7.61,)|

BDBM310357

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)ncnc1OC |r,wU:20.20,10.11,8.9,(9.65,3.52,;8.56,4.61,;7.08,4.21,;6.68,2.72,;5.19,2.32,;4.1,3.41,;4.5,4.9,;5.99,5.3,;2.61,3.01,;2.21,1.52,;1.52,4.1,;1.92,5.59,;.04,3.7,;.43,2.21,;-1.05,2.61,;-1.05,4.79,;-2.54,4.39,;-3.02,2.93,;-4.56,2.93,;-5.03,4.39,;-6.57,4.39,;-7.34,5.73,;-8.88,5.73,;-9.65,4.39,;-8.88,3.06,;-7.34,3.06,;-3.79,5.3,;-3.79,6.84,;-5.12,7.61,;-6.45,6.84,;-7.79,7.61,;-5.12,9.15,;-3.79,9.92,;-2.45,9.15,;-2.45,7.61,;-1.12,6.84,;.22,7.61,)|

BDBM310359

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1[C@@H]1COCCO1 |r,wU:36.39,wD:16.16,18.31,(-7.19,9.69,;-5.86,8.92,;-4.52,9.69,;-4.52,11.23,;-3.19,12,;-1.85,11.23,;-1.85,9.69,;-.52,8.92,;.81,9.69,;-3.19,8.92,;-3.19,7.38,;-1.94,6.48,;-.45,6.87,;.63,5.78,;1.03,4.3,;-.45,4.7,;2.12,6.18,;2.52,7.67,;4.01,8.07,;5.1,6.98,;4.7,5.49,;3.21,5.09,;5.79,4.4,;5.39,2.92,;6.48,1.83,;7.97,2.23,;9.05,1.14,;8.36,3.71,;7.27,4.8,;4.41,9.56,;5.89,9.96,;6.29,11.44,;6.98,8.87,;-2.42,5.01,;-3.96,5.01,;-4.43,6.48,;-5.97,6.48,;-6.74,7.81,;-8.28,7.81,;-9.05,6.48,;-8.28,5.14,;-6.74,5.14,)|

BDBM310361

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1[C@@H]1COCCO1 |r,wU:36.39,wD:16.16,18.31,(-7.19,9.69,;-5.86,8.92,;-4.52,9.69,;-4.52,11.23,;-3.19,12,;-1.85,11.23,;-1.85,9.69,;-.52,8.92,;.81,9.69,;-3.19,8.92,;-3.19,7.38,;-1.94,6.48,;-.45,6.87,;.63,5.78,;1.03,4.3,;-.45,4.7,;2.12,6.18,;2.52,7.67,;4.01,8.07,;5.1,6.98,;4.7,5.49,;3.21,5.09,;5.79,4.4,;5.39,2.92,;6.48,1.83,;7.97,2.23,;9.05,1.14,;8.36,3.71,;7.27,4.8,;4.41,9.56,;5.89,9.96,;6.29,11.44,;6.98,8.87,;-2.42,5.01,;-3.96,5.01,;-4.43,6.48,;-5.97,6.48,;-6.74,7.81,;-8.28,7.81,;-9.05,6.48,;-8.28,5.14,;-6.74,5.14,)|

BDBM310363

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCS(C)(C)C1 |r,wU:16.17,18.19,wD:30.32,(-6.76,6.24,;-5.42,5.47,;-4.09,6.24,;-4.09,7.78,;-2.76,8.55,;-1.42,7.78,;-1.42,6.24,;-.09,5.47,;1.25,6.24,;-2.76,5.47,;-2.76,3.93,;-1.51,3.02,;-.18,3.79,;1.16,3.02,;.39,1.69,;1.93,1.69,;2.49,3.79,;2.49,5.33,;3.83,3.02,;3.83,1.48,;5.16,3.79,;6.49,3.02,;7.83,3.79,;7.83,5.33,;9.16,6.1,;6.49,6.1,;5.16,5.33,;-1.99,1.56,;-3.53,1.56,;-4,3.02,;-5.33,3.79,;-5.81,5.26,;-7.35,5.26,;-7.83,3.79,;-9.16,4.56,;-9.16,3.02,;-6.58,2.89,)|

BDBM310364

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCS(=O)(=O)C1 |r,wU:16.17,18.19,wD:30.32,(-6.76,6.24,;-5.42,5.47,;-4.09,6.24,;-4.09,7.78,;-2.76,8.55,;-1.42,7.78,;-1.42,6.24,;-.09,5.47,;1.25,6.24,;-2.76,5.47,;-2.76,3.93,;-1.51,3.02,;-.18,3.79,;1.16,3.02,;.39,1.69,;1.93,1.69,;2.49,3.79,;2.49,5.33,;3.83,3.02,;3.83,1.48,;5.16,3.79,;6.49,3.02,;7.83,3.79,;7.83,5.33,;9.16,6.1,;6.49,6.1,;5.16,5.33,;-1.99,1.56,;-3.53,1.56,;-4,3.02,;-5.33,3.79,;-5.81,5.26,;-7.35,5.26,;-7.83,3.79,;-9.16,4.56,;-9.16,3.02,;-6.58,2.89,)|

BDBM310365

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1-c1c(OC)ncnc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,wD:13.12,(4.49,1.79,;3.16,2.56,;3.16,4.1,;1.82,4.87,;1.82,6.41,;.49,4.1,;-.28,2.76,;1.26,2.76,;-.84,4.87,;-2.18,4.1,;-2.65,2.63,;-4.19,2.63,;-4.67,4.1,;-6,4.87,;-6.48,6.33,;-8.02,6.33,;-8.49,4.87,;-7.25,3.96,;-3.42,5,;-3.42,6.54,;-4.76,7.31,;-6.09,6.54,;-7.42,7.31,;-4.76,8.85,;-3.42,9.62,;-2.09,8.85,;-2.09,7.31,;-.75,6.54,;.58,7.31,;4.49,4.87,;4.49,6.41,;5.83,7.18,;7.16,6.41,;8.49,7.18,;7.16,4.87,;5.83,4.1,)|

BDBM310367

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCS(=O)(=O)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(5.16,1.79,;3.83,2.56,;3.83,4.1,;2.49,4.87,;2.49,6.41,;1.16,4.1,;.39,2.76,;1.93,2.76,;-.18,4.87,;-1.51,4.1,;-1.99,2.63,;-3.53,2.63,;-4,4.1,;-5.33,4.87,;-5.81,6.33,;-7.35,6.33,;-7.83,4.87,;-9.16,5.64,;-9.16,4.1,;-6.58,3.96,;-2.76,5,;-2.76,6.54,;-4.09,7.31,;-5.42,6.54,;-6.76,7.31,;-4.09,8.85,;-2.76,9.62,;-1.42,8.85,;-1.42,7.31,;-.09,6.54,;1.25,7.31,;5.16,4.87,;6.49,4.1,;7.83,4.87,;7.83,6.41,;9.16,7.18,;6.49,7.18,;5.16,6.41,)|

BDBM310369

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CCS(=O)(=O)O1 |r,wU:30.32,16.17,18.19,(-6.76,-4.48,;-5.42,-5.25,;-4.09,-4.48,;-4.09,-2.94,;-2.76,-2.17,;-1.42,-2.94,;-1.42,-4.48,;-.09,-5.25,;1.25,-4.48,;-2.76,-5.25,;-2.76,-6.79,;-1.51,-7.7,;-.18,-6.93,;1.16,-7.7,;.39,-9.03,;1.93,-9.03,;2.49,-6.93,;2.49,-5.39,;3.83,-7.7,;3.83,-9.24,;5.16,-6.93,;6.49,-7.7,;7.83,-6.93,;7.83,-5.39,;9.16,-4.62,;6.49,-4.62,;5.16,-5.39,;-1.99,-9.16,;-3.53,-9.16,;-4,-7.7,;-5.33,-6.93,;-5.81,-5.46,;-7.35,-5.46,;-7.83,-6.93,;-9.16,-6.16,;-9.16,-7.7,;-6.58,-7.83,)|

BDBM310371

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCCCO1 |r,wU:16.17,18.19,wD:30.32,(-7.1,6.93,;-5.77,6.16,;-4.44,6.93,;-4.44,8.47,;-3.1,9.24,;-1.77,8.47,;-1.77,6.93,;-.44,6.16,;.9,6.93,;-3.1,6.16,;-3.1,4.62,;-1.86,3.71,;-.52,4.48,;.81,3.71,;.04,2.38,;1.58,2.38,;2.14,4.48,;2.14,6.02,;3.48,3.71,;3.48,2.17,;4.81,4.48,;6.14,3.71,;7.48,4.48,;7.48,6.02,;8.81,6.79,;6.14,6.79,;4.81,6.02,;-2.33,2.25,;-3.87,2.25,;-4.35,3.71,;-5.84,4.11,;-6.24,5.6,;-7.72,5.99,;-8.81,4.91,;-8.41,3.42,;-6.93,3.02,)|

BDBM310373

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1[C@@H]1CCCCO1 |r,wU:30.32,16.17,18.19,(-7.32,7.46,;-5.99,6.69,;-4.65,7.46,;-4.65,9,;-3.32,9.77,;-1.99,9,;-1.99,7.46,;-.65,6.69,;.68,7.46,;-3.32,6.69,;-3.32,5.15,;-2.07,4.25,;-.59,4.65,;.5,3.56,;-.59,2.47,;.9,2.07,;1.99,3.96,;2.39,5.44,;3.08,2.87,;2.68,1.38,;4.57,3.27,;5.66,2.18,;7.14,2.58,;7.54,4.06,;9.03,4.46,;6.45,5.15,;4.96,4.75,;-2.55,2.78,;-4.09,2.78,;-4.57,4.25,;-6.05,4.65,;-6.45,6.13,;-7.94,6.53,;-9.03,5.44,;-8.63,3.96,;-7.14,3.56,)|

BDBM310375

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.32,7.46,;-5.99,6.69,;-4.65,7.46,;-4.65,9,;-3.32,9.77,;-1.99,9,;-1.99,7.46,;-.65,6.69,;.68,7.46,;-3.32,6.69,;-3.32,5.15,;-2.07,4.25,;-.59,4.65,;.5,3.56,;-.59,2.47,;.9,2.07,;1.99,3.96,;2.39,5.44,;3.08,2.87,;2.68,1.38,;4.57,3.27,;5.66,2.18,;7.14,2.58,;7.54,4.06,;9.03,4.46,;6.45,5.15,;4.96,4.75,;-2.55,2.78,;-4.09,2.78,;-4.57,4.25,;-6.05,4.65,;-6.45,6.13,;-7.94,6.53,;-9.03,5.44,;-8.63,3.96,;-7.14,3.56,)|

BDBM310377

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,(3.77,1.54,;2.68,2.63,;3.08,4.12,;1.99,5.2,;2.39,6.69,;.5,4.81,;-.59,3.72,;.9,3.32,;-.59,5.89,;-2.07,5.5,;-2.55,4.03,;-4.09,4.03,;-4.57,5.5,;-6.05,5.89,;-6.45,7.38,;-7.94,7.78,;-9.03,6.69,;-8.63,5.2,;-7.14,4.81,;-3.32,6.4,;-3.32,7.94,;-4.65,8.71,;-5.99,7.94,;-7.32,8.71,;-4.65,10.25,;-3.32,11.02,;-1.99,10.25,;-1.99,8.71,;-.65,7.94,;.68,8.71,;4.57,4.51,;5.66,3.43,;7.14,3.82,;7.54,5.31,;9.03,5.71,;6.45,6.4,;4.96,6,)|

BDBM310379

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H](C)O2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM310381

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:13.12,3.3,2.1,(3.77,1.54,;2.68,2.63,;3.08,4.12,;1.99,5.2,;2.39,6.69,;.5,4.81,;-.59,3.72,;.9,3.32,;-.59,5.89,;-2.07,5.5,;-2.55,4.03,;-4.09,4.03,;-4.57,5.5,;-6.05,5.89,;-6.45,7.38,;-7.94,7.78,;-9.03,6.69,;-8.63,5.2,;-7.14,4.81,;-3.32,6.4,;-3.32,7.94,;-4.65,8.71,;-5.99,7.94,;-7.32,8.71,;-4.65,10.25,;-3.32,11.02,;-1.99,10.25,;-1.99,8.71,;-.65,7.94,;.68,8.71,;4.57,4.51,;5.66,3.43,;7.14,3.82,;7.54,5.31,;9.03,5.71,;6.45,6.4,;4.96,6,)|

BDBM310383

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:14.13,4.4,3.2,(3.37,1.73,;3.77,3.22,;2.68,4.31,;3.08,5.8,;1.99,6.89,;2.39,8.37,;.5,6.49,;-.59,5.4,;.9,5,;-.59,7.58,;-2.07,7.18,;-2.55,5.71,;-4.09,5.71,;-4.57,7.18,;-6.05,7.58,;-6.45,9.06,;-7.94,9.46,;-9.03,8.37,;-8.63,6.89,;-7.14,6.49,;-3.32,8.08,;-3.32,9.62,;-4.65,10.39,;-5.99,9.62,;-7.32,10.39,;-4.65,11.93,;-3.32,12.7,;-1.99,11.93,;-1.99,10.39,;-.65,9.62,;.68,10.39,;4.57,6.2,;5.66,5.11,;7.14,5.51,;7.54,6.99,;9.03,7.39,;6.45,8.08,;4.96,7.68,)|

BDBM310385

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.32,8.32,;-5.99,7.55,;-4.65,8.32,;-4.65,9.86,;-3.32,10.63,;-1.99,9.86,;-1.99,8.32,;-.65,7.55,;.68,8.32,;-3.32,7.55,;-3.32,6.01,;-2.07,5.1,;-.59,5.5,;.5,4.41,;-.59,3.32,;.9,2.92,;1.99,4.81,;2.39,6.3,;3.08,3.72,;2.68,2.23,;4.57,4.12,;5.66,3.03,;7.14,3.43,;7.54,4.92,;9.03,5.31,;6.45,6,;4.96,5.61,;-2.55,3.64,;-4.09,3.64,;-4.57,5.1,;-6.05,5.5,;-6.45,6.99,;-7.94,7.39,;-9.03,6.3,;-8.63,4.81,;-7.14,4.41,)|

BDBM310387

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC |r,wU:20.20,10.11,8.9,(9.6,4.17,;8.46,5.31,;6.97,4.92,;6.57,3.43,;5.08,3.03,;4,4.12,;4.39,5.61,;5.88,6,;2.51,3.72,;2.11,2.23,;1.42,4.81,;1.82,6.3,;-.07,4.41,;-1.16,3.32,;.33,2.92,;-1.16,5.5,;-2.65,5.1,;-3.12,3.64,;-4.66,3.64,;-5.14,5.1,;-6.62,5.5,;-7.02,6.99,;-8.51,7.39,;-9.6,6.3,;-9.2,4.81,;-7.71,4.41,;-3.89,6.01,;-3.89,7.55,;-5.22,8.32,;-6.56,7.55,;-7.89,8.32,;-5.22,9.86,;-3.89,10.63,;-2.56,9.86,;-2.56,8.32,;-1.22,7.55,;.11,8.32,)|

BDBM310388

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC |r,wU:20.20,10.11,8.9,(9.57,3.84,;8.48,4.93,;7,4.53,;6.6,3.04,;5.11,2.65,;4.02,3.74,;4.42,5.22,;5.91,5.62,;2.53,3.34,;2.14,1.85,;1.45,4.43,;1.84,5.91,;-.04,4.03,;.36,2.54,;-1.13,2.94,;-1.13,5.12,;-2.62,4.72,;-3.09,3.25,;-4.63,3.25,;-5.11,4.72,;-6.6,5.12,;-7,6.6,;-8.48,7,;-9.57,5.91,;-9.17,4.43,;-7.69,4.03,;-3.86,5.62,;-3.86,7.16,;-5.2,7.93,;-6.53,7.16,;-7.87,7.93,;-5.2,9.47,;-3.86,10.24,;-2.53,9.47,;-2.53,7.93,;-1.2,7.16,;.14,7.93,)|

BDBM310389

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1CCC(C)(C)O1 |r,wU:16.17,wD:33.35,18.19,(-6.76,8.59,;-5.42,7.82,;-4.09,8.59,;-4.09,10.13,;-2.76,10.9,;-1.42,10.13,;-1.42,8.59,;-.09,7.82,;1.25,8.59,;-2.76,7.82,;-2.76,6.28,;-1.51,5.37,;-.18,6.14,;1.16,5.37,;.39,4.04,;1.93,4.04,;2.49,6.14,;2.49,7.68,;3.83,5.37,;3.83,3.83,;5.16,3.06,;5.16,1.52,;6.49,3.83,;5.16,6.14,;6.49,5.37,;7.83,6.14,;7.83,7.68,;9.16,8.45,;6.49,8.45,;5.16,7.68,;-1.99,3.91,;-3.53,3.91,;-4,5.37,;-5.33,6.14,;-5.81,7.61,;-7.35,7.61,;-7.83,6.14,;-9.16,6.91,;-9.16,5.37,;-6.58,5.24,)|

BDBM310391

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1[C@H]1CCCCO1 |r,wU:16.17,wD:33.35,18.19,(-7.1,8.53,;-5.77,7.76,;-4.44,8.53,;-4.44,10.07,;-3.1,10.84,;-1.77,10.07,;-1.77,8.53,;-.44,7.76,;.9,8.53,;-3.1,7.76,;-3.1,6.22,;-1.86,5.32,;-.52,6.09,;.81,5.32,;.04,3.98,;1.58,3.98,;2.14,6.09,;2.14,7.63,;3.48,5.32,;3.48,3.78,;4.81,3.01,;4.81,1.47,;6.14,3.78,;4.81,6.09,;4.81,7.63,;6.14,8.4,;7.48,7.63,;8.81,8.4,;7.48,6.09,;6.14,5.32,;-2.33,3.85,;-3.87,3.85,;-4.35,5.32,;-5.84,5.71,;-6.24,7.2,;-7.72,7.6,;-8.81,6.51,;-8.41,5.02,;-6.93,4.63,)|

BDBM310393

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,wD:33.35,18.19,(-7.42,8.32,;-6.09,7.55,;-4.76,8.32,;-4.76,9.86,;-3.42,10.63,;-2.09,9.86,;-2.09,8.32,;-.75,7.55,;.58,8.32,;-3.42,7.55,;-3.42,6.01,;-2.18,5.1,;-.84,5.87,;.49,5.1,;-.28,3.77,;1.26,3.77,;1.82,5.87,;1.82,7.41,;3.16,5.1,;3.16,3.56,;4.49,2.79,;5.83,3.56,;4.49,1.25,;4.49,5.87,;4.49,7.41,;5.83,8.18,;7.16,7.41,;8.49,8.18,;7.16,5.87,;5.83,5.1,;-2.65,3.64,;-4.19,3.64,;-4.67,5.1,;-6,5.87,;-6.48,7.33,;-8.02,7.33,;-8.49,5.87,;-7.25,4.96,)|

BDBM310395

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1[C@H]1CCCOC1 |r,wU:16.17,wD:33.35,18.19,(-7.1,8.53,;-5.77,7.76,;-4.44,8.53,;-4.44,10.07,;-3.1,10.84,;-1.77,10.07,;-1.77,8.53,;-.44,7.76,;.9,8.53,;-3.1,7.76,;-3.1,6.22,;-1.86,5.32,;-.52,6.09,;.81,5.32,;.04,3.98,;1.58,3.98,;2.14,6.09,;2.14,7.63,;3.48,5.32,;3.48,3.78,;4.81,3.01,;4.81,1.47,;6.14,3.78,;4.81,6.09,;4.81,7.63,;6.14,8.4,;7.48,7.63,;8.81,8.4,;7.48,6.09,;6.14,5.32,;-2.33,3.85,;-3.87,3.85,;-4.35,5.32,;-5.84,5.71,;-6.24,7.2,;-7.72,7.6,;-8.81,6.51,;-8.41,5.02,;-6.93,4.63,)|

BDBM310397

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1[C@@H]1COCCO1 |r,wU:33.35,16.17,wD:18.19,(-7.32,9.55,;-5.99,8.78,;-4.65,9.55,;-4.65,11.09,;-3.32,11.86,;-1.99,11.09,;-1.99,9.55,;-.65,8.78,;.68,9.55,;-3.32,8.78,;-3.32,7.24,;-2.07,6.34,;-.59,6.73,;.5,5.65,;-.59,4.56,;.9,4.16,;1.99,6.04,;2.39,7.53,;3.08,4.96,;2.68,3.47,;3.77,2.38,;3.37,.89,;5.26,2.78,;4.57,5.35,;4.96,6.84,;6.45,7.24,;7.54,6.15,;9.03,6.55,;7.14,4.66,;5.66,4.27,;-2.55,4.87,;-4.09,4.87,;-4.57,6.34,;-6.05,6.73,;-6.45,8.22,;-7.94,8.62,;-9.03,7.53,;-8.63,6.04,;-7.14,5.65,)|

BDBM310399

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(C)cn2)nnc1[C@H]1CCCO1 |r,wD:30.32,16.17,18.19,(-7.42,6.24,;-6.09,5.47,;-4.76,6.24,;-4.76,7.78,;-3.42,8.55,;-2.09,7.78,;-2.09,6.24,;-.75,5.47,;.58,6.24,;-3.42,5.47,;-3.42,3.93,;-2.18,3.02,;-.84,3.79,;.49,3.02,;-.28,1.69,;1.26,1.69,;1.82,3.79,;1.82,5.33,;3.16,3.02,;3.16,1.48,;4.49,3.79,;5.83,3.02,;7.16,3.79,;7.16,5.33,;8.49,6.1,;5.83,6.1,;4.49,5.33,;-2.65,1.56,;-4.19,1.56,;-4.67,3.02,;-6,3.79,;-6.48,5.26,;-8.02,5.26,;-8.49,3.79,;-7.25,2.89,)|

BDBM310401

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCC(C)(C)O2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM310403

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CCCS1 |r,wU:16.17,18.19,wD:30.32,(-7.42,6.24,;-6.09,5.47,;-4.76,6.24,;-4.76,7.78,;-3.42,8.55,;-2.09,7.78,;-2.09,6.24,;-.75,5.47,;.58,6.24,;-3.42,5.47,;-3.42,3.93,;-2.18,3.02,;-.84,3.79,;.49,3.02,;-.28,1.69,;1.26,1.69,;1.82,3.79,;1.82,5.33,;3.16,3.02,;3.16,1.48,;4.49,3.79,;5.83,3.02,;7.16,3.79,;7.16,5.33,;8.49,6.1,;5.83,6.1,;4.49,5.33,;-2.65,1.56,;-4.19,1.56,;-4.67,3.02,;-6,3.79,;-6.48,5.26,;-8.02,5.26,;-8.49,3.79,;-7.25,2.89,)|

BDBM310405

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H](C)O2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM310407

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CN(CCO1)S(C)(=O)=O |r,wU:16.17,18.19,wD:30.32,(-6.71,5.78,;-5.37,5.01,;-4.04,5.78,;-4.04,7.32,;-2.7,8.09,;-1.37,7.32,;-1.37,5.78,;-.04,5.01,;1.3,5.78,;-2.7,5.01,;-2.7,3.47,;-1.46,2.57,;-.13,3.34,;1.21,2.57,;2.54,1.8,;-.13,1.8,;2.54,3.34,;2.54,4.88,;3.88,2.57,;3.88,1.03,;5.21,3.34,;6.54,2.57,;7.88,3.34,;7.88,4.88,;9.21,5.65,;6.54,5.65,;5.21,4.88,;-1.93,1.1,;-3.47,1.1,;-3.95,2.57,;-5.44,2.97,;-5.84,4.45,;-7.32,4.85,;-8.41,3.76,;-8.01,2.28,;-6.53,1.88,;-7.72,6.34,;-8.12,7.83,;-9.21,5.94,;-6.24,6.74,)|

BDBM310409

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2Cc3ccccc3O2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,13.12,2.1,(-6.73,6.59,;-5.48,5.68,;-5.65,4.15,;-4.4,3.24,;-4.56,1.71,;-2.99,3.87,;-2.37,2.46,;-3.62,5.28,;-1.59,4.5,;-.34,3.59,;-.34,2.05,;1.12,1.58,;2.03,2.82,;3.57,2.82,;4.47,1.58,;5.94,2.05,;7.27,1.28,;8.61,2.05,;8.61,3.59,;7.27,4.36,;5.94,3.59,;4.47,4.07,;1.12,4.07,;1.6,5.53,;3.11,5.85,;4.14,4.71,;5.64,5.03,;3.58,7.32,;2.55,8.46,;1.05,8.14,;.57,6.68,;-.94,6.36,;-1.97,7.5,;-7.05,3.52,;-7.21,1.99,;-8.62,1.37,;-9.87,2.27,;-11.27,1.64,;-9.71,3.8,;-8.3,4.43,)|

BDBM310411

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1NC(=O)c2ccccc12 |r,wU:16.17,18.19,wD:30.32,(-6.76,7.96,;-5.42,7.19,;-4.09,7.96,;-4.09,9.5,;-2.76,10.27,;-1.42,9.5,;-1.42,7.96,;-.09,7.19,;1.24,7.96,;-2.76,7.19,;-2.76,5.65,;-1.51,4.75,;-.18,5.52,;1.16,4.75,;2.49,3.98,;-.18,3.98,;2.49,5.52,;2.49,7.06,;3.82,4.75,;3.82,3.21,;5.16,5.52,;6.49,4.75,;7.82,5.52,;7.82,7.06,;9.16,7.83,;6.49,7.83,;5.16,7.06,;-1.99,3.28,;-3.53,3.28,;-4,4.75,;-5.54,4.75,;-6.45,5.99,;-7.91,5.52,;-9.16,6.42,;-7.91,3.98,;-9.06,2.95,;-8.74,1.44,;-7.27,.96,;-6.13,2,;-6.45,3.5,)|

BDBM310413

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2NC(=O)c3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,13.12,2.1,(-5.8,10.61,;-4.56,9.7,;-3.15,10.33,;-1.91,9.42,;-.5,10.05,;-2.07,7.89,;-.54,7.73,;-3.6,8.05,;-2.23,6.36,;-.98,5.45,;.48,5.93,;1.39,4.68,;.48,3.44,;.96,1.97,;.05,.73,;.96,-.52,;.48,-1.98,;2.42,-.04,;3.76,-.81,;5.09,-.04,;5.09,1.5,;3.76,2.27,;2.42,1.5,;-.98,3.91,;-2.23,3.01,;-3.63,3.63,;-3.8,5.17,;-5.2,5.79,;-4.88,2.73,;-4.72,1.2,;-3.31,.57,;-2.07,1.48,;-.66,.85,;-.5,-.68,;-2.99,11.86,;-4.24,12.76,;-4.08,14.3,;-2.67,14.92,;-2.51,16.45,;-1.42,14.02,;-1.58,12.49,)|

BDBM310415

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COc3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:13.12,wD:3.3,2.1,(-5.61,10.4,;-4.37,9.49,;-2.96,10.12,;-1.72,9.21,;-.31,9.84,;-1.88,7.68,;-.35,7.52,;-3.41,7.84,;-2.04,6.15,;-.79,5.24,;.67,5.72,;1.58,4.47,;.67,3.23,;1.15,1.76,;.24,.52,;1.15,-.73,;2.61,-.25,;3.95,-1.02,;5.28,-.25,;5.28,1.29,;3.95,2.06,;2.61,1.29,;-.79,3.7,;-2.04,2.8,;-3.44,3.42,;-3.61,4.96,;-5.01,5.58,;-4.69,2.52,;-4.53,.99,;-3.12,.36,;-1.88,1.27,;-.47,.64,;-.31,-.89,;-2.8,11.65,;-4.05,12.55,;-3.89,14.09,;-2.48,14.71,;-2.32,16.24,;-1.23,13.81,;-1.39,12.28,)|

BDBM310417

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1ccccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.53,-3.92,;3.2,-3.15,;3.2,-1.61,;1.87,-.84,;1.87,.7,;.53,-1.61,;1.87,-2.38,;-.8,-2.38,;-.8,-.84,;-2.13,-1.61,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-2.85,;-8.54,-2.38,;-8.54,-.84,;-7.07,-.36,;-3.38,-.7,;-3.38,.84,;-2.05,1.61,;-2.05,3.15,;-3.38,3.92,;-4.71,3.15,;-4.71,1.61,;-6.05,.84,;-7.38,1.61,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,)|

BDBM310418

CCc1ccccc1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@@H]1CCCO1 |r,wU:14.15,16.17,wD:29.31,(-7.38,1.61,;-6.05,.84,;-4.71,1.61,;-4.71,3.15,;-3.38,3.92,;-2.05,3.15,;-2.05,1.61,;-3.38,.84,;-3.38,-.7,;-2.13,-1.61,;-.8,-.84,;.53,-1.61,;1.87,-2.38,;-.8,-2.38,;1.87,-.84,;1.87,.7,;3.2,-1.61,;3.2,-3.15,;4.53,-3.92,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-2.85,;-8.54,-2.38,;-8.54,-.84,;-7.07,-.36,)|

BDBM310419

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1ccccc1C)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.53,-3.92,;3.2,-3.15,;3.2,-1.61,;1.87,-.84,;1.87,.7,;.53,-1.61,;1.87,-2.38,;-.8,-2.38,;-.8,-.84,;-2.13,-1.61,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-2.85,;-8.54,-2.38,;-8.54,-.84,;-7.07,-.36,;-3.38,-.7,;-3.38,.84,;-2.05,1.61,;-2.05,3.15,;-3.38,3.92,;-4.71,3.15,;-4.71,1.61,;-6.05,.84,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,)|

BDBM310420

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1ccccc1Cl)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.53,-3.92,;3.2,-3.15,;3.2,-1.61,;1.87,-.84,;1.87,.7,;.53,-1.61,;1.87,-2.38,;-.8,-2.38,;-.8,-.84,;-2.13,-1.61,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-2.85,;-8.54,-2.38,;-8.54,-.84,;-7.07,-.36,;-3.38,-.7,;-3.38,.84,;-2.05,1.61,;-2.05,3.15,;-3.38,3.92,;-4.71,3.15,;-4.71,1.61,;-6.05,.84,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,)|

BDBM310421

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1ccccc1F)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.53,-3.92,;3.2,-3.15,;3.2,-1.61,;1.87,-.84,;1.87,.7,;.53,-1.61,;1.87,-2.38,;-.8,-2.38,;-.8,-.84,;-2.13,-1.61,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-2.85,;-8.54,-2.38,;-8.54,-.84,;-7.07,-.36,;-3.38,-.7,;-3.38,.84,;-2.05,1.61,;-2.05,3.15,;-3.38,3.92,;-4.71,3.15,;-4.71,1.61,;-6.05,.84,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,)|

BDBM310422

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM310424

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM310426

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@H](C)O2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,20.20,23.24,(10.08,2.99,;8.99,4.08,;7.5,3.68,;7.1,2.2,;5.61,1.8,;4.52,2.89,;4.92,4.37,;6.41,4.77,;3.04,2.49,;2.64,1,;1.95,3.58,;2.35,5.06,;.46,3.18,;-.31,1.85,;1.23,1.85,;-.63,4.27,;-2.12,3.87,;-2.59,2.4,;-4.13,2.4,;-4.61,3.87,;-6.1,4.27,;-6.57,5.73,;-8.11,5.73,;-8.59,4.27,;-10.08,3.87,;-7.34,3.36,;-3.36,4.77,;-3.36,6.31,;-4.7,7.08,;-6.03,6.31,;-7.36,7.08,;-4.7,8.62,;-3.36,9.39,;-2.03,8.62,;-2.03,7.08,;-.7,6.31,;.64,7.08,)|

BDBM310427

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r|

BDBM310429

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@@H]1CC[C@H](C)O1 |r|

BDBM310431

COc1c(Br)cc(Br)c(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CCOC1 |r,wU:32.34,18.19,20.21,(-7.02,-4.77,;-5.68,-5.54,;-4.35,-4.77,;-4.35,-3.23,;-5.68,-2.46,;-3.02,-2.46,;-1.68,-3.23,;-.35,-2.46,;-1.68,-4.77,;-.35,-5.54,;.99,-4.77,;-3.02,-5.54,;-3.02,-7.44,;-1.77,-8.35,;-.44,-7.58,;.9,-8.35,;-.44,-9.12,;2.23,-9.12,;2.23,-7.58,;2.23,-6.04,;3.57,-8.35,;3.57,-9.89,;4.9,-7.58,;6.23,-8.35,;7.57,-7.58,;7.57,-6.04,;8.9,-5.27,;6.23,-5.27,;4.9,-6.04,;-2.25,-9.81,;-3.79,-9.81,;-4.26,-8.35,;-5.59,-7.58,;-6.07,-6.11,;-7.61,-6.11,;-8.09,-7.58,;-6.84,-8.48,)|

BDBM310432

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1COCCO1 |r,wU:16.17,wD:18.19,33.35,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;2.14,-1.61,;-.52,-1.61,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;4.81,-4.69,;6.14,-2.38,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.24,1.05,;-7.72,1.45,;-8.81,.36,;-8.41,-1.13,;-6.93,-1.53,)|

BDBM310433

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@@H]1COCCO1 |r,wU:16.17,33.35,wD:18.19,(-7.1,-3.28,;-5.77,-4.05,;-4.44,-3.28,;-4.44,-1.74,;-3.1,-.97,;-1.77,-1.74,;-1.77,-3.28,;-.44,-4.05,;.9,-3.28,;-3.1,-4.05,;-3.1,-5.59,;-1.86,-6.49,;-.52,-5.72,;.81,-6.49,;2.14,-7.26,;-.52,-7.26,;2.14,-5.72,;2.14,-4.18,;3.48,-6.49,;3.48,-8.03,;4.81,-8.8,;4.81,-10.34,;6.14,-8.03,;4.81,-5.72,;6.14,-6.49,;7.48,-5.72,;7.48,-4.18,;8.81,-3.41,;6.14,-3.41,;4.81,-4.18,;-2.33,-7.96,;-3.87,-7.96,;-4.35,-6.49,;-5.84,-6.09,;-6.24,-4.61,;-7.72,-4.21,;-8.81,-5.3,;-8.41,-6.78,;-6.93,-7.18,)|

BDBM310434

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1CN2CCC[C@H]2CO1 |r,wU:36.39,30.32,18.19,16.17,(3.2,5.72,;1.71,5.32,;.62,6.41,;1.02,7.89,;-.07,8.98,;-1.56,8.59,;-1.96,7.1,;-3.44,6.7,;-4.53,7.79,;-.87,6.01,;-1.27,4.52,;-.24,3.38,;1.25,3.78,;2.02,2.44,;.69,1.67,;2.79,1.11,;3.35,3.21,;3.17,4.68,;4.81,2.55,;5.14,1,;5.78,3.53,;7.27,3.13,;8.35,4.22,;7.96,5.71,;9.04,6.8,;6.47,6.11,;5.38,5.02,;-1.01,2.04,;-2.51,2.36,;-2.67,3.89,;-4.01,4.66,;-5.34,3.89,;-6.67,4.66,;-8.14,4.19,;-9.04,5.43,;-8.14,6.68,;-6.67,6.2,;-5.34,6.97,;-4.01,6.2,)|

BDBM310435

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COc3ccccc3O2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,(6.1,1.06,;4.77,1.83,;4.77,3.37,;3.43,4.14,;3.43,5.68,;2.1,3.37,;3.43,2.6,;.76,2.6,;.76,4.14,;-.57,3.37,;-1.05,1.91,;-2.59,1.91,;-3.06,3.37,;-4.55,3.77,;-4.95,5.26,;-6.43,5.66,;-7.52,4.57,;-9.01,4.97,;-10.1,3.88,;-9.7,2.39,;-8.21,1.99,;-7.13,3.08,;-5.64,2.68,;-1.82,4.28,;-1.82,5.82,;-3.15,6.59,;-4.48,5.82,;-5.82,6.59,;-3.15,8.13,;-1.82,8.9,;-.48,8.13,;-.48,6.59,;.85,5.82,;2.19,6.59,;6.1,4.14,;7.43,3.37,;8.77,4.14,;8.77,5.68,;10.1,6.45,;7.43,6.45,;6.1,5.68,)|

BDBM310437

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1C1CCOCC1)c1cnc(C)cn1 |r|

BDBM310439

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@H](C)O2)n1C1CCOCC1)c1cnc(C)cn1 |r|

BDBM310441

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:13.12,3.3,2.1,(3.77,.96,;2.68,2.05,;3.08,3.54,;1.99,4.63,;2.39,6.11,;.5,4.23,;1.59,3.14,;-.99,3.83,;-.59,5.32,;-2.07,4.92,;-2.55,3.45,;-4.09,3.45,;-4.57,4.92,;-6.05,5.32,;-6.45,6.8,;-7.94,7.2,;-9.03,6.11,;-8.63,4.63,;-7.14,4.23,;-3.32,5.82,;-3.32,7.36,;-1.99,8.13,;-.65,7.36,;.68,8.13,;-1.99,9.67,;-3.32,10.44,;-4.65,9.67,;-4.65,8.13,;-5.99,7.36,;-7.32,8.13,;4.57,3.94,;4.96,5.42,;6.45,5.82,;7.54,4.73,;9.03,5.13,;7.14,3.25,;5.66,2.85,)|

BDBM310443

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2cn3ccccc3n2)nnc1[C@H]1COCCO1 |r,wU:18.19,wD:35.38,16.17,(-7.6,3.18,;-6.27,2.41,;-4.94,3.18,;-4.94,4.72,;-3.6,5.49,;-2.27,4.72,;-2.27,3.18,;-.94,2.41,;.4,3.18,;-3.6,2.41,;-3.6,.87,;-2.36,-.04,;-.87,.36,;.22,-.73,;-.87,-1.82,;.62,-2.22,;1.71,-.33,;2.11,1.16,;2.8,-1.42,;2.4,-2.91,;3.49,-4,;3.09,-5.49,;4.97,-3.6,;4.28,-1.02,;4.76,.44,;6.3,.44,;7.33,1.59,;8.84,1.27,;9.31,-.2,;8.28,-1.34,;6.77,-1.02,;5.53,-1.93,;-2.83,-1.5,;-4.37,-1.5,;-4.85,-.04,;-6.34,.36,;-6.74,1.85,;-8.22,2.24,;-9.31,1.16,;-8.91,-.33,;-7.43,-.73,)|

BDBM310444

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.32,1.89,;-5.99,1.12,;-4.65,1.89,;-4.65,3.43,;-3.32,4.2,;-1.99,3.43,;-1.99,1.89,;-.65,1.12,;.68,1.89,;-3.32,1.12,;-3.32,-.42,;-2.07,-1.33,;-.59,-.93,;.5,-2.02,;-.59,-3.11,;.9,-3.51,;1.99,-1.62,;2.39,-.13,;3.08,-2.71,;2.68,-4.2,;4.57,-2.31,;4.96,-.82,;6.45,-.42,;7.54,-1.51,;9.03,-1.11,;7.14,-3,;5.66,-3.4,;-2.55,-2.79,;-4.09,-2.79,;-4.57,-1.33,;-6.05,-.93,;-6.45,.56,;-7.94,.96,;-9.03,-.13,;-8.63,-1.62,;-7.14,-2.02,)|

BDBM310446

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@@H]1CCCN(C)C1 |r,wU:30.32,16.17,18.19,(-6.76,1.22,;-5.43,.45,;-4.09,1.22,;-4.09,2.76,;-2.76,3.53,;-1.42,2.76,;-1.42,1.22,;-.09,.45,;1.24,1.22,;-2.76,.45,;-2.76,-1.09,;-1.51,-1.99,;-.18,-1.22,;1.15,-1.99,;.38,-3.33,;1.92,-3.33,;2.49,-1.22,;2.49,.32,;3.82,-1.99,;3.82,-3.53,;5.16,-1.22,;6.49,-1.99,;7.82,-1.22,;7.82,.32,;9.16,1.09,;6.49,1.09,;5.16,.32,;-1.99,-3.46,;-3.53,-3.46,;-4,-1.99,;-5.49,-1.59,;-5.89,-.11,;-7.38,.29,;-8.47,-.8,;-8.07,-2.28,;-9.16,-3.37,;-6.58,-2.68,)|

BDBM310448

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM310450

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,18.19,wD:30.32,(-7.42,1.22,;-6.09,.45,;-4.76,1.22,;-4.76,2.76,;-3.42,3.53,;-2.09,2.76,;-2.09,1.22,;-.75,.45,;.58,1.22,;-3.42,.45,;-3.42,-1.09,;-2.18,-1.99,;-.84,-1.22,;.49,-1.99,;-.28,-3.33,;1.26,-3.33,;1.82,-1.22,;1.82,.32,;3.16,-1.99,;3.16,-3.53,;4.49,-1.22,;5.83,-1.99,;7.16,-1.22,;7.16,.32,;8.49,1.09,;5.83,1.09,;4.49,.32,;-2.65,-3.46,;-4.19,-3.46,;-4.67,-1.99,;-6,-1.22,;-6.48,.24,;-8.02,.24,;-8.49,-1.22,;-7.25,-2.13,)|

BDBM310452

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310454

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1[C@@H]1COCCO1 |r,wU:30.32,16.17,18.19,(-7.1,1.22,;-5.77,.45,;-4.44,1.22,;-4.44,2.76,;-3.1,3.53,;-1.77,2.76,;-1.77,1.22,;-.44,.45,;.9,1.22,;-3.1,.45,;-3.1,-1.09,;-1.86,-1.99,;-.52,-1.22,;.81,-1.99,;.04,-3.33,;1.58,-3.33,;2.14,-1.22,;2.14,.32,;3.48,-1.99,;3.48,-3.53,;4.81,-1.22,;6.14,-1.99,;7.48,-1.22,;7.48,.32,;8.81,1.09,;6.14,1.09,;4.81,.32,;-2.33,-3.46,;-3.87,-3.46,;-4.35,-1.99,;-5.84,-1.59,;-6.24,-.11,;-7.72,.29,;-8.81,-.8,;-8.41,-2.28,;-6.93,-2.68,)|

BDBM310456

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CCC(C)(C)O1 |r,wU:16.17,wD:33.35,18.19,(-6.76,2.38,;-5.42,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.25,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.16,-.84,;.39,-2.17,;1.93,-2.17,;2.49,-.07,;2.49,1.47,;3.83,-.84,;3.83,-2.38,;5.16,-3.15,;5.16,-4.69,;6.49,-2.38,;5.16,-.07,;6.49,-.84,;7.83,-.07,;7.83,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.33,-.07,;-5.81,1.4,;-7.35,1.4,;-7.83,-.07,;-8.6,-1.4,;-9.16,.7,;-6.58,-.97,)|

BDBM310458

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,wD:33.35,18.19,(-7.42,2.38,;-6.09,1.61,;-4.76,2.38,;-4.76,3.92,;-3.42,4.69,;-2.09,3.92,;-2.09,2.38,;-.75,1.61,;.58,2.38,;-3.42,1.61,;-3.42,.07,;-2.18,-.84,;-.84,-.07,;.49,-.84,;-.28,-2.17,;1.26,-2.17,;1.82,-.07,;1.82,1.47,;3.16,-.84,;3.16,-2.38,;4.49,-3.15,;4.49,-4.69,;5.83,-2.38,;4.49,-.07,;5.83,-.84,;7.16,-.07,;7.16,1.47,;8.49,2.24,;5.83,2.24,;4.49,1.47,;-2.65,-2.3,;-4.19,-2.3,;-4.67,-.84,;-6,-.07,;-6.48,1.4,;-8.02,1.4,;-8.49,-.07,;-7.25,-.97,)|

BDBM310460

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:33.35,16.17,wD:18.19,(-7.1,2.38,;-5.77,1.61,;-4.44,2.38,;-4.44,3.92,;-3.1,4.69,;-1.77,3.92,;-1.77,2.38,;-.44,1.61,;.9,2.38,;-3.1,1.61,;-3.1,.07,;-1.86,-.84,;-.52,-.07,;.81,-.84,;.04,-2.17,;1.58,-2.17,;2.14,-.07,;2.14,1.47,;3.48,-.84,;3.48,-2.38,;4.81,-3.15,;4.81,-4.69,;6.14,-2.38,;4.81,-.07,;6.14,-.84,;7.48,-.07,;7.48,1.47,;8.81,2.24,;6.14,2.24,;4.81,1.47,;-2.33,-2.3,;-3.87,-2.3,;-4.35,-.84,;-5.84,-.44,;-6.24,1.05,;-7.72,1.45,;-8.81,.36,;-8.41,-1.13,;-6.93,-1.53,)|

BDBM310462

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310464

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1CCC(C)(C)O1 |r|

BDBM310466

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1CCC(C)(C)O1 |r|

BDBM310468

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,wD:33.35,18.19,(-7.42,2.38,;-6.09,1.61,;-4.76,2.38,;-4.76,3.92,;-3.42,4.69,;-2.09,3.92,;-2.09,2.38,;-.75,1.61,;.58,2.38,;-3.42,1.61,;-3.42,.07,;-2.18,-.84,;-.84,-.07,;.49,-.84,;-.28,-2.17,;1.26,-2.17,;1.82,-.07,;1.82,1.47,;3.16,-.84,;3.16,-2.38,;4.49,-3.15,;4.49,-4.69,;5.83,-2.38,;4.49,-.07,;5.83,-.84,;7.16,-.07,;7.16,1.47,;8.49,2.24,;5.83,2.24,;4.49,1.47,;-2.65,-2.3,;-4.19,-2.3,;-4.67,-.84,;-6,-.07,;-6.48,1.4,;-8.02,1.4,;-8.49,-.07,;-7.25,-.97,)|

BDBM310470

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CN(C)C(=O)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(5.16,-3.92,;3.83,-3.15,;3.83,-1.61,;2.49,-.84,;2.49,.7,;1.16,-1.61,;.39,-2.94,;1.93,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.33,-.84,;-6.58,-1.74,;-7.83,-.84,;-9.16,-1.61,;-7.35,.63,;-8.12,1.96,;-5.81,.63,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.42,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.25,1.61,;5.16,-.84,;6.49,-1.61,;7.83,-.84,;7.83,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM310471

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CN(C)C(=O)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,(15.49,-3.92,;14.16,-3.15,;14.16,-1.61,;12.83,-.84,;12.83,.7,;11.49,-1.61,;10.72,-2.94,;12.26,-2.94,;10.16,-.84,;8.82,-1.61,;8.35,-3.07,;6.81,-3.07,;6.33,-1.61,;5,-.84,;3.75,-1.74,;2.51,-.84,;1.17,-1.61,;2.98,.63,;2.21,1.96,;4.52,.63,;7.58,-.7,;7.58,.84,;6.24,1.61,;4.91,.84,;3.58,1.61,;6.24,3.15,;7.58,3.92,;8.91,3.15,;8.91,1.61,;10.25,.84,;11.58,1.61,;15.49,-.84,;16.83,-1.61,;18.16,-.84,;18.16,.7,;19.49,1.47,;16.83,1.47,;15.49,.7,)|

BDBM310472

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C1(CC1)c1cccnc1)c1ncc(Cl)cn1 |r|

BDBM310474

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCOC2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM310476

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCC(C)(C)O2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM310478

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2COCCO2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM310480

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r|

BDBM310481

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1COCCO1 |r|

BDBM310482

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@@H]1CCOC1 |r|

BDBM310484

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@@H]1CCC(C)(C)O1 |r|

BDBM310486

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r|

BDBM310488

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1COCCO1 |r|

BDBM310490

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@@H]1COC(C)(C)C1 |r,wU:16.17,wD:18.19,33.35,(1.11,8.46,;-.22,7.69,;-1.56,8.46,;-1.56,10,;-2.89,10.77,;-4.22,10,;-4.22,8.46,;-5.56,7.69,;-6.89,8.46,;-2.89,7.69,;-2.89,6.15,;-1.64,5.24,;-.31,6.01,;1.02,5.24,;1.79,3.91,;.25,3.91,;2.36,6.01,;2.36,7.55,;3.69,5.24,;3.69,3.7,;5.02,2.93,;5.02,1.39,;6.36,3.7,;5.02,6.01,;6.36,5.24,;7.69,6.01,;7.69,7.55,;9.03,8.32,;6.36,8.32,;5.02,7.55,;-2.12,3.78,;-3.66,3.78,;-4.14,5.24,;-5.47,6.01,;-6.72,5.11,;-7.96,6.01,;-7.49,7.48,;-7.49,9.02,;-9.03,7.48,;-5.95,7.48,)|

BDBM310492

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COC(C)(C)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(5.02,1.5,;3.69,2.27,;3.69,3.81,;2.36,4.58,;2.36,6.12,;1.02,3.81,;1.79,2.47,;.25,2.47,;-.31,4.58,;-1.64,3.81,;-2.12,2.34,;-3.66,2.34,;-4.14,3.81,;-5.47,4.58,;-6.72,3.67,;-7.96,4.58,;-7.49,6.04,;-7.49,7.58,;-9.03,6.04,;-5.95,6.04,;-2.89,4.71,;-2.89,6.25,;-1.56,7.02,;-.22,6.25,;1.11,7.02,;-1.56,8.56,;-2.89,9.33,;-4.22,8.56,;-4.22,7.02,;-5.56,6.25,;-6.89,7.02,;5.02,4.58,;6.36,3.81,;7.69,4.58,;7.69,6.12,;9.03,6.89,;6.36,6.89,;5.02,6.12,)|

BDBM310494

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1COC(C)(C)C1 |r,wU:16.17,18.19,wD:30.32,(1.11,6.4,;-.22,5.63,;-1.56,6.4,;-1.56,7.94,;-2.89,8.71,;-4.22,7.94,;-4.22,6.4,;-5.56,5.63,;-6.89,6.4,;-2.89,5.63,;-2.89,4.09,;-1.64,3.19,;-.31,3.96,;1.02,3.19,;1.79,1.85,;.25,1.85,;2.36,3.96,;2.36,5.5,;3.69,3.19,;3.69,1.65,;5.02,3.96,;6.36,3.19,;7.69,3.96,;7.69,5.5,;9.03,6.27,;6.36,6.27,;5.02,5.5,;-2.12,1.72,;-3.66,1.72,;-4.14,3.19,;-5.47,3.96,;-6.72,3.05,;-7.96,3.96,;-7.49,5.42,;-7.49,6.96,;-9.03,5.42,;-5.95,5.42,)|

BDBM310496

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r|

BDBM310498

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(F)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,wD:18.19,33.35,(-7.42,8.62,;-6.09,7.85,;-4.76,8.62,;-4.76,10.16,;-3.42,10.93,;-2.09,10.16,;-2.09,8.62,;-.75,7.85,;.58,8.62,;-3.42,7.85,;-3.42,6.31,;-2.18,5.41,;-.84,6.18,;.49,5.41,;1.26,4.07,;-.28,4.07,;1.82,6.18,;1.82,7.72,;3.16,5.41,;3.16,3.87,;4.49,3.1,;4.49,1.56,;5.83,3.87,;4.49,6.18,;5.83,5.41,;7.16,6.18,;7.16,7.72,;8.49,8.49,;5.83,8.49,;4.49,7.72,;-2.65,3.94,;-4.19,3.94,;-4.67,5.41,;-6,6.18,;-6.48,7.64,;-8.02,7.64,;-8.49,6.18,;-7.25,5.27,)|

BDBM310500

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ccc(C)cn2)nnc1[C@H]1CCOC1 |r,wU:16.17,wD:18.19,33.35,(-7.42,8.62,;-6.09,7.85,;-4.76,8.62,;-4.76,10.16,;-3.42,10.93,;-2.09,10.16,;-2.09,8.62,;-.75,7.85,;.58,8.62,;-3.42,7.85,;-3.42,6.31,;-2.18,5.41,;-.84,6.18,;.49,5.41,;1.26,4.07,;-.28,4.07,;1.82,6.18,;1.82,7.72,;3.16,5.41,;3.16,3.87,;4.49,3.1,;4.49,1.56,;5.83,3.87,;4.49,6.18,;4.49,7.72,;5.83,8.49,;7.16,7.72,;8.49,8.49,;7.16,6.18,;5.83,5.41,;-2.65,3.94,;-4.19,3.94,;-4.67,5.41,;-6,6.18,;-6.48,7.64,;-8.02,7.64,;-8.49,6.18,;-7.25,5.27,)|

BDBM310502

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C1(CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM310504

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C1(CC1)C1CC1)c1cnc(C)cn1 |r|

BDBM310506

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1CCCO1 |r|

BDBM310507

COc1c(Br)cc(Br)c(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:18.19,20.21,wD:32.34,(-7.42,6.21,;-6.09,5.44,;-4.76,6.21,;-4.76,7.75,;-6.09,8.52,;-3.42,8.52,;-2.09,7.75,;-.75,8.52,;-2.09,6.21,;-.75,5.44,;.58,6.21,;-3.42,5.44,;-3.42,3.9,;-2.18,2.99,;-.69,3.39,;.65,2.62,;-.69,1.85,;1.98,1.85,;1.98,3.39,;1.98,4.93,;3.31,2.62,;3.31,1.08,;4.65,3.39,;5.98,2.62,;7.31,3.39,;7.31,4.93,;8.65,5.7,;5.98,5.7,;4.65,4.93,;-2.65,1.53,;-4.19,1.53,;-4.67,2.99,;-6.16,3.39,;-6.63,4.86,;-8.17,4.86,;-8.65,3.39,;-7.4,2.49,)|

BDBM310509

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1[C@H]1CCC(C)(C)O1 |r,wU:16.17,18.19,wD:30.32,(-6.88,6.15,;-5.54,5.38,;-4.21,6.15,;-4.21,7.69,;-2.88,8.46,;-1.54,7.69,;-1.54,6.15,;-.21,5.38,;1.12,6.15,;-2.88,5.38,;-2.88,3.84,;-1.63,2.94,;-.14,3.34,;1.19,2.57,;-.14,1.8,;2.52,1.8,;2.52,3.34,;2.52,4.88,;3.86,2.57,;3.86,1.03,;5.19,3.34,;6.52,2.57,;7.86,3.34,;7.86,4.88,;9.19,5.65,;6.52,5.65,;5.19,4.88,;-2.11,1.47,;-3.65,1.47,;-4.12,2.94,;-5.61,3.34,;-6.09,4.8,;-7.63,4.8,;-8.1,3.34,;-9.19,4.43,;-9.19,2.25,;-6.86,2.43,)|

BDBM310511

CCC(CC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r|

BDBM310513

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2COCCO2)n1C(C1CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM310519

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCC(=O)N1 |r,wU:16.17,18.19,wD:30.32,(-6.68,6.15,;-5.35,5.38,;-4.01,6.15,;-4.01,7.69,;-2.68,8.46,;-1.34,7.69,;-1.34,6.15,;-.01,5.38,;1.32,6.15,;-2.68,5.38,;-2.68,3.84,;-1.43,2.94,;.06,3.34,;1.39,2.57,;.06,1.8,;2.72,1.8,;2.72,3.34,;2.72,4.88,;4.06,2.57,;4.06,1.03,;5.39,3.34,;6.72,2.57,;8.06,3.34,;8.06,4.88,;9.39,5.65,;6.72,5.65,;5.39,4.88,;-1.91,1.47,;-3.45,1.47,;-3.92,2.94,;-5.41,3.34,;-5.89,4.8,;-7.43,4.8,;-7.9,3.34,;-9.39,2.94,;-6.66,2.43,)|

BDBM310521

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1[C@@H]1CCOC1 |r,wU:30.32,(.63,2.15,;-.71,1.38,;-2.04,2.15,;-2.09,3.72,;-3.42,4.49,;-4.76,3.72,;-4.76,2.18,;-6.09,1.41,;-7.42,2.18,;-3.42,1.41,;-3.42,-.13,;-2.18,-1.04,;-.69,-.64,;.65,-1.41,;-.69,-2.18,;1.98,-2.18,;1.98,-.64,;3.31,-1.41,;4.65,-.64,;4.65,.9,;5.98,1.67,;7.31,.9,;8.65,1.67,;7.31,-.64,;5.98,-1.46,;5.98,-3,;5.98,-4.54,;-2.65,-2.5,;-4.19,-2.5,;-4.67,-1.04,;-6.16,-.64,;-6.63,.83,;-8.17,.83,;-8.65,-.64,;-7.4,-1.54,)|

BDBM310522

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(n1-c1c(OC)cccc1OC)[C@]12CCC[C@H]1OCC2)c1ncc(Cl)cn1 |r,wU:3.3,2.1,28.31,wD:24.25,(4.43,1.02,;3.1,1.79,;3.1,3.33,;1.77,4.1,;1.77,5.64,;.43,3.33,;-.9,2.56,;1.77,2.56,;-.9,4.1,;-2.39,3.7,;-2.86,2.24,;-4.4,2.24,;-4.88,3.7,;-3.63,4.61,;-3.63,7.23,;-2.25,7.97,;-.92,7.2,;.41,7.97,;-2.3,9.54,;-3.63,10.31,;-4.97,9.54,;-4.97,8,;-6.3,7.23,;-7.64,8,;-6.37,4.1,;-5.84,2.65,;-7.06,1.71,;-8.33,2.57,;-7.91,4.05,;-8.43,5.5,;-7.22,6.44,;-5.94,5.58,;4.43,4.1,;5.77,3.33,;7.1,4.1,;7.1,5.64,;8.43,6.41,;5.77,6.41,;4.43,5.64,)|

BDBM310523

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(n1-c1c(OC)cccc1OC)[C@@]12CCC[C@@H]1OCC2)c1ncc(Cl)cn1 |r,wU:24.25,3.3,2.1,wD:28.31,(4.43,1.02,;3.1,1.79,;3.1,3.33,;1.77,4.1,;1.77,5.64,;.43,3.33,;-.9,2.56,;1.77,2.56,;-.9,4.1,;-2.39,3.7,;-2.86,2.24,;-4.4,2.24,;-4.88,3.7,;-3.63,4.61,;-3.63,7.23,;-2.25,7.97,;-.92,7.2,;.41,7.97,;-2.3,9.54,;-3.63,10.31,;-4.97,9.54,;-4.97,8,;-6.3,7.23,;-7.64,8,;-6.37,4.1,;-5.84,2.65,;-7.06,1.71,;-8.33,2.57,;-7.91,4.05,;-8.43,5.5,;-7.22,6.44,;-5.94,5.58,;4.43,4.1,;5.77,3.33,;7.1,4.1,;7.1,5.64,;8.43,6.41,;5.77,6.41,;4.43,5.64,)|

BDBM310524

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2ccccc2)nnc1[C@H]1CCCO1 |r,wD:27.29,16.17,(2.02,6.91,;.7,6.13,;-.64,6.88,;-.75,8.44,;-2.09,9.21,;-3.42,8.44,;-3.42,6.9,;-4.76,6.13,;-6.09,6.9,;-2.09,6.13,;-2.09,4.59,;-.84,3.69,;.65,4.08,;1.98,3.31,;.65,2.54,;3.31,2.54,;3.31,4.08,;3.31,5.62,;4.65,3.31,;4.65,1.77,;5.98,1,;7.31,1.77,;7.31,3.31,;5.98,4.08,;-1.32,2.22,;-2.86,2.22,;-3.33,3.69,;-4.82,4.08,;-5.3,5.55,;-6.84,5.55,;-7.31,4.08,;-6.07,3.18,)|

BDBM310525

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2ccccc2)nnc1[C@@H]1CCCO1 |r,wU:27.29,wD:16.17,(2.02,6.91,;.7,6.13,;-.64,6.88,;-.75,8.44,;-2.09,9.21,;-3.42,8.44,;-3.42,6.9,;-4.76,6.13,;-6.09,6.9,;-2.09,6.13,;-2.09,4.59,;-.84,3.69,;.65,4.08,;1.98,3.31,;.65,2.54,;3.31,2.54,;3.31,4.08,;3.31,5.62,;4.65,3.31,;4.65,1.77,;5.98,1,;7.31,1.77,;7.31,3.31,;5.98,4.08,;-1.32,2.22,;-2.86,2.22,;-3.33,3.69,;-4.82,4.08,;-5.3,5.55,;-6.84,5.55,;-7.31,4.08,;-6.07,3.18,)|

BDBM310526

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H](C)O2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM310527

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@H](C)O2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM310528

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310530

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r|

BDBM310532

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310534

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(F)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310536

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(OC)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310538

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310540

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ccc(C)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310542

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310544

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(OC)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310546

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310548

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310550

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310552

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(OC)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310554

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ccc(Cl)cn2)nnc1[C@H]1CC[C@@H](C)O1 |r|

BDBM310556

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(cn2)C#N)nnc1[C@@H]1CCOC1 |r,wU:31.33,16.17,18.19,(-8.09,6.15,;-6.76,5.38,;-5.42,6.15,;-5.42,7.69,;-4.09,8.46,;-2.76,7.69,;-2.76,6.15,;-1.42,5.38,;-.09,6.15,;-4.09,5.38,;-4.09,3.84,;-2.84,2.94,;-1.36,3.33,;-.02,2.56,;-1.36,1.79,;1.31,1.79,;1.31,3.33,;1.31,4.87,;2.65,2.56,;2.65,1.02,;3.98,3.33,;3.98,4.87,;5.31,5.64,;6.69,4.9,;6.65,3.33,;5.31,2.56,;8.03,5.67,;9.36,6.44,;-3.32,1.47,;-4.86,1.47,;-5.33,2.94,;-6.82,3.33,;-7.3,4.8,;-8.84,4.8,;-9.31,3.33,;-8.07,2.43,)|

BDBM310558

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1[C@@H]1CCOC1 |r,wU:28.30,(-7.42,1.18,;-6.09,.41,;-4.76,1.18,;-4.76,2.72,;-3.42,3.49,;-2.09,2.72,;-2.09,1.18,;-.75,.41,;.58,1.18,;-3.42,.41,;-3.42,-1.13,;-2.18,-2.03,;-.69,-1.63,;.65,-2.4,;-.69,-3.17,;1.98,-3.17,;1.98,-1.63,;3.31,-2.4,;4.65,-1.63,;5.98,-2.4,;7.31,-1.63,;7.31,-.09,;8.65,.68,;5.98,.68,;4.65,-.09,;-2.65,-3.49,;-4.19,-3.49,;-4.67,-2.03,;-6.16,-1.63,;-6.63,-.17,;-8.17,-.17,;-8.65,-1.63,;-7.4,-2.54,)|

BDBM310559

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:28.30,(-7.1,5.86,;-5.77,5.09,;-4.44,5.86,;-4.44,7.4,;-3.1,8.17,;-1.77,7.4,;-1.77,5.86,;-.43,5.09,;.9,5.86,;-3.1,5.09,;-3.1,3.55,;-1.86,2.64,;-.37,3.04,;.97,2.27,;-.37,1.5,;2.3,1.5,;2.3,3.04,;3.63,2.27,;4.97,3.04,;6.3,2.27,;7.63,3.04,;7.63,4.58,;8.97,5.35,;6.3,5.35,;4.97,4.58,;-2.33,1.18,;-3.87,1.18,;-4.35,2.64,;-5.89,2.64,;-6.66,3.97,;-8.2,3.97,;-8.97,2.64,;-8.2,1.31,;-6.66,1.31,)|

BDBM310560

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1[C@@H]1CCCO1 |r,wU:28.30,(-7.42,1.18,;-6.09,.41,;-4.76,1.18,;-4.76,2.72,;-3.42,3.49,;-2.09,2.72,;-2.09,1.18,;-.75,.41,;.58,1.18,;-3.42,.41,;-3.42,-1.13,;-2.18,-2.03,;-.69,-1.63,;.65,-2.4,;-.69,-3.17,;1.98,-3.17,;1.98,-1.63,;3.31,-2.4,;4.65,-1.63,;5.98,-2.4,;7.31,-1.63,;7.31,-.09,;8.65,.68,;5.98,.68,;4.65,-.09,;-2.65,-3.49,;-4.19,-3.49,;-4.67,-2.03,;-6.16,-1.63,;-6.63,-.17,;-8.17,-.17,;-8.65,-1.63,;-7.4,-2.54,)|

BDBM310561

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1[C@H]1CCCO1 |r,wD:28.30,(-7.42,1.18,;-6.09,.41,;-4.76,1.18,;-4.76,2.72,;-3.42,3.49,;-2.09,2.72,;-2.09,1.18,;-.75,.41,;.58,1.18,;-3.42,.41,;-3.42,-1.13,;-2.18,-2.03,;-.69,-1.63,;.65,-2.4,;-.69,-3.17,;1.98,-3.17,;1.98,-1.63,;3.31,-2.4,;4.65,-1.63,;5.98,-2.4,;7.31,-1.63,;7.31,-.09,;8.65,.68,;5.98,.68,;4.65,-.09,;-2.65,-3.49,;-4.19,-3.49,;-4.67,-2.03,;-6.16,-1.63,;-6.63,-.17,;-8.17,-.17,;-8.65,-1.63,;-7.4,-2.54,)|

BDBM310562

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wD:28.30,(-7.42,1.18,;-6.09,.41,;-4.76,1.18,;-4.76,2.72,;-3.42,3.49,;-2.09,2.72,;-2.09,1.18,;-.75,.41,;.58,1.18,;-3.42,.41,;-3.42,-1.13,;-2.18,-2.03,;-.69,-1.63,;.65,-2.4,;-.69,-3.17,;1.98,-3.17,;1.98,-1.63,;3.31,-2.4,;4.65,-1.63,;5.98,-2.4,;7.31,-1.63,;7.31,-.09,;8.65,.68,;5.98,.68,;4.65,-.09,;-2.65,-3.49,;-4.19,-3.49,;-4.67,-2.03,;-6.16,-1.63,;-6.63,-.17,;-8.17,-.17,;-8.65,-1.63,;-7.4,-2.54,)|

BDBM310563

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCOC1 |r,wU:18.19,16.17,wD:30.32,(-7.36,5.91,;-6.02,5.14,;-4.69,5.91,;-4.69,7.45,;-3.36,8.22,;-2.02,7.45,;-2.02,5.91,;-.69,5.14,;.64,5.91,;-3.36,5.14,;-3.36,3.6,;-2.11,2.69,;-.78,3.46,;.56,2.69,;-.78,1.92,;1.89,1.92,;1.89,3.46,;1.89,5,;3.22,2.69,;3.22,1.15,;4.56,3.46,;4.56,5,;5.89,5.77,;7.23,5,;8.56,5.77,;7.23,3.46,;5.89,2.69,;-2.59,1.23,;-4.13,1.23,;-4.6,2.69,;-6.07,3.17,;-6.54,4.63,;-8.08,4.63,;-8.56,3.17,;-7.31,2.26,)|

BDBM310564

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CCOC1 |r,wU:30.32,18.19,16.17,(-7.36,5.91,;-6.02,5.14,;-4.69,5.91,;-4.69,7.45,;-3.36,8.22,;-2.02,7.45,;-2.02,5.91,;-.69,5.14,;.64,5.91,;-3.36,5.14,;-3.36,3.6,;-2.11,2.69,;-.78,3.46,;.56,2.69,;-.78,1.92,;1.89,1.92,;1.89,3.46,;1.89,5,;3.22,2.69,;3.22,1.15,;4.56,3.46,;4.56,5,;5.89,5.77,;7.23,5,;8.56,5.77,;7.23,3.46,;5.89,2.69,;-2.59,1.23,;-4.13,1.23,;-4.6,2.69,;-6.07,3.17,;-6.54,4.63,;-8.08,4.63,;-8.56,3.17,;-7.31,2.26,)|

BDBM310565

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1COC(C)(C)C1 |r,wU:18.19,16.17,wD:30.32,(-6.83,5.91,;-5.49,5.14,;-4.16,5.91,;-4.16,7.45,;-2.82,8.22,;-1.49,7.45,;-1.49,5.91,;-.16,5.14,;1.18,5.91,;-2.82,5.14,;-2.82,3.6,;-1.58,2.69,;-.24,3.46,;1.09,2.69,;-.24,1.92,;2.42,1.92,;2.42,3.46,;2.42,5,;3.76,2.69,;3.76,1.15,;5.09,3.46,;5.09,5,;6.42,5.77,;7.76,5,;9.09,5.77,;7.76,3.46,;6.42,2.69,;-2.05,1.23,;-3.59,1.23,;-4.07,2.69,;-5.54,3.17,;-6.78,2.26,;-8.03,3.17,;-7.55,4.63,;-7.55,6.17,;-9.09,4.63,;-6.01,4.63,)|

BDBM310567

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1[C@@H]1COC(C)(C)C1 |r,wU:18.19,16.17,wD:30.32,(-6.83,5.91,;-5.49,5.14,;-4.16,5.91,;-4.16,7.45,;-2.82,8.22,;-1.49,7.45,;-1.49,5.91,;-.16,5.14,;1.18,5.91,;-2.82,5.14,;-2.82,3.6,;-1.58,2.69,;-.24,3.46,;1.09,2.69,;-.24,1.92,;2.42,1.92,;2.42,3.46,;2.42,5,;3.76,2.69,;3.76,1.15,;5.09,3.46,;5.09,5,;6.42,5.77,;7.76,5,;9.09,5.77,;7.76,3.46,;6.42,2.69,;-2.05,1.23,;-3.59,1.23,;-4.07,2.69,;-5.54,3.17,;-6.78,2.26,;-8.03,3.17,;-7.55,4.63,;-7.55,6.17,;-9.09,4.63,;-6.01,4.63,)|

BDBM310569

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCC(=O)N2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,wD:13.12,(5.29,1.07,;3.96,1.84,;3.96,3.38,;2.62,4.15,;2.62,5.69,;1.29,3.38,;-.04,2.61,;2.62,2.61,;-.04,4.15,;-1.38,3.38,;-1.85,1.92,;-3.39,1.92,;-3.87,3.38,;-5.33,3.86,;-5.81,5.32,;-7.35,5.32,;-7.83,3.86,;-9.29,3.38,;-6.58,2.95,;-2.62,4.29,;-2.62,5.83,;-3.96,6.6,;-5.29,5.83,;-6.63,6.6,;-3.96,8.14,;-2.62,8.91,;-1.29,8.14,;-1.29,6.6,;.04,5.83,;1.38,6.6,;5.29,4.15,;5.29,5.69,;6.62,6.46,;7.96,5.69,;9.29,6.46,;7.96,4.15,;6.62,3.38,)|

BDBM310571

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CCC(=O)N1 |r,wU:16.17,wD:33.35,18.19,(-6.63,8.17,;-5.29,7.4,;-3.96,8.17,;-3.96,9.71,;-2.62,10.48,;-1.29,9.71,;-1.29,8.17,;.04,7.4,;1.38,8.17,;-2.62,7.4,;-2.62,5.86,;-1.38,4.96,;-.04,5.73,;1.29,4.96,;-.04,4.19,;2.62,4.19,;2.62,5.73,;2.62,7.27,;3.96,4.96,;3.96,3.42,;5.29,2.65,;5.29,1.11,;6.62,3.42,;5.29,5.73,;5.29,7.27,;6.62,8.04,;7.96,7.27,;9.29,8.04,;7.96,5.73,;6.62,4.96,;-1.85,3.49,;-3.39,3.49,;-3.87,4.96,;-5.33,5.43,;-5.81,6.9,;-7.35,6.9,;-7.83,5.43,;-9.29,4.96,;-6.58,4.53,)|

BDBM310573

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCOC2)n1Cc1ccon1)c1ncc(Cl)cn1 |r|

BDBM310575

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H](C)O2)n1Cc1ccon1)c1ncc(Cl)cn1 |r|

BDBM310577

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC(=O)N2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(5.29,1.1,;3.96,1.87,;3.96,3.41,;2.62,4.18,;2.62,5.72,;1.29,3.41,;-.04,2.64,;2.62,2.64,;-.04,4.18,;-1.38,3.41,;-1.85,1.94,;-3.39,1.94,;-3.87,3.41,;-5.33,3.89,;-5.81,5.35,;-7.35,5.35,;-7.83,3.89,;-9.29,3.41,;-6.58,2.98,;-6.58,1.44,;-2.62,4.31,;-2.62,5.85,;-3.96,6.62,;-5.29,5.85,;-6.63,6.62,;-3.96,8.16,;-2.62,8.93,;-1.29,8.16,;-1.29,6.62,;.04,5.85,;1.38,6.62,;5.29,4.18,;5.29,5.72,;6.62,6.49,;7.96,5.72,;9.29,6.49,;7.96,4.18,;6.62,3.41,)|

BDBM310579

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ccc(C)cn2)nnc1C1CCOC1 |r,wU:16.17,wD:18.19,(-7.36,8.16,;-6.02,7.39,;-4.69,8.16,;-4.69,9.7,;-3.36,10.47,;-2.02,9.7,;-2.02,8.16,;-.69,7.39,;.64,8.16,;-3.36,7.39,;-3.36,5.85,;-2.11,4.95,;-.78,5.72,;.56,4.95,;-.78,4.18,;1.89,4.18,;1.89,5.72,;1.89,7.26,;3.22,4.95,;3.22,3.41,;4.56,2.64,;4.56,1.1,;5.89,3.41,;4.56,5.72,;4.56,7.26,;5.89,8.03,;7.23,7.26,;8.56,8.03,;7.23,5.72,;5.89,4.95,;-2.59,3.48,;-4.13,3.48,;-4.6,4.95,;-6.07,5.42,;-6.54,6.89,;-8.08,6.89,;-8.56,5.42,;-7.31,4.52,)|

BDBM310581

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1C1CCOC1 |r,wU:18.19,16.17,(-7.36,5.92,;-6.02,5.15,;-4.69,5.92,;-4.69,7.46,;-3.36,8.23,;-2.02,7.46,;-2.02,5.92,;-.69,5.15,;.64,5.92,;-3.36,5.15,;-3.36,3.61,;-2.11,2.71,;-.78,3.48,;.56,2.71,;-.78,1.94,;1.89,1.94,;1.89,3.48,;1.89,5.02,;3.22,2.71,;3.22,1.17,;4.56,3.48,;4.56,5.02,;5.89,5.79,;7.23,5.02,;8.56,5.79,;7.23,3.48,;5.89,2.71,;-2.59,1.24,;-4.13,1.24,;-4.6,2.71,;-6.07,3.18,;-6.54,4.65,;-8.08,4.65,;-8.56,3.18,;-7.31,2.28,)|

BDBM310582

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1C1CCOC1 |r,wU:18.19,16.17,(-7.36,5.93,;-6.02,5.16,;-4.69,5.93,;-4.69,7.47,;-3.36,8.24,;-2.02,7.47,;-2.02,5.93,;-.69,5.16,;.64,5.93,;-3.36,5.16,;-3.36,3.62,;-2.11,2.72,;-.78,3.49,;.56,2.72,;-.78,1.95,;1.89,1.95,;1.89,3.49,;1.89,5.03,;3.22,2.72,;3.22,1.18,;4.56,3.49,;4.56,5.03,;5.89,5.8,;7.23,5.03,;8.56,5.8,;7.23,3.49,;5.89,2.72,;-2.59,1.25,;-4.13,1.25,;-4.6,2.72,;-6.07,3.19,;-6.54,4.66,;-8.08,4.66,;-8.56,3.19,;-7.31,2.29,)|

BDBM310583

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@@H]1COC(C)(C)C1 |r,wU:16.17,wD:33.35,18.19,(-6.83,8.03,;-5.49,7.26,;-4.16,8.03,;-4.16,9.57,;-2.82,10.34,;-1.49,9.57,;-1.49,8.03,;-.16,7.26,;1.18,8.03,;-2.82,7.26,;-2.82,5.72,;-1.58,4.81,;-.24,5.58,;1.09,4.81,;-.24,4.04,;2.42,4.04,;2.42,5.58,;2.42,7.12,;3.76,4.81,;3.76,3.27,;5.09,2.5,;6.42,3.27,;5.09,.96,;5.09,5.58,;5.09,7.12,;6.42,7.89,;7.76,7.12,;9.09,7.89,;7.76,5.58,;6.42,4.81,;-2.05,3.35,;-3.59,3.35,;-4.07,4.81,;-5.54,5.29,;-6.78,4.38,;-8.03,5.29,;-7.55,6.75,;-7.55,8.29,;-9.09,6.75,;-6.01,6.75,)|

BDBM310585

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@H]1CCC(C)(C)O1 |r,wU:16.17,wD:33.35,18.19,(-6.81,8.17,;-5.48,7.4,;-4.15,8.17,;-4.15,9.71,;-2.81,10.48,;-1.48,9.71,;-1.48,8.17,;-.14,7.4,;1.19,8.17,;-2.81,7.4,;-2.81,5.86,;-1.57,4.96,;-.23,5.73,;1.1,4.96,;-.23,4.19,;2.43,4.19,;2.43,5.73,;2.43,7.27,;3.77,4.96,;3.77,3.42,;5.1,2.65,;6.44,3.42,;5.1,1.11,;5.1,5.73,;5.1,7.27,;6.44,8.04,;7.77,7.27,;9.1,8.04,;7.77,5.73,;6.44,4.96,;-2.04,3.49,;-3.58,3.49,;-4.06,4.96,;-5.52,5.43,;-6,6.9,;-7.54,6.9,;-8.01,5.43,;-9.1,6.52,;-9.1,4.34,;-6.77,4.53,)|

BDBM310587

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCOC2)n1[C@@H](C)c1ccon1)c1ncc(Cl)cn1 |r|

BDBM310589

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1C1CCC(=O)N1C |r,wU:16.17,wD:18.19,(-6.63,8.17,;-5.29,7.4,;-3.96,8.17,;-3.96,9.71,;-2.62,10.48,;-1.29,9.71,;-1.29,8.17,;.04,7.4,;1.38,8.17,;-2.62,7.4,;-2.62,5.86,;-1.38,4.96,;-.04,5.73,;1.29,4.96,;-.04,4.19,;2.62,4.19,;2.62,5.73,;2.62,7.27,;3.96,4.96,;3.96,3.42,;5.29,2.65,;6.62,3.42,;5.29,1.11,;5.29,5.73,;5.29,7.27,;6.62,8.04,;7.96,7.27,;9.29,8.04,;7.96,5.73,;6.62,4.96,;-1.85,3.49,;-3.39,3.49,;-3.87,4.96,;-5.33,5.43,;-5.81,6.9,;-7.35,6.9,;-7.83,5.43,;-9.29,4.96,;-6.58,4.53,;-6.58,2.99,)|

BDBM310591

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1CCC(=O)N1C |r,wU:18.19,16.17,(-6.63,6.27,;-5.29,5.5,;-3.96,6.27,;-3.96,7.81,;-2.62,8.58,;-1.29,7.81,;-1.29,6.27,;.04,5.5,;1.38,6.27,;-2.62,5.5,;-2.62,3.96,;-1.38,3.05,;-.04,3.82,;1.29,3.05,;-.04,2.28,;2.62,2.28,;2.62,3.82,;2.62,5.36,;3.96,3.05,;3.96,1.51,;5.29,3.82,;5.29,5.36,;6.62,6.13,;7.96,5.36,;9.29,6.13,;7.96,3.82,;6.62,3.05,;-1.85,1.59,;-3.39,1.59,;-3.87,3.05,;-5.33,3.53,;-5.81,4.99,;-7.35,4.99,;-7.83,3.53,;-9.29,3.05,;-6.58,2.62,;-6.58,1.08,)|

BDBM310592

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1[C@@H]1COCCO1 |r,wU:28.30,(-7.03,5.89,;-5.69,5.12,;-4.36,5.89,;-4.36,7.43,;-3.02,8.2,;-1.69,7.43,;-1.69,5.89,;-.36,5.12,;.98,5.89,;-3.02,5.12,;-3.02,3.58,;-1.78,2.67,;-.45,3.44,;.89,2.67,;-.45,1.9,;2.22,1.9,;2.22,3.44,;3.56,2.67,;4.89,3.44,;6.22,2.67,;7.56,3.44,;7.56,4.98,;8.89,5.75,;6.22,5.75,;4.89,4.98,;-2.25,1.21,;-3.79,1.21,;-4.27,2.67,;-5.81,2.67,;-6.58,4.01,;-8.12,4.01,;-8.89,2.67,;-8.12,1.34,;-6.58,1.34,)|

BDBM310594

COc1cccc(c1)[C@@H](C)S(=O)(=O)Nc1nnc([C@H]2CCCO2)n1-c1c(OC)cccc1OC |r,wD:18.18,8.9,(7.24,.67,;5.91,1.43,;5.9,2.97,;7.23,3.88,;7.23,5.42,;5.89,6.19,;4.56,5.42,;4.56,3.88,;3.22,6.19,;3.22,7.73,;1.89,5.42,;.56,4.65,;3.22,4.65,;.56,6.19,;-.78,5.42,;-1.25,3.96,;-2.79,3.96,;-3.27,5.42,;-4.73,5.9,;-5.21,7.36,;-6.75,7.36,;-7.23,5.9,;-5.98,5,;-2.02,6.33,;-2.02,7.87,;-.64,8.61,;.69,7.84,;2.03,8.61,;-.69,10.18,;-2.02,10.95,;-3.36,10.18,;-3.36,8.64,;-4.69,7.87,;-6.02,8.64,)|

BDBM310596

COc1cccc(c1)[C@@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCCO2)n1-c1c(OC)cccc1OC |r,wU:18.18,wD:8.9,(7.24,.67,;5.91,1.43,;5.9,2.97,;7.23,3.88,;7.23,5.42,;5.89,6.19,;4.56,5.42,;4.56,3.88,;3.22,6.19,;3.22,7.73,;1.89,5.42,;.56,4.65,;3.22,4.65,;.56,6.19,;-.78,5.42,;-1.25,3.96,;-2.79,3.96,;-3.27,5.42,;-4.73,5.9,;-5.21,7.36,;-6.75,7.36,;-7.23,5.9,;-5.98,5,;-2.02,6.33,;-2.02,7.87,;-.64,8.61,;.69,7.84,;2.03,8.61,;-.69,10.18,;-2.02,10.95,;-3.36,10.18,;-3.36,8.64,;-4.69,7.87,;-6.02,8.64,)|

BDBM310598

COc1cccc(O)c1-n1c(NS(=O)(=O)[C@H](C)c2ccccc2F)nnc1[C@H]1CCCO1 |r,wD:27.29,15.16,(2.03,6.6,;.69,5.83,;-.64,6.6,;-.69,8.17,;-2.02,8.94,;-3.36,8.17,;-3.36,6.63,;-4.69,5.86,;-2.02,5.86,;-2.02,4.32,;-.78,3.41,;.56,4.18,;1.89,3.41,;.56,2.64,;3.22,2.64,;3.22,4.18,;3.22,5.72,;4.56,3.41,;4.56,1.87,;5.89,1.1,;7.23,1.87,;7.23,3.41,;5.89,4.18,;5.89,5.72,;-1.25,1.95,;-2.79,1.95,;-3.27,3.41,;-4.73,3.89,;-5.21,5.35,;-6.75,5.35,;-7.23,3.89,;-5.98,2.98,)|

BDBM310599

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2ccccc2F)nnc1[C@H]1CCCO1 |r,wD:28.30,16.17,(2.03,6.6,;.69,5.83,;-.64,6.6,;-.69,8.17,;-2.02,8.94,;-3.36,8.17,;-3.36,6.63,;-4.69,5.86,;-6.02,6.63,;-2.02,5.86,;-2.02,4.32,;-.78,3.41,;.56,4.18,;1.89,3.41,;.56,2.64,;3.22,2.64,;3.22,4.18,;3.22,5.72,;4.56,3.41,;4.56,1.87,;5.89,1.1,;7.23,1.87,;7.23,3.41,;5.89,4.18,;5.89,5.72,;-1.25,1.95,;-2.79,1.95,;-3.27,3.41,;-4.73,3.89,;-5.21,5.35,;-6.75,5.35,;-7.23,3.89,;-5.98,2.98,)|

BDBM310602

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2ccccc2)nnc1[C@H]1CCCO1 |r,wD:27.29,16.17,(2.03,6.6,;.69,5.83,;-.64,6.6,;-.69,8.17,;-2.02,8.94,;-3.36,8.17,;-3.36,6.63,;-4.69,5.86,;-6.02,6.63,;-2.02,5.86,;-2.02,4.32,;-.78,3.41,;.56,4.18,;1.89,3.41,;.56,2.64,;3.22,2.64,;3.22,4.18,;3.22,5.72,;4.56,3.41,;5.89,4.18,;7.23,3.41,;7.23,1.87,;5.89,1.1,;4.56,1.87,;-1.25,1.95,;-2.79,1.95,;-3.27,3.41,;-4.73,3.89,;-5.21,5.35,;-6.75,5.35,;-7.23,3.89,;-5.98,2.98,)|

BDBM310603

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2cccc(Cl)c2)nnc1[C@H]1CCCO1 |r,wD:28.30,16.17,(2.03,8.23,;.69,7.46,;-.64,8.23,;-.69,9.79,;-2.02,10.56,;-3.36,9.79,;-3.36,8.25,;-4.69,7.48,;-6.02,8.25,;-2.02,7.48,;-2.02,5.94,;-.78,5.04,;.56,5.81,;1.89,5.04,;.56,4.27,;3.22,4.27,;3.22,5.81,;3.22,7.35,;4.56,5.04,;5.89,5.81,;7.23,5.04,;7.23,3.5,;5.89,2.73,;5.89,1.19,;4.56,3.5,;-1.25,3.57,;-2.79,3.57,;-3.27,5.04,;-4.73,5.51,;-5.21,6.98,;-6.75,6.98,;-7.23,5.51,;-5.98,4.61,)|

BDBM310604

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)c2cccc(Cl)c2)nnc1[C@H]1CCCO1 |r,wD:28.30,16.17,(2.03,8.23,;.69,7.46,;-.64,8.23,;-.69,9.8,;-2.02,10.57,;-3.36,9.8,;-3.36,8.26,;-4.69,7.49,;-6.02,8.26,;-2.02,7.49,;-2.02,5.95,;-.78,5.04,;.56,5.81,;1.89,5.04,;.56,4.27,;3.22,4.27,;3.22,5.81,;3.22,7.35,;4.56,5.04,;5.89,5.81,;7.23,5.04,;7.23,3.5,;5.89,2.73,;5.89,1.19,;4.56,3.5,;-1.25,3.58,;-2.79,3.58,;-3.27,5.04,;-4.73,5.52,;-5.21,6.99,;-6.75,6.99,;-7.23,5.52,;-5.98,4.62,)|

BDBM310607

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CO[C@@H](C)C1 |r,wU:33.36,18.19,16.17,wD:30.32,(-7.28,6.81,;-5.95,6.04,;-4.62,6.81,;-4.62,8.35,;-3.28,9.12,;-1.95,8.35,;-1.95,6.81,;-.61,6.04,;.72,6.81,;-3.28,6.04,;-3.28,4.5,;-2.04,3.6,;-.7,4.37,;.39,3.28,;-1.1,2.88,;1.48,2.19,;1.87,3.68,;2.27,5.17,;2.96,2.59,;2.56,1.1,;4.45,2.99,;4.85,4.48,;6.34,4.87,;7.43,3.79,;8.91,4.18,;7.03,2.3,;5.54,1.9,;-2.51,2.13,;-4.05,2.13,;-4.53,3.6,;-5.99,4.08,;-7.24,3.17,;-8.48,4.08,;-8.01,5.54,;-8.91,6.79,;-6.47,5.54,)|

BDBM310611

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CCO1 |r,wU:18.19,16.17,wD:30.32,(-7.71,6.8,;-6.37,6.03,;-5.04,6.8,;-5.04,8.34,;-3.71,9.11,;-2.37,8.34,;-2.37,6.8,;-1.04,6.03,;.29,6.8,;-3.71,6.03,;-3.71,4.49,;-2.46,3.58,;-1.13,4.35,;-.04,3.27,;-1.53,2.87,;1.05,2.18,;1.45,3.66,;1.85,5.15,;2.54,2.57,;2.14,1.09,;4.03,2.97,;4.42,4.46,;5.91,4.86,;7,3.77,;8.49,4.17,;6.6,2.28,;5.11,1.88,;-2.94,2.12,;-4.48,2.12,;-4.95,3.58,;-6.42,4.06,;-7.12,5.43,;-8.49,4.73,;-7.79,3.36,)|

BDBM359715

COc1cccc(n1)C(=O)NN\C(NS(C)(=O)=O)=N\c1c(OC)cccc1OC

BDBM359716

CO[C@@H]([C@H](C)S(=O)(=O)N\C(NNC(=O)c1cccc(OC)n1)=N/c1c(OC)cccc1OC)c1ncc(C)cn1 |r|

BDBM359748

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)C#N)c1ncc(C)cn1 |r|

BDBM359804

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(4.92,-10.72,;4.92,-9.18,;3.58,-8.41,;3.58,-6.87,;2.25,-6.1,;2.25,-4.56,;.92,-6.87,;.15,-8.21,;1.69,-8.21,;-.42,-6.15,;-1.88,-6.58,;-2.36,-8.04,;-3.9,-8.04,;-4.37,-6.58,;-5.84,-6.1,;-6.61,-4.77,;-8.15,-4.77,;-8.92,-6.1,;-8.15,-7.44,;-8.92,-8.77,;-10.44,-8.5,;-6.61,-7.44,;-3.13,-5.67,;-3.13,-4.13,;-1.75,-3.39,;-.41,-4.16,;.92,-3.39,;-1.79,-1.82,;-3.13,-1.05,;-4.46,-1.82,;-4.46,-3.36,;-5.8,-4.13,;-6.97,-3.14,;4.92,-6.1,;6.25,-6.87,;7.58,-6.1,;7.58,-4.56,;8.92,-3.79,;6.25,-3.79,;4.92,-4.56,)|

BDBM359812

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-8.12,-10.54,;-8.89,-9.2,;-8.12,-7.87,;-8.89,-6.54,;-8.12,-5.2,;-6.58,-5.2,;-5.81,-6.54,;-6.58,-7.87,;-4.27,-6.54,;-3.79,-8,;-2.25,-8,;-1.78,-6.54,;-.45,-5.77,;.89,-6.54,;.12,-7.87,;1.66,-7.87,;2.22,-5.77,;2.22,-4.23,;3.56,-6.54,;4.89,-5.77,;6.22,-6.54,;7.56,-5.77,;7.56,-4.23,;8.89,-3.46,;6.22,-3.46,;4.89,-4.23,;-3.02,-5.63,;-3.02,-4.09,;-4.36,-3.32,;-5.69,-4.09,;-7.03,-3.32,;-4.36,-1.78,;-3.02,-1.01,;-1.69,-1.78,;-1.69,-3.32,;-.36,-4.09,;.98,-3.32,)|

BDBM359815

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccnc(C)c1 |r,wD:16.17,(-7.03,-3.35,;-5.69,-4.12,;-4.36,-3.35,;-4.36,-1.81,;-3.02,-1.04,;-1.69,-1.81,;-1.69,-3.35,;-.36,-4.12,;.98,-3.35,;-3.02,-4.12,;-3.02,-5.66,;-1.78,-6.57,;-.45,-5.8,;.89,-6.57,;.12,-7.9,;1.66,-7.9,;2.22,-5.8,;2.22,-4.26,;3.56,-6.57,;4.89,-5.8,;6.22,-6.57,;7.56,-5.8,;7.56,-4.26,;8.89,-3.49,;6.22,-3.49,;4.89,-4.26,;-2.25,-8.03,;-3.79,-8.03,;-4.27,-6.57,;-5.81,-6.57,;-6.58,-5.23,;-8.12,-5.23,;-8.89,-6.57,;-8.12,-7.9,;-8.89,-9.23,;-6.58,-7.9,)|

BDBM359828

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-7.4,-10.63,;-7.8,-9.15,;-6.71,-8.06,;-7.11,-6.57,;-6.02,-5.48,;-4.53,-5.88,;-4.13,-7.37,;-5.22,-8.45,;-2.65,-7.76,;-1.81,-9.06,;-.32,-8.66,;-.24,-7.12,;1.09,-6.35,;2.43,-7.12,;1.66,-8.45,;3.76,-7.89,;3.2,-5.79,;2.43,-4.45,;4.74,-5.79,;5.51,-7.12,;5.51,-4.45,;7.05,-4.45,;7.82,-3.12,;7.05,-1.78,;7.82,-.45,;5.51,-1.78,;4.74,-3.12,;-1.68,-6.57,;-2.28,-4.07,;-3.77,-3.67,;-4.86,-4.76,;-6.35,-4.36,;-4.17,-2.18,;-3.08,-1.09,;-1.59,-1.49,;-1.19,-2.98,;.29,-3.38,;1.38,-2.29,)|

BDBM359829

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-7.41,-10.66,;-7.81,-9.18,;-6.72,-8.09,;-7.12,-6.6,;-6.03,-5.51,;-4.54,-5.91,;-4.14,-7.4,;-5.23,-8.49,;-2.66,-7.8,;-1.82,-9.09,;-.33,-8.69,;-.25,-7.15,;1.08,-6.38,;2.42,-7.15,;1.65,-8.48,;3.75,-7.92,;3.19,-5.82,;2.42,-4.48,;4.73,-5.82,;5.5,-7.15,;5.5,-4.48,;7.04,-4.48,;7.81,-3.15,;7.04,-1.82,;7.81,-.48,;5.5,-1.82,;4.73,-3.15,;-1.69,-6.6,;-2.29,-4.1,;-3.78,-3.7,;-4.87,-4.79,;-6.36,-4.39,;-4.18,-2.21,;-3.09,-1.12,;-1.6,-1.52,;-1.2,-3.01,;.28,-3.41,;1.37,-2.32,)|

BDBM359830

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-7.41,-10.73,;-7.81,-9.24,;-6.72,-8.15,;-7.12,-6.66,;-6.03,-5.57,;-4.54,-5.97,;-4.14,-7.46,;-5.23,-8.55,;-2.66,-7.86,;-1.82,-9.15,;-.33,-8.75,;-.25,-7.21,;1.08,-6.44,;2.42,-7.21,;1.65,-8.55,;3.75,-7.98,;3.19,-5.88,;2.42,-4.55,;4.73,-5.88,;5.5,-7.21,;5.5,-4.55,;7.04,-4.55,;7.81,-3.21,;7.04,-1.88,;7.81,-.54,;5.5,-1.88,;4.73,-3.21,;-1.69,-6.66,;-2.29,-4.16,;-3.78,-3.76,;-4.87,-4.85,;-6.36,-4.45,;-4.18,-2.27,;-3.09,-1.19,;-1.6,-1.58,;-1.2,-3.07,;.28,-3.47,;1.37,-2.38,)|

BDBM359879

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1cncc(Cl)c1 |(-7.02,2.06,;-5.69,1.29,;-4.36,2.06,;-4.36,3.6,;-3.02,4.37,;-1.69,3.6,;-1.69,2.06,;-.36,1.29,;.98,2.06,;-3.02,1.29,;-3.02,-.25,;-1.78,-1.15,;-.44,-.38,;.87,-1.19,;-.46,-1.96,;2.2,-1.96,;2.22,-.45,;3.54,-1.26,;4.89,-.52,;4.89,1.02,;6.22,1.79,;7.56,1.02,;8.89,1.79,;7.56,-.52,;6.22,-1.35,;6.22,-2.89,;6.22,-4.43,;-2.25,-2.62,;-3.79,-2.62,;-4.27,-1.15,;-5.81,-1.15,;-6.58,-2.49,;-8.12,-2.49,;-8.89,-1.15,;-8.12,.18,;-8.89,1.51,;-6.58,.18,)|

BDBM359898

COc1cccc(n1)-c1nnc(NS(=O)(=O)CCc2ccc(F)cc2C#N)n1-c1c(OC)cccc1OC |(-8.09,-4.76,;-8.86,-3.43,;-8.09,-2.1,;-8.86,-.76,;-8.09,.57,;-6.55,.57,;-5.78,-.76,;-6.55,-2.1,;-4.24,-.76,;-3.77,-2.23,;-2.23,-2.23,;-1.75,-.76,;-.29,-.29,;.86,-1.32,;.09,-2.65,;1.63,-2.65,;2.19,-.55,;3.53,-1.32,;4.86,-.55,;6.19,-1.32,;7.53,-.55,;7.53,.99,;8.86,1.76,;6.19,1.76,;4.81,1.02,;3.48,1.79,;2.15,2.56,;-3,.14,;-3,1.68,;-4.33,2.45,;-5.66,1.68,;-7,2.45,;-4.33,3.99,;-3,4.76,;-1.66,3.99,;-1.66,2.45,;-.33,1.68,;1.01,2.45,)|

BDBM359941

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-7.42,-3.26,;-6.09,-4.03,;-4.75,-3.26,;-4.75,-1.72,;-3.42,-.95,;-2.09,-1.72,;-2.09,-3.26,;-.75,-4.03,;.58,-3.26,;-3.42,-4.03,;-3.42,-5.57,;-2.17,-6.47,;-.84,-5.7,;.49,-6.47,;-.84,-7.24,;1.83,-7.24,;1.83,-5.7,;1.83,-4.16,;3.16,-6.47,;3.16,-8.01,;4.49,-5.7,;5.83,-6.47,;7.16,-5.7,;7.16,-4.16,;8.49,-3.39,;5.83,-3.39,;4.49,-4.16,;-2.65,-7.94,;-4.19,-7.94,;-4.67,-6.47,;-6.21,-6.47,;-6.98,-7.81,;-8.52,-7.81,;-9.29,-6.47,;-8.52,-5.14,;-9.29,-3.81,;-6.98,-5.14,)|

BDBM359951

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wD:3.3,2.1,(-7.05,.31,;-5.59,-.16,;-5.27,-1.67,;-3.8,-2.14,;-3.48,-3.65,;-2.66,-1.11,;-3.69,.03,;-1.63,-2.26,;-1.51,-.08,;-.05,-.56,;.43,-2.02,;1.97,-2.02,;2.44,-.56,;3.91,-.08,;4.23,1.42,;5.69,1.9,;6.84,.87,;6.52,-.64,;7.66,-1.67,;5.05,-1.11,;1.2,.35,;1.2,1.89,;2.53,2.66,;3.87,1.89,;5.2,2.66,;2.53,4.2,;1.2,4.97,;-.14,4.2,;-.14,2.66,;-1.47,1.89,;-2.65,2.88,;-6.41,-2.7,;-6.09,-4.21,;-7.23,-5.24,;-8.7,-4.76,;-9.84,-5.79,;-9.02,-3.25,;-7.88,-2.22,)|

BDBM359952

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wD:3.3,2.1,(-6.59,.22,;-5.13,-.25,;-4.81,-1.76,;-3.34,-2.23,;-3.02,-3.74,;-2.2,-1.2,;-3.23,-.06,;-1.17,-2.35,;-1.05,-.17,;.41,-.65,;.89,-2.11,;2.43,-2.11,;2.9,-.65,;4.37,-.17,;5.51,-1.2,;6.98,-.73,;7.3,.78,;6.15,1.81,;4.69,1.33,;1.66,.26,;1.66,1.8,;2.99,2.57,;4.32,1.8,;5.66,2.57,;2.99,4.11,;1.66,4.88,;.32,4.11,;.32,2.57,;-1.01,1.8,;-2.19,2.79,;-5.95,-2.79,;-5.63,-4.29,;-6.78,-5.32,;-8.24,-4.85,;-9.39,-5.88,;-8.56,-3.34,;-7.42,-2.31,)|

BDBM359964

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cn3ccccc3n2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-10.3,1.74,;-8.83,1.27,;-7.69,2.3,;-8.01,3.8,;-6.86,4.83,;-5.4,4.36,;-5.08,2.85,;-6.22,1.82,;-3.61,2.37,;-3.14,.91,;-1.6,.91,;-1.12,2.37,;.21,3.14,;1.55,2.37,;.21,1.6,;2.88,1.6,;2.88,3.14,;4.21,2.37,;4.21,.83,;5.55,3.14,;5.71,4.68,;7.22,5,;7.99,6.33,;9.53,6.33,;10.3,5,;9.53,3.66,;7.99,3.66,;6.95,2.52,;-2.37,3.28,;-2.37,4.82,;-3.7,5.59,;-5.03,4.82,;-6.37,5.59,;-3.7,7.13,;-2.37,7.9,;-1.03,7.13,;-1.03,5.59,;.3,4.82,;1.63,5.59,)|

BDBM359965

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2cn(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.09,-8.86,;-8.41,-7.35,;-7.26,-6.32,;-7.58,-4.82,;-6.44,-3.79,;-4.97,-4.26,;-4.65,-5.77,;-5.8,-6.8,;-3.19,-6.24,;-2.71,-7.71,;-1.17,-7.71,;-.7,-6.24,;.64,-5.47,;1.97,-6.24,;.64,-7.01,;3.3,-7.01,;3.3,-5.47,;3.3,-3.93,;4.64,-6.24,;4.64,-7.78,;5.97,-5.47,;6.13,-3.94,;7.64,-3.62,;8.26,-2.21,;8.41,-4.96,;7.38,-6.1,;-1.94,-5.34,;-1.94,-3.8,;-3.28,-3.03,;-4.61,-3.8,;-5.94,-3.03,;-3.28,-1.49,;-1.94,-.72,;-.61,-1.49,;-.61,-3.03,;.72,-3.8,;2.06,-3.03,)|

BDBM359966

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cn(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-8.09,-8.86,;-8.41,-7.35,;-7.26,-6.32,;-7.58,-4.82,;-6.44,-3.79,;-4.97,-4.26,;-4.65,-5.77,;-5.8,-6.8,;-3.19,-6.24,;-2.71,-7.71,;-1.17,-7.71,;-.7,-6.24,;.64,-5.47,;1.97,-6.24,;.64,-7.01,;3.3,-7.01,;3.3,-5.47,;3.3,-3.93,;4.64,-6.24,;4.64,-7.78,;5.97,-5.47,;6.13,-3.94,;7.64,-3.62,;8.26,-2.21,;8.41,-4.96,;7.38,-6.1,;-1.94,-5.34,;-1.94,-3.8,;-3.28,-3.03,;-4.61,-3.8,;-5.94,-3.03,;-3.28,-1.49,;-1.94,-.72,;-.61,-1.49,;-.61,-3.03,;.72,-3.8,;2.06,-3.03,)|

BDBM359968

COc1cccc(OC)c1\N=C(\NNC(=O)c1cncc(C)c1)NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(C)cn1 |r|

BDBM359969

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)C[C@H](O)c2ccc(Cl)cc2)n1-c1c(OC)cccc1OC |r,wU:23.24,(-8.84,1.66,;-9.16,3.16,;-8.02,4.19,;-8.34,5.7,;-7.19,6.73,;-5.73,6.25,;-5.41,4.75,;-6.55,3.72,;-3.94,4.27,;-3.47,2.81,;-1.93,2.81,;-1.45,4.27,;.01,4.75,;.33,6.25,;1.87,6.42,;2.49,7.83,;4.02,8,;1.58,9.07,;3.11,9.24,;1.16,3.72,;1.56,2.23,;.07,2.63,;2.49,4.49,;3.83,3.72,;3.83,2.18,;5.16,4.49,;6.49,3.72,;7.83,4.49,;7.83,6.03,;9.16,6.8,;6.49,6.8,;5.16,6.03,;-2.7,5.18,;-2.7,6.72,;-4.03,7.49,;-5.36,6.72,;-6.7,7.49,;-4.03,9.03,;-2.7,9.8,;-1.36,9.03,;-1.36,7.49,;-.03,6.72,;1.3,7.49,)|

BDBM359977

CO[C@@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wU:2.1,(2.03,1,;3.36,1.77,;3.36,3.31,;2.03,4.08,;.69,3.31,;1.09,1.83,;-.4,2.22,;-.45,4.34,;-.13,5.85,;1.4,6.02,;2.02,7.43,;3.55,7.59,;1.11,8.67,;2.64,8.84,;-1.92,3.87,;-2.39,2.4,;-3.93,2.4,;-4.41,3.87,;-5.87,4.34,;-6.19,5.85,;-7.66,6.33,;-8.8,5.29,;-8.48,3.79,;-9.63,2.76,;-9.31,1.25,;-7.02,3.31,;-3.16,4.77,;-3.16,6.31,;-4.5,7.08,;-5.83,6.31,;-7.16,7.08,;-4.5,8.62,;-3.16,9.39,;-1.83,8.62,;-1.83,7.08,;-.5,6.31,;.84,7.08,;4.69,4.08,;4.69,5.62,;6.03,6.39,;7.36,5.62,;8.69,6.39,;7.36,4.08,;6.03,3.31,;6.03,1.77,;4.69,1,;7.36,1,;7.36,2.54,)|

BDBM359978

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wU:2.1,(2.14,1,;3.47,1.77,;3.47,3.31,;2.14,4.08,;.81,3.31,;1.21,1.83,;-.28,2.22,;-.34,4.34,;-1.8,3.87,;-2.28,2.4,;-3.82,2.4,;-4.29,3.87,;-5.76,4.34,;-6.08,5.85,;-7.54,6.33,;-8.69,5.29,;-8.37,3.79,;-9.51,2.76,;-9.19,1.25,;-6.9,3.31,;-3.05,4.77,;-3.05,6.31,;-4.38,7.08,;-5.72,6.31,;-7.05,7.08,;-4.38,8.62,;-3.05,9.39,;-1.71,8.62,;-1.71,7.08,;-.38,6.31,;.95,7.08,;4.81,4.08,;4.81,5.62,;6.14,6.39,;7.47,5.62,;8.81,6.39,;7.47,4.08,;6.14,3.31,;6.14,1.77,;4.81,1,;7.47,1,;7.47,2.54,)|

BDBM359980

CO[C@@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1Br |r,wU:2.1,(2.03,1,;3.36,1.77,;3.36,3.31,;2.03,4.08,;.69,3.31,;1.09,1.83,;-.4,2.22,;-.45,4.34,;-.13,5.85,;1.4,6.02,;2.02,7.43,;3.55,7.59,;1.11,8.67,;2.64,8.84,;-1.92,3.87,;-2.39,2.4,;-3.93,2.4,;-4.41,3.87,;-5.87,4.34,;-6.19,5.85,;-7.66,6.33,;-8.8,5.29,;-8.48,3.79,;-9.63,2.76,;-9.31,1.25,;-7.02,3.31,;-3.16,4.77,;-3.16,6.31,;-4.5,7.08,;-5.83,6.31,;-7.16,7.08,;-4.5,8.62,;-3.16,9.39,;-1.83,8.62,;-1.83,7.08,;-.5,6.31,;.84,7.08,;4.69,4.08,;4.69,5.62,;6.03,6.39,;7.36,5.62,;8.69,6.39,;7.36,4.08,;6.03,3.31,;6.03,1.77,)|

BDBM359981

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1C#N |r,wU:2.1,(2.15,1.39,;3.49,2.16,;3.49,3.7,;2.15,4.47,;.82,3.7,;1.22,2.21,;-.27,2.61,;-.32,4.73,;-1.79,4.25,;-2.27,2.79,;-3.81,2.79,;-4.28,4.25,;-5.75,4.73,;-6.07,6.23,;-7.53,6.71,;-8.67,5.68,;-8.35,4.17,;-9.5,3.14,;-9.18,1.64,;-6.89,3.7,;-3.04,5.16,;-3.04,6.7,;-4.37,7.47,;-5.7,6.7,;-7.04,7.47,;-4.37,9.01,;-3.04,9.78,;-1.7,9.01,;-1.7,7.47,;-.37,6.7,;.97,7.47,;4.82,4.47,;4.82,6.01,;6.15,6.78,;7.49,6.01,;8.82,6.78,;7.49,4.47,;6.15,3.64,;6.15,2.1,;6.15,.56,)|

BDBM359983

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2F)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(1.74,-9.63,;1.42,-8.12,;2.56,-7.09,;2.24,-5.59,;3.39,-4.56,;4.85,-5.03,;5.17,-6.54,;4.03,-7.57,;6.64,-7.01,;7.11,-8.48,;8.65,-8.48,;9.13,-7.01,;10.59,-6.54,;10.91,-5.03,;12.44,-4.86,;13.06,-3.45,;14.6,-3.29,;12.15,-2.21,;13.68,-2.05,;11.74,-7.57,;12.14,-9.06,;10.65,-8.66,;13.07,-6.8,;13.07,-5.26,;14.4,-7.57,;14.4,-9.11,;15.74,-6.8,;15.74,-5.26,;17.07,-4.49,;18.41,-5.26,;19.74,-4.49,;18.41,-6.8,;17.07,-7.57,;17.07,-9.11,;7.88,-6.11,;7.88,-4.57,;6.55,-3.8,;5.21,-4.57,;3.88,-3.8,;6.55,-2.26,;7.88,-1.49,;9.22,-2.26,;9.22,-3.8,;10.55,-4.57,;11.88,-3.8,)|

BDBM359987

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wU:22.23,wD:24.25,(-19.42,-10.09,;-19.74,-8.58,;-18.59,-7.55,;-18.91,-6.04,;-17.77,-5.01,;-16.3,-5.49,;-15.98,-6.99,;-17.13,-8.02,;-14.52,-7.47,;-14.04,-8.94,;-12.5,-8.94,;-12.03,-7.47,;-10.56,-6.99,;-10.24,-5.49,;-8.71,-5.32,;-8.09,-3.91,;-6.56,-3.74,;-9.01,-2.67,;-7.48,-2.5,;-9.42,-8.02,;-10.51,-9.11,;-9.02,-9.51,;-8.08,-7.25,;-8.08,-5.71,;-6.75,-8.02,;-6.75,-9.56,;-5.42,-7.25,;-4.08,-8.02,;-2.75,-7.25,;-2.75,-5.71,;-1.41,-4.94,;-4.08,-4.94,;-5.42,-5.71,;-13.27,-6.57,;-13.27,-5.03,;-14.61,-4.26,;-15.94,-5.03,;-17.27,-4.26,;-14.61,-2.72,;-13.27,-1.95,;-11.94,-2.72,;-11.94,-4.26,;-10.6,-5.03,;-9.27,-4.26,)|

BDBM359988

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-19.23,-7.92,;-19.06,-6.38,;-17.66,-5.76,;-17.5,-4.23,;-16.09,-3.6,;-14.84,-4.5,;-15.01,-6.04,;-16.41,-6.66,;-13.76,-6.94,;-13.76,-8.48,;-12.29,-8.96,;-11.39,-7.71,;-9.85,-7.71,;-9.08,-9.05,;-10.41,-9.82,;-8.31,-10.38,;-7.75,-8.28,;-7.75,-6.74,;-6.41,-9.05,;-6.41,-10.59,;-5.08,-8.28,;-3.74,-9.05,;-2.41,-8.28,;-2.41,-6.74,;-1.08,-5.97,;-3.74,-5.97,;-5.08,-6.74,;-12.29,-6.47,;-11.82,-5,;-12.85,-3.86,;-14.36,-4.18,;-15.39,-3.03,;-12.37,-2.39,;-10.87,-2.07,;-9.84,-3.22,;-10.31,-4.68,;-9.28,-5.83,;-7.78,-5.5,)|

BDBM359993

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(F)cc2Br)n1-c1c(OC)cccc1OC |r,wU:22.23,wD:24.25,(-19.42,-10.09,;-19.74,-8.58,;-18.59,-7.55,;-18.91,-6.04,;-17.77,-5.01,;-16.3,-5.49,;-15.98,-6.99,;-17.13,-8.02,;-14.52,-7.47,;-14.04,-8.94,;-12.5,-8.94,;-12.03,-7.47,;-10.56,-6.99,;-10.24,-5.49,;-8.78,-5.01,;-8.46,-3.51,;-6.99,-3.03,;-9.6,-2.48,;-8.14,-2,;-9.42,-8.02,;-10.51,-9.11,;-9.02,-9.51,;-8.08,-7.25,;-8.08,-5.71,;-6.75,-8.02,;-6.75,-9.56,;-5.42,-7.25,;-5.42,-5.71,;-4.08,-4.94,;-2.75,-5.71,;-1.41,-4.94,;-2.75,-7.25,;-4.08,-8.02,;-4.08,-9.56,;-13.27,-6.57,;-13.27,-5.03,;-14.61,-4.26,;-15.94,-5.03,;-17.27,-4.26,;-14.61,-2.72,;-13.27,-1.95,;-11.94,-2.72,;-11.94,-4.26,;-10.6,-5.03,;-9.27,-4.26,)|

BDBM359996

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@H](O)c2nc(C)c(C)s2)cc1 |r|

BDBM359997

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2nc(C)c(C)s2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-17.1,-4.4,;-15.77,-5.17,;-14.43,-4.4,;-14.43,-2.86,;-13.1,-2.09,;-11.77,-2.86,;-11.77,-4.4,;-10.43,-5.17,;-9.1,-4.4,;-13.1,-5.17,;-13.1,-6.71,;-11.85,-7.61,;-10.39,-7.14,;-9.25,-8.17,;-10.02,-9.5,;-8.48,-9.5,;-7.78,-7.69,;-7.46,-6.19,;-6.64,-8.72,;-6.96,-10.23,;-5.17,-8.25,;-3.93,-9.15,;-2.68,-8.25,;-1.22,-8.72,;-3.16,-6.78,;-2.25,-5.54,;-4.7,-6.78,;-12.33,-9.08,;-13.87,-9.08,;-14.35,-7.61,;-15.89,-7.61,;-16.66,-8.95,;-18.2,-8.95,;-18.97,-7.61,;-18.2,-6.28,;-18.97,-4.95,;-16.66,-6.28,)|

BDBM360002

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1nc(C)c(C)s1 |r,wU:2.1,wD:3.3,(-5.81,-10.75,;-6.96,-9.72,;-6.64,-8.21,;-7.78,-7.18,;-7.46,-5.67,;-9.25,-7.65,;-10.02,-8.99,;-8.48,-8.99,;-10.39,-6.62,;-11.85,-7.1,;-12.33,-8.56,;-13.87,-8.56,;-14.35,-7.1,;-15.89,-7.1,;-16.66,-8.43,;-18.2,-8.43,;-18.97,-7.1,;-18.2,-5.77,;-18.97,-4.43,;-16.66,-5.77,;-13.1,-6.19,;-13.1,-4.65,;-14.43,-3.88,;-15.77,-4.65,;-17.1,-3.88,;-14.43,-2.34,;-13.1,-1.57,;-11.77,-2.34,;-11.77,-3.88,;-10.43,-4.65,;-9.1,-3.88,;-5.17,-7.73,;-3.93,-8.64,;-2.68,-7.73,;-1.22,-8.21,;-3.16,-6.27,;-2.25,-5.02,;-4.7,-6.27,)|

BDBM360010

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@H](O)c2cnc(OC)cn2)cc1 |r|

BDBM360011

COc1cnc(cn1)[C@@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:8.9,wD:10.11,(-1.22,-8.28,;-2.37,-7.25,;-3.83,-7.73,;-4.15,-9.24,;-5.62,-9.71,;-6.76,-8.68,;-6.44,-7.17,;-4.98,-6.7,;-8.23,-9.16,;-8.55,-10.66,;-9.37,-8.13,;-9.05,-6.62,;-10.84,-8.6,;-11.61,-9.94,;-10.07,-9.94,;-11.98,-7.57,;-13.45,-8.05,;-13.92,-9.51,;-15.46,-9.51,;-15.94,-8.05,;-17.48,-8.05,;-18.25,-9.38,;-19.79,-9.38,;-20.56,-8.05,;-19.79,-6.71,;-20.56,-5.38,;-18.25,-6.71,;-14.69,-7.14,;-14.69,-5.6,;-16.03,-4.83,;-17.36,-5.6,;-18.69,-4.83,;-16.03,-3.29,;-14.69,-2.52,;-13.36,-3.29,;-13.36,-4.83,;-12.02,-5.6,;-10.69,-4.83,)|

BDBM360014

COc1cnc(cn1)[C@@H](O)[C@@H](C)S(N)(=O)=O |r|

BDBM360017

CO[C@@H]([C@@H](C)S(=O)(=O)N(Cc1ccc(OC)cc1)Cc1ccc(OC)cc1)c1cnc(OC)cn1 |r|

BDBM360018

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(OC)cn1 |r,wU:2.1,wD:3.3,(-7.4,-11.18,;-8.55,-10.15,;-8.23,-8.64,;-9.37,-7.61,;-9.05,-6.11,;-10.84,-8.09,;-11.61,-9.42,;-10.07,-9.42,;-11.98,-7.06,;-13.45,-7.53,;-13.92,-9,;-15.46,-9,;-15.94,-7.53,;-17.48,-7.53,;-18.25,-8.87,;-19.79,-8.87,;-20.56,-7.53,;-19.79,-6.2,;-20.56,-4.87,;-18.25,-6.2,;-14.69,-6.63,;-14.69,-5.09,;-16.03,-4.32,;-17.36,-5.09,;-18.69,-4.32,;-16.03,-2.78,;-14.69,-2.01,;-13.36,-2.78,;-13.36,-4.32,;-12.02,-5.09,;-10.69,-4.32,;-6.76,-8.17,;-6.44,-6.66,;-4.98,-6.18,;-3.83,-7.21,;-2.37,-6.74,;-1.22,-7.77,;-4.15,-8.72,;-5.62,-9.2,)|

BDBM360020

C[C@@H]([C@H](C)S(N)(=O)=O)c1ncc(C)cn1 |r|

BDBM360023

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.88,-8.91,;-8.2,-7.4,;-7.05,-6.37,;-7.37,-4.86,;-6.23,-3.83,;-4.77,-4.31,;-4.45,-5.82,;-5.59,-6.85,;-2.98,-6.29,;-2.5,-7.76,;-.96,-7.76,;-.49,-6.29,;.98,-5.82,;2.06,-6.9,;3.15,-7.99,;.98,-7.99,;3.15,-5.82,;4.64,-6.21,;5.04,-7.7,;5.73,-5.13,;5.33,-3.64,;6.42,-2.55,;7.91,-2.95,;9,-1.86,;8.31,-4.43,;7.22,-5.52,;-1.73,-5.39,;-1.73,-3.85,;-3.07,-3.08,;-4.4,-3.85,;-5.74,-3.08,;-3.07,-1.54,;-1.73,-.77,;-.4,-1.54,;-.4,-3.08,;.93,-3.85,;2.27,-3.08,)|

BDBM360049

C[C@H]([C@@H](O[Si](C)(C)C(C)(C)C)c1ccc(Br)cc1F)S(N)(=O)=O |r|

BDBM360050

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(cc2F)C#N)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(-16.74,-3.75,;-15.41,-4.52,;-14.07,-3.75,;-14.07,-2.21,;-12.74,-1.44,;-11.41,-2.21,;-11.41,-3.75,;-10.07,-4.52,;-8.74,-3.75,;-12.74,-4.52,;-12.74,-6.06,;-11.49,-6.96,;-10.03,-6.49,;-8.94,-7.58,;-7.85,-8.67,;-10.03,-8.67,;-7.85,-6.49,;-8.25,-5,;-6.36,-6.89,;-5.96,-8.37,;-5.27,-5.8,;-3.79,-6.2,;-2.7,-5.11,;-3.06,-3.58,;-4.58,-3.22,;-5.67,-4.31,;-7.16,-3.91,;-1.97,-2.49,;-.88,-1.4,;-11.97,-8.43,;-13.51,-8.43,;-13.99,-6.96,;-15.45,-6.49,;-15.77,-4.98,;-17.23,-4.51,;-18.38,-5.54,;-18.06,-7.04,;-19.2,-8.07,;-16.59,-7.52,)|

BDBM360052

C[C@@H]([C@@H](O)c1ccc(F)cn1)S(N)(=O)=O |r|

BDBM360053

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-6.06,7.48,;-4.73,6.71,;-3.4,7.48,;-3.4,9.02,;-2.06,9.79,;-.73,9.02,;-.73,7.48,;.6,6.71,;1.94,7.48,;-2.06,6.71,;-2.06,5.17,;-.82,4.27,;.67,4.67,;1.76,3.58,;.67,2.49,;2.85,2.49,;2.85,4.67,;2.45,6.15,;4.34,4.27,;4.73,2.78,;5.42,5.36,;5.03,6.84,;6.12,7.93,;7.6,7.53,;8.69,8.62,;8,6.05,;6.91,4.96,;-1.29,2.8,;-2.83,2.8,;-3.31,4.27,;-4.8,4.67,;-5.19,6.15,;-6.68,6.55,;-7.77,5.46,;-7.37,3.98,;-8.46,2.89,;-5.89,3.58,)|

BDBM360054

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(-6,7.51,;-4.67,6.74,;-3.33,7.51,;-3.33,9.05,;-2,9.82,;-.67,9.05,;-.67,7.51,;.67,6.74,;2,7.51,;-2,6.74,;-2,5.2,;-.75,4.3,;.73,4.7,;1.82,3.61,;.73,2.52,;2.91,2.52,;2.91,4.7,;2.51,6.19,;4.4,4.3,;4.8,2.81,;5.49,5.39,;5.09,6.88,;6.18,7.96,;7.67,7.57,;8.75,8.65,;8.06,6.08,;6.97,4.99,;-1.23,2.83,;-2.77,2.83,;-3.25,4.3,;-4.73,4.7,;-5.13,6.19,;-6.62,6.58,;-7.71,5.49,;-7.31,4.01,;-8.4,2.92,;-5.82,3.61,)|

BDBM360059

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wU:2.1,wD:3.3,(3.93,2,;5.02,3.09,;4.62,4.57,;3.13,4.97,;2.73,6.46,;2.04,3.88,;.95,2.79,;3.13,2.79,;.95,4.97,;-.53,4.57,;-1.01,3.11,;-2.55,3.11,;-3.03,4.57,;-4.51,4.97,;-4.91,6.46,;-6.4,6.86,;-7.49,5.77,;-7.09,4.28,;-8.18,3.19,;-5.6,3.88,;-1.78,5.48,;-1.78,7.02,;-3.11,7.79,;-4.45,7.02,;-5.78,7.79,;-3.11,9.33,;-1.78,10.1,;-.45,9.33,;-.45,7.79,;.89,7.02,;2.22,7.79,;5.71,5.66,;5.31,7.15,;6.4,8.24,;7.89,7.84,;8.97,8.93,;8.28,6.35,;7.2,5.26,)|

BDBM360060

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wU:2.1,wD:3.3,(3.74,2.06,;4.83,3.15,;4.43,4.64,;2.94,5.03,;2.54,6.52,;1.85,3.95,;.76,2.86,;2.94,2.86,;.76,5.03,;-.72,4.64,;-1.2,3.17,;-2.74,3.17,;-3.22,4.64,;-4.7,5.03,;-5.1,6.52,;-6.59,6.92,;-7.68,5.83,;-7.28,4.34,;-8.37,3.25,;-5.79,3.95,;-1.97,5.54,;-1.97,7.08,;-3.3,7.85,;-4.64,7.08,;-5.97,7.85,;-3.3,9.39,;-1.97,10.16,;-.64,9.39,;-.64,7.85,;.7,7.08,;2.03,7.85,;5.52,5.72,;5.12,7.21,;6.21,8.3,;7.7,7.9,;8.79,8.99,;8.09,6.41,;7.01,5.33,)|

BDBM360061

CO[C@H]([C@H](C)S(N)(=O)=O)c1ccc(Br)cc1F |r|

BDBM360062

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1F)C#N |r,wU:2.1,wD:3.3,(3.19,1.97,;4.28,3.05,;3.88,4.54,;2.4,4.94,;2,6.43,;1.31,3.85,;.22,2.76,;2.4,2.76,;.22,4.94,;-1.27,4.54,;-1.74,3.08,;-3.28,3.08,;-3.76,4.54,;-5.25,4.94,;-5.65,6.43,;-7.13,6.83,;-8.22,5.74,;-7.82,4.25,;-8.91,3.16,;-6.34,3.85,;-2.51,5.45,;-2.51,6.99,;-3.85,7.76,;-5.18,6.99,;-6.52,7.76,;-3.85,9.3,;-2.51,10.07,;-1.18,9.3,;-1.18,7.76,;.15,6.99,;1.49,7.76,;4.97,5.63,;4.58,7.12,;5.66,8.21,;7.15,7.81,;7.55,6.32,;6.46,5.23,;6.86,3.74,;8.24,8.9,;9.33,9.99,)|

BDBM360063

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1F)C#N |r,wU:2.1,wD:3.3,(3.06,2.09,;4.15,3.18,;3.75,4.67,;2.26,5.07,;1.86,6.55,;1.17,3.98,;.08,2.89,;2.26,2.89,;.08,5.07,;-1.4,4.67,;-1.88,3.2,;-3.42,3.2,;-3.9,4.67,;-5.38,5.07,;-5.78,6.55,;-7.27,6.95,;-8.36,5.86,;-7.96,4.37,;-9.05,3.29,;-6.47,3.98,;-2.65,5.57,;-2.65,7.11,;-3.98,7.88,;-5.32,7.11,;-6.65,7.88,;-3.98,9.42,;-2.65,10.19,;-1.32,9.42,;-1.32,7.88,;.02,7.11,;1.35,7.88,;4.84,5.76,;4.44,7.24,;5.53,8.33,;7.02,7.93,;7.41,6.45,;6.33,5.36,;6.72,3.87,;8.1,9.02,;9.19,10.11,)|

BDBM360064

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1F)C#N |r,wU:2.1,wD:3.3,(2.93,2.12,;4.02,3.21,;3.62,4.7,;2.13,5.1,;1.73,6.58,;1.04,4.01,;-.05,2.92,;2.13,2.92,;-.05,5.1,;-1.54,4.7,;-2.01,3.23,;-3.55,3.23,;-4.03,4.7,;-5.51,5.1,;-5.91,6.58,;-7.4,6.98,;-8.49,5.89,;-8.09,4.41,;-9.18,3.32,;-6.6,4.01,;-2.78,5.6,;-2.78,7.14,;-4.11,7.91,;-5.45,7.14,;-6.78,7.91,;-4.11,9.45,;-2.78,10.22,;-1.45,9.45,;-1.45,7.91,;-.11,7.14,;1.22,7.91,;4.71,5.79,;4.31,7.27,;5.4,8.36,;6.88,7.96,;7.28,6.48,;6.19,5.39,;6.59,3.9,;7.97,9.05,;9.06,10.14,)|

BDBM360069

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-9.69,-9.54,;-8.17,-9.8,;-7.4,-8.47,;-8.17,-7.14,;-7.4,-5.8,;-5.86,-5.8,;-5.09,-7.14,;-5.86,-8.47,;-3.76,-7.91,;-3.28,-9.37,;-1.74,-9.37,;-1.26,-7.91,;.22,-7.51,;1.56,-8.28,;.79,-9.61,;2.33,-9.61,;2.89,-7.51,;2.89,-5.97,;4.22,-8.28,;4.22,-9.82,;5.56,-7.51,;6.89,-8.28,;8.22,-7.51,;8.22,-5.97,;9.56,-5.2,;6.89,-5.2,;5.56,-5.97,;-2.51,-7,;-2.51,-4.34,;-1.13,-3.6,;.2,-4.37,;1.54,-3.6,;-1.18,-2.03,;-2.51,-1.26,;-3.84,-2.03,;-3.84,-3.57,;-5.18,-4.34,;-6.36,-3.35,)|

BDBM360075

COc1cccc(OC)c1-n1c(N)nnc1-c1ccccn1 |(-3.15,1.18,;-1.81,.41,;-.48,1.18,;-.48,2.72,;.85,3.49,;2.19,2.72,;2.19,1.18,;3.52,.41,;4.85,1.18,;.85,.41,;.85,-1.13,;2.1,-2.03,;3.59,-1.63,;1.62,-3.49,;.08,-3.49,;-.39,-2.03,;-1.88,-1.63,;-2.28,-.14,;-3.77,.25,;-4.85,-.83,;-4.46,-2.32,;-2.97,-2.72,)|

BDBM360076

COc1cccc(OC)c1-n1c(N)nnc1-c1cccnc1 |(-3.15,1.18,;-1.81,.41,;-.48,1.18,;-.48,2.72,;.85,3.49,;2.19,2.72,;2.19,1.18,;3.52,.41,;4.85,1.18,;.85,.41,;.85,-1.13,;2.1,-2.03,;3.59,-1.63,;1.62,-3.49,;.08,-3.49,;-.39,-2.03,;-1.88,-1.63,;-2.28,-.14,;-3.77,.25,;-4.85,-.83,;-4.46,-2.32,;-2.97,-2.72,)|

BDBM360081

COc1cccc(OC)c1-n1c(NC(=O)[C@H](C)Cc2ccccc2)nnc1-c1cncc(C)c1 |r,wD:15.16,(-6.71,6.66,;-5.37,5.89,;-4.04,6.66,;-4.04,8.2,;-2.7,8.97,;-1.37,8.2,;-1.37,6.66,;-.04,5.89,;1.3,6.66,;-2.7,5.89,;-2.7,4.35,;-1.46,3.45,;.01,3.92,;1.15,2.89,;.83,1.39,;2.61,3.37,;2.93,4.87,;3.76,2.34,;5.22,2.81,;6.37,1.78,;7.83,2.26,;8.15,3.77,;7.01,4.8,;5.54,4.32,;-1.93,1.98,;-3.47,1.98,;-3.95,3.45,;-5.42,3.92,;-5.74,5.43,;-7.2,5.91,;-8.34,4.87,;-8.02,3.37,;-9.17,2.34,;-6.56,2.89,)|

BDBM360086

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)C2(C)COC2)nnc1-c1cncc(C)c1 |r,wD:17.18,(-4.8,-3.85,;-3.77,-5,;-2.26,-4.68,;-1.78,-3.21,;-.28,-2.89,;.75,-4.04,;.28,-5.5,;1.38,-6.5,;2.85,-6.03,;-1.23,-5.82,;-1.71,-7.29,;-.8,-8.53,;.74,-8.53,;1.51,-9.87,;.18,-10.64,;2.28,-11.2,;2.84,-9.1,;4.18,-9.87,;4.18,-11.41,;5.51,-9.1,;4.18,-8.33,;6.6,-10.18,;7.69,-9.1,;6.6,-8.01,;-1.71,-9.78,;-3.17,-9.3,;-3.17,-7.76,;-4.42,-6.86,;-5.82,-7.48,;-7.07,-6.58,;-6.91,-5.05,;-5.5,-4.42,;-5.34,-2.89,;-4.26,-5.32,)|

BDBM360089

CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:2.1,(5.9,-8.29,;4.57,-7.52,;4.57,-5.98,;3.23,-5.21,;1.9,-5.98,;2.67,-7.31,;1.13,-7.31,;.57,-5.21,;-.77,-5.98,;-1.24,-7.44,;-2.78,-7.44,;-3.26,-5.98,;-4.75,-5.58,;-5.15,-4.09,;-6.63,-3.69,;-7.72,-4.78,;-7.32,-6.27,;-8.41,-7.36,;-9.9,-6.96,;-5.84,-6.67,;-2.01,-5.07,;-2.01,-3.17,;-3.35,-2.4,;-4.68,-3.17,;-6.02,-2.4,;-3.35,-.86,;-2.01,-.09,;-.68,-.86,;-.68,-2.4,;.65,-3.17,;1.99,-2.4,;5.9,-5.21,;7.23,-5.98,;8.57,-5.21,;8.57,-3.67,;9.9,-2.9,;7.23,-2.9,;5.9,-3.67,)|

BDBM360102

COCCO[C@H]([C@@H](C)S(=O)(=O)N(C)c1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:6.6,5.4,(6.66,-25.04,;6.66,-23.5,;5.32,-22.73,;5.32,-21.19,;3.99,-20.42,;3.99,-18.88,;2.66,-18.11,;2.66,-16.57,;1.32,-18.88,;.55,-20.21,;2.09,-20.21,;-.01,-18.11,;.31,-16.6,;-1.48,-18.58,;-1.93,-20.08,;-3.49,-20.05,;-3.97,-18.58,;-5.43,-18.11,;-6.2,-19.44,;-7.74,-19.44,;-8.51,-18.11,;-7.74,-16.77,;-8.51,-15.44,;-6.2,-16.77,;-2.72,-17.68,;-2.72,-16.14,;-1.34,-15.39,;-.01,-16.16,;1.33,-15.39,;-1.39,-13.83,;-2.72,-13.06,;-4.06,-13.83,;-4.06,-15.37,;-5.39,-16.14,;-6.57,-15.15,;5.32,-18.11,;6.66,-18.88,;7.99,-18.11,;7.99,-16.57,;9.32,-15.8,;6.66,-15.8,;5.32,-16.57,)|

BDBM360103

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC[C@@H](C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,21.23,(-9.31,-4.34,;-10.64,-5.11,;-11.98,-4.34,;-12.02,-2.77,;-13.36,-2,;-14.69,-2.77,;-14.69,-4.31,;-16.02,-5.08,;-17.2,-4.09,;-13.36,-5.08,;-13.36,-6.62,;-12.11,-7.52,;-10.65,-7.05,;-9.31,-7.82,;-10.08,-9.15,;-8.54,-9.15,;-7.98,-7.05,;-7.98,-5.51,;-6.65,-7.82,;-6.65,-9.36,;-5.31,-10.13,;-5.31,-11.67,;-3.98,-12.44,;-6.65,-12.44,;-5.31,-7.05,;-3.98,-7.82,;-2.64,-7.05,;-2.64,-5.51,;-1.31,-4.74,;-3.98,-4.74,;-5.31,-5.51,;-12.59,-8.99,;-14.13,-8.99,;-14.6,-7.52,;-16.07,-7.05,;-16.84,-8.38,;-18.38,-8.38,;-19.15,-7.05,;-18.38,-5.71,;-19.15,-4.38,;-16.84,-5.71,)|

BDBM360117

CCc1cncc(c1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-9.66,6.22,;-8.12,6.22,;-7.35,4.88,;-8.12,3.55,;-7.35,2.22,;-5.81,2.22,;-5.04,3.55,;-5.81,4.88,;-3.5,3.55,;-3.02,2.09,;-1.48,2.09,;-1.01,3.55,;.32,4.32,;1.66,3.55,;.32,2.78,;2.99,2.78,;2.99,4.32,;2.99,5.86,;4.33,3.55,;5.66,4.32,;6.99,3.55,;8.33,4.32,;8.33,5.86,;9.66,6.63,;6.99,6.63,;5.66,5.86,;-2.25,4.45,;-2.25,5.99,;-3.59,6.76,;-4.92,5.99,;-6.26,6.76,;-3.59,8.3,;-2.25,9.07,;-.92,8.3,;-.92,6.76,;.41,5.99,;1.75,6.76,)|

BDBM360118

CCc1cncc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-9.66,6,;-8.12,6,;-7.35,4.67,;-8.12,3.33,;-7.35,2,;-5.81,2,;-5.04,3.33,;-5.81,4.67,;-3.5,3.33,;-3.02,1.87,;-1.48,1.87,;-1.01,3.33,;.32,4.1,;1.66,3.33,;.32,2.56,;2.99,2.56,;2.99,4.1,;2.99,5.64,;4.33,3.33,;5.66,4.1,;6.99,3.33,;8.33,4.1,;8.33,5.64,;9.66,6.41,;6.99,6.41,;5.66,5.64,;-2.25,4.24,;-2.25,5.78,;-3.59,6.55,;-4.92,5.78,;-6.26,6.55,;-3.59,8.09,;-2.25,8.86,;-.92,8.09,;-.92,6.55,;.41,5.78,;1.75,6.55,)|

BDBM360119

CCc1cncc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-9.66,6.43,;-8.12,6.43,;-7.35,5.1,;-8.12,3.77,;-7.35,2.43,;-5.81,2.43,;-5.04,3.77,;-5.81,5.1,;-3.5,3.77,;-3.02,2.3,;-1.48,2.3,;-1.01,3.77,;.32,4.54,;1.66,3.77,;.32,3,;2.99,3,;2.99,4.54,;2.99,6.08,;4.33,3.77,;5.66,4.54,;6.99,3.77,;8.33,4.54,;8.33,6.08,;9.66,6.85,;6.99,6.85,;5.66,6.08,;-2.25,4.67,;-2.25,6.21,;-3.59,6.98,;-4.92,6.21,;-6.26,6.98,;-3.59,8.52,;-2.25,9.29,;-.92,8.52,;-.92,6.98,;.41,6.21,;1.75,6.98,)|

BDBM360120

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(2.97,13.76,;4.3,14.53,;4.3,16.07,;2.97,16.84,;2.97,18.38,;1.63,16.07,;.86,14.73,;2.4,14.73,;.3,16.84,;-1.04,16.07,;-1.2,14.53,;-2.7,14.21,;-3.47,15.55,;-5.01,15.55,;-5.78,16.88,;-7.32,16.88,;-8.09,15.55,;-7.32,14.21,;-8.09,12.88,;-9.63,12.88,;-5.78,14.21,;-2.44,16.69,;-2.76,18.2,;-4.23,18.67,;-5.72,18.28,;-6.49,19.61,;-4.55,20.18,;-3.4,21.21,;-1.94,20.73,;-1.62,19.23,;-.15,18.75,;1.33,19.15,;5.63,16.84,;6.97,16.07,;8.3,16.84,;8.3,18.38,;9.63,19.15,;6.97,19.15,;5.63,18.38,)|

BDBM360121

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(2.97,14.2,;4.3,14.97,;4.3,16.51,;2.97,17.28,;2.97,18.82,;1.63,16.51,;.86,15.18,;2.4,15.18,;.3,17.28,;-1.04,16.51,;-1.2,14.98,;-2.7,14.66,;-3.47,16,;-5.01,16,;-5.78,17.33,;-7.32,17.33,;-8.09,16,;-7.32,14.66,;-8.09,13.33,;-9.63,13.33,;-5.78,14.66,;-2.44,17.14,;-2.76,18.65,;-4.23,19.12,;-5.72,18.72,;-6.49,20.06,;-4.55,20.63,;-3.4,21.66,;-1.94,21.18,;-1.62,19.68,;-.15,19.2,;1.33,19.6,;5.63,17.28,;6.97,16.51,;8.3,17.28,;8.3,18.82,;9.63,19.59,;6.97,19.59,;5.63,18.82,)|

BDBM360122

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(2.97,14.08,;4.3,14.85,;4.3,16.39,;2.97,17.16,;2.97,18.7,;1.63,16.39,;.86,15.06,;2.4,15.06,;.3,17.16,;-1.04,16.39,;-1.2,14.86,;-2.7,14.54,;-3.47,15.87,;-5.01,15.87,;-5.78,17.21,;-7.32,17.21,;-8.09,15.87,;-7.32,14.54,;-8.09,13.21,;-9.63,13.21,;-5.78,14.54,;-2.44,17.02,;-2.76,18.53,;-4.23,19,;-5.72,18.6,;-6.49,19.94,;-4.55,20.51,;-3.4,21.54,;-1.94,21.06,;-1.62,19.56,;-.15,19.08,;1.33,19.48,;5.63,17.16,;6.97,16.39,;8.3,17.16,;8.3,18.7,;9.63,19.47,;6.97,19.47,;5.63,18.7,)|

BDBM360123

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(2.97,14.11,;4.3,14.88,;4.3,16.42,;2.97,17.19,;2.97,18.73,;1.63,16.42,;.86,15.09,;2.4,15.09,;.3,17.19,;-1.04,16.42,;-1.2,14.89,;-2.7,14.57,;-3.47,15.9,;-5.01,15.9,;-5.78,17.24,;-7.32,17.24,;-8.09,15.9,;-7.32,14.57,;-8.09,13.24,;-9.63,13.24,;-5.78,14.57,;-2.44,17.05,;-2.76,18.55,;-4.23,19.03,;-5.72,18.63,;-6.49,19.96,;-4.55,20.54,;-3.4,21.57,;-1.94,21.09,;-1.62,19.58,;-.15,19.11,;1.33,19.51,;5.63,17.19,;6.97,16.42,;8.3,17.19,;8.3,18.73,;9.63,19.5,;6.97,19.5,;5.63,18.73,)|

BDBM360124

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(2.97,13.61,;4.3,14.38,;4.3,15.92,;2.97,16.69,;2.97,18.23,;1.63,15.92,;.86,14.59,;2.4,14.59,;.3,16.69,;-1.04,15.92,;-1.2,14.39,;-2.7,14.07,;-3.47,15.41,;-5.01,15.41,;-5.78,16.74,;-7.32,16.74,;-8.09,15.41,;-7.32,14.07,;-8.09,12.74,;-9.63,12.74,;-5.78,14.07,;-2.44,16.55,;-2.76,18.06,;-4.23,18.53,;-5.72,18.13,;-6.49,19.47,;-4.55,20.04,;-3.4,21.07,;-1.94,20.59,;-1.62,19.09,;-.15,18.61,;1.33,19.01,;5.63,16.69,;6.97,15.92,;8.3,16.69,;8.3,18.23,;9.63,19,;6.97,19,;5.63,18.23,)|

BDBM360125

CN[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(2.97,14.95,;4.3,15.72,;4.3,17.26,;2.97,18.03,;2.97,19.57,;1.63,17.26,;.86,15.93,;2.4,15.93,;.3,18.03,;-1.04,17.26,;-1.2,15.73,;-2.7,15.41,;-3.47,16.74,;-5.01,16.74,;-5.78,18.08,;-7.32,18.08,;-8.09,16.74,;-7.32,15.41,;-8.09,14.08,;-9.63,14.08,;-5.78,15.41,;-2.44,17.89,;-2.76,19.39,;-4.23,19.87,;-5.72,19.47,;-6.49,20.8,;-4.55,21.38,;-3.4,22.41,;-1.94,21.93,;-1.62,20.42,;-.15,19.95,;1.33,20.35,;5.63,18.03,;6.97,17.26,;8.3,18.03,;8.3,19.57,;9.63,20.34,;6.97,20.34,;5.63,19.57,)|

BDBM360130

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)C(C)(C)C)n1-c1c(OC)cccc1OC |r,wD:22.23,24.25,(-18.06,-10.79,;-16.53,-10.95,;-15.63,-9.71,;-16.25,-8.3,;-15.35,-7.05,;-13.82,-7.21,;-13.19,-8.62,;-14.09,-9.87,;-11.66,-8.78,;-10.89,-10.12,;-9.38,-9.8,;-9.22,-8.26,;-7.89,-7.49,;-7.89,-5.95,;-6.55,-5.18,;-6.55,-3.64,;-5.22,-2.87,;-7.89,-2.87,;-6.55,-2.1,;-6.55,-8.26,;-5.78,-6.93,;-7.32,-9.6,;-5.22,-9.03,;-5.22,-10.57,;-3.89,-8.26,;-3.89,-6.72,;-2.55,-9.03,;-1.22,-8.26,;-2.55,-10.57,;-1.22,-9.8,;-10.63,-7.64,;-10.95,-6.13,;-12.41,-5.66,;-13.56,-6.69,;-15.02,-6.21,;-12.73,-4.15,;-11.59,-3.12,;-10.12,-3.59,;-9.8,-5.1,;-8.34,-5.58,;-7.19,-4.55,)|

BDBM360135

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)C2CC2)n1-c1c(OC)cccc1OC |r,wD:22.23,24.25,(-18.17,-10.79,;-16.63,-10.95,;-15.73,-9.71,;-16.36,-8.3,;-15.45,-7.05,;-13.92,-7.21,;-13.29,-8.62,;-14.2,-9.87,;-11.76,-8.78,;-10.99,-10.12,;-9.48,-9.8,;-9.32,-8.26,;-7.99,-7.49,;-7.99,-5.95,;-6.66,-5.18,;-6.66,-3.64,;-5.32,-2.87,;-7.99,-2.87,;-6.66,-2.1,;-6.66,-8.26,;-5.89,-6.93,;-7.43,-9.6,;-5.32,-9.03,;-5.32,-10.57,;-3.99,-8.26,;-3.99,-6.72,;-2.66,-9.03,;-1.89,-10.37,;-1.12,-9.03,;-10.73,-7.64,;-11.05,-6.13,;-12.52,-5.66,;-13.66,-6.69,;-15.12,-6.21,;-12.84,-4.15,;-11.69,-3.12,;-10.23,-3.59,;-9.91,-5.1,;-8.44,-5.58,;-7.3,-4.55,)|

BDBM360138

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:22.23,24.25,(-19.42,-10.59,;-17.88,-10.76,;-16.98,-9.51,;-17.6,-8.1,;-16.7,-6.86,;-15.17,-7.02,;-14.54,-8.42,;-15.45,-9.67,;-13.01,-8.59,;-12.24,-9.92,;-10.73,-9.6,;-10.57,-8.07,;-9.24,-7.3,;-9.24,-5.76,;-7.91,-4.99,;-7.91,-3.45,;-6.57,-2.68,;-9.24,-2.68,;-7.91,-1.91,;-7.91,-8.07,;-7.14,-6.73,;-8.68,-9.4,;-6.57,-8.84,;-6.57,-10.38,;-5.24,-8.07,;-5.24,-6.53,;-3.9,-8.84,;-3.9,-10.38,;-2.57,-11.15,;-1.24,-10.38,;-1.24,-8.84,;-2.57,-8.07,;-11.98,-7.44,;-12.3,-5.94,;-13.76,-5.46,;-14.91,-6.49,;-16.37,-6.01,;-14.08,-3.95,;-12.94,-2.92,;-11.48,-3.4,;-11.16,-4.9,;-9.69,-5.38,;-8.55,-4.35,)|

BDBM360141

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wD:24.25,22.23,(-19.49,-10.37,;-17.96,-10.53,;-17.06,-9.29,;-17.68,-7.88,;-16.78,-6.63,;-15.25,-6.79,;-14.62,-8.2,;-15.53,-9.45,;-13.09,-8.36,;-12.32,-9.7,;-10.81,-9.38,;-10.65,-7.84,;-9.32,-7.07,;-9.32,-5.53,;-7.98,-4.76,;-7.98,-3.22,;-6.65,-2.45,;-9.32,-2.45,;-7.98,-1.68,;-7.98,-7.84,;-7.21,-6.51,;-8.75,-9.18,;-6.65,-8.61,;-6.65,-10.15,;-5.32,-7.84,;-5.32,-6.3,;-3.98,-8.61,;-3.98,-10.15,;-2.65,-10.92,;-1.32,-10.15,;-1.32,-8.61,;-2.65,-7.84,;-12.06,-7.22,;-12.38,-5.71,;-13.84,-5.24,;-14.99,-6.27,;-16.45,-5.79,;-14.16,-3.73,;-13.02,-2.7,;-11.55,-3.17,;-11.23,-4.68,;-9.77,-5.16,;-8.62,-4.13,)|

BDBM360148

COc1ncccc1-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(F)cn2)n1-c1cn(C)c2ccccc12 |r,wD:16.17,18.19,(-1.75,-11.92,;-3.29,-11.92,;-4.06,-10.58,;-5.63,-10.53,;-6.4,-9.2,;-5.63,-7.87,;-4.09,-7.87,;-3.32,-9.2,;-1.78,-9.2,;-.88,-10.45,;.59,-9.97,;.59,-8.43,;1.83,-7.53,;3.24,-8.15,;4.65,-8.78,;2.61,-9.56,;3.87,-6.75,;2.96,-5.5,;5.4,-6.58,;6.3,-7.83,;6.03,-5.18,;7.56,-5.02,;8.18,-3.61,;7.28,-2.36,;7.9,-.96,;5.75,-2.52,;5.12,-3.93,;-.88,-7.96,;-1.35,-6.49,;-.45,-5.24,;-1.35,-4,;-.88,-2.53,;-2.82,-4.47,;-4.15,-3.7,;-5.48,-4.47,;-5.48,-6.01,;-4.15,-6.78,;-2.82,-6.01,)|

BDBM360154

COc1cccc(OC)c1-n1c(nnc1-c1cncc(C)c1)N(CC[Si](C)(C)C)S(=O)(=O)C[C@H](O)c1ccc(Cl)cc1S(C)(=O)=O |r,wU:33.36,(-6.71,9.43,;-5.38,8.66,;-4.05,9.43,;-4.05,10.97,;-2.71,11.74,;-1.38,10.97,;-1.38,9.43,;-.05,8.66,;1.29,9.43,;-2.71,8.66,;-2.71,7.12,;-1.47,6.22,;-1.94,4.75,;-3.48,4.75,;-3.96,6.22,;-5.45,6.61,;-5.84,8.1,;-7.33,8.5,;-8.42,7.41,;-8.02,5.92,;-9.11,4.83,;-6.54,5.52,;.02,6.61,;-.75,5.28,;-2.45,5.16,;-3,4.28,;-3.89,5.35,;-2.04,3.03,;-4.87,5.05,;1.11,5.52,;.34,4.19,;1.88,4.19,;2.44,6.29,;3.78,5.52,;3.78,3.98,;5.11,6.29,;6.44,5.52,;7.78,6.29,;7.78,7.83,;9.11,8.6,;6.44,8.6,;5.11,7.83,;3.78,8.6,;2.44,7.83,;3.01,9.94,;4.55,9.94,)|

BDBM360158

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1cccc(=O)[nH]1 |(-6.98,1.79,;-5.65,1.02,;-4.31,1.79,;-4.31,3.33,;-2.98,4.1,;-1.65,3.33,;-1.65,1.79,;-.31,1.02,;1.02,1.79,;-2.98,1.02,;-2.98,-.52,;-1.73,-1.43,;-.25,-1.03,;.84,-2.12,;.07,-3.45,;1.61,-3.45,;2.18,-1.35,;3.51,-2.12,;4.84,-1.35,;6.18,-2.12,;7.51,-1.35,;7.51,.19,;8.85,.96,;6.18,.96,;4.77,.28,;3.45,1.06,;2.12,1.85,;-2.21,-2.89,;-3.75,-2.89,;-4.23,-1.43,;-5.77,-1.43,;-6.54,-.1,;-8.08,-.1,;-8.85,-1.43,;-8.08,-2.76,;-8.85,-4.1,;-6.54,-2.76,)|

BDBM360159

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1ccco1 |r,wD:16.16,18.19,(-7.59,-3.81,;-6.26,-4.58,;-4.93,-3.81,;-4.93,-2.27,;-3.59,-1.5,;-2.26,-2.27,;-2.26,-3.81,;-.92,-4.58,;.41,-3.81,;-3.59,-4.58,;-3.59,-6.12,;-2.35,-7.02,;-.88,-6.55,;.21,-7.64,;-.56,-8.97,;.98,-8.97,;1.54,-6.87,;1.54,-5.33,;2.88,-4.56,;2.88,-2.8,;4.21,-5.33,;4.21,-6.87,;2.88,-7.64,;5.54,-7.64,;5.54,-9.18,;6.88,-9.95,;8.21,-9.18,;9.54,-9.95,;8.21,-7.64,;6.88,-6.87,;-2.82,-8.49,;-4.36,-8.49,;-4.84,-7.02,;-6.3,-6.55,;-6.78,-5.08,;-8.32,-5.08,;-8.79,-6.55,;-7.55,-7.45,)|

BDBM360160

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wU:16.16,18.19,(-7.38,8.92,;-6.05,8.15,;-4.71,8.92,;-4.71,10.46,;-3.38,11.23,;-2.05,10.46,;-2.05,8.92,;-.71,8.15,;.62,8.92,;-3.38,8.15,;-3.38,6.61,;-2.13,5.7,;-.65,6.1,;.44,5.01,;-.33,3.68,;1.21,3.68,;1.78,5.78,;1.78,7.32,;3.11,8.09,;3.11,9.63,;4.44,7.32,;4.44,5.78,;3.11,5.01,;5.78,5.01,;5.78,3.47,;7.11,2.7,;8.44,3.47,;9.78,2.7,;8.44,5.01,;7.11,5.78,;-2.61,4.24,;-4.15,4.24,;-4.63,5.7,;-6.11,6.1,;-6.51,7.59,;-8,7.99,;-9.09,6.9,;-8.69,5.41,;-9.78,4.32,;-7.2,5.01,)|

BDBM360162

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.16,18.19,(-7.38,10.18,;-6.05,9.41,;-4.71,10.18,;-4.71,11.72,;-3.38,12.49,;-2.05,11.72,;-2.05,10.18,;-.71,9.41,;.62,10.18,;-3.38,9.41,;-3.38,7.87,;-2.13,6.97,;-.65,7.37,;.44,6.28,;-.33,4.94,;1.21,4.94,;1.78,7.05,;1.78,8.59,;3.11,9.36,;3.11,10.9,;4.44,8.59,;4.44,7.05,;3.11,6.28,;5.78,6.28,;5.78,4.74,;7.11,3.97,;8.44,4.74,;9.78,3.97,;8.44,6.28,;7.11,7.05,;-2.61,5.5,;-4.15,5.5,;-4.63,6.97,;-6.11,7.37,;-6.51,8.85,;-8,9.25,;-9.09,8.16,;-8.69,6.68,;-9.78,5.59,;-7.2,6.28,)|

BDBM360163

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.16,wD:18.19,(-7.38,8.92,;-6.05,8.15,;-4.71,8.92,;-4.71,10.46,;-3.38,11.23,;-2.05,10.46,;-2.05,8.92,;-.71,8.15,;.62,8.92,;-3.38,8.15,;-3.38,6.61,;-2.13,5.7,;-.65,6.1,;.44,5.01,;-.33,3.68,;1.21,3.68,;1.78,5.78,;1.78,7.32,;3.11,8.09,;3.11,9.63,;4.44,7.32,;4.44,5.78,;3.11,5.01,;5.78,5.01,;5.78,3.47,;7.11,2.7,;8.44,3.47,;9.78,2.7,;8.44,5.01,;7.11,5.78,;-2.61,4.24,;-4.15,4.24,;-4.63,5.7,;-6.11,6.1,;-6.51,7.59,;-8,7.99,;-9.09,6.9,;-8.69,5.41,;-9.78,4.32,;-7.2,5.01,)|

BDBM360164

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.16,18.19,(-7.38,9.23,;-6.05,8.46,;-4.71,9.23,;-4.71,10.77,;-3.38,11.54,;-2.05,10.77,;-2.05,9.23,;-.71,8.46,;.62,9.23,;-3.38,8.46,;-3.38,6.92,;-2.13,6.01,;-.65,6.41,;.44,5.32,;-.33,3.99,;1.21,3.99,;1.78,6.09,;1.78,7.63,;3.11,8.4,;3.11,9.94,;4.44,7.63,;4.44,6.09,;3.11,5.32,;5.78,5.32,;5.78,3.78,;7.11,3.01,;8.44,3.78,;9.78,3.01,;8.44,5.32,;7.11,6.09,;-2.61,4.55,;-4.15,4.55,;-4.63,6.01,;-6.11,6.41,;-6.51,7.9,;-8,8.3,;-9.09,7.21,;-8.69,5.72,;-9.78,4.63,;-7.2,5.32,)|

BDBM360165

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.16,18.19,(-7.38,8.92,;-6.05,8.15,;-4.71,8.92,;-4.71,10.46,;-3.38,11.23,;-2.05,10.46,;-2.05,8.92,;-.71,8.15,;.62,8.92,;-3.38,8.15,;-3.38,6.61,;-2.13,5.7,;-.65,6.1,;.44,5.01,;-.33,3.68,;1.21,3.68,;1.78,5.78,;1.78,7.32,;3.11,8.09,;3.11,9.63,;4.44,7.32,;4.44,5.78,;3.11,5.01,;5.78,5.01,;5.78,3.47,;7.11,2.7,;8.44,3.47,;9.78,2.7,;8.44,5.01,;7.11,5.78,;-2.61,4.24,;-4.15,4.24,;-4.63,5.7,;-6.11,6.1,;-6.51,7.59,;-8,7.99,;-9.09,6.9,;-8.69,5.41,;-9.78,4.32,;-7.2,5.01,)|

BDBM360166

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.16,18.19,(-10.52,6.97,;-9.03,6.57,;-7.95,7.66,;-8.34,9.14,;-7.26,10.23,;-5.77,9.83,;-5.37,8.35,;-6.46,7.26,;-3.88,7.95,;-3.41,6.48,;-1.87,6.48,;-1.39,7.95,;.1,8.35,;1.19,7.26,;.42,5.92,;1.96,5.92,;2.52,8.03,;2.52,9.57,;3.85,10.34,;3.85,11.88,;5.19,9.57,;5.19,8.03,;3.85,7.26,;6.52,7.26,;6.52,5.72,;7.85,4.95,;9.19,5.72,;10.52,4.95,;9.19,7.26,;7.85,8.03,;-2.64,8.85,;-2.64,10.39,;-3.97,11.16,;-5.3,10.39,;-6.64,11.16,;-3.97,12.7,;-2.64,13.47,;-1.3,12.7,;-1.3,11.16,;.03,10.39,;1.37,11.16,)|

BDBM360167

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.16,wD:18.19,(-10.52,6.97,;-9.03,6.57,;-7.95,7.66,;-8.34,9.14,;-7.26,10.23,;-5.77,9.83,;-5.37,8.35,;-6.46,7.26,;-3.88,7.95,;-3.41,6.48,;-1.87,6.48,;-1.39,7.95,;.1,8.35,;1.19,7.26,;.42,5.92,;1.96,5.92,;2.52,8.03,;2.52,9.57,;3.85,10.34,;3.85,11.88,;5.19,9.57,;5.19,8.03,;3.85,7.26,;6.52,7.26,;6.52,5.72,;7.85,4.95,;9.19,5.72,;10.52,4.95,;9.19,7.26,;7.85,8.03,;-2.64,8.85,;-2.64,10.39,;-3.97,11.16,;-5.3,10.39,;-6.64,11.16,;-3.97,12.7,;-2.64,13.47,;-1.3,12.7,;-1.3,11.16,;.03,10.39,;1.37,11.16,)|

BDBM360171

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wU:3.3,2.1,(-3.67,4.53,;-2.77,5.77,;-1.24,5.61,;-.33,6.86,;1.2,6.7,;-.96,8.27,;-2.36,7.64,;.45,8.89,;-1.58,9.67,;-.68,10.92,;.86,10.92,;1.34,12.38,;.09,13.29,;.09,14.83,;-1.24,15.6,;-1.24,17.14,;.09,17.91,;1.43,17.14,;2.76,17.91,;2.76,19.45,;1.43,15.6,;-1.15,12.38,;-2.62,12.86,;-2.94,14.37,;-1.79,15.4,;-2.11,16.9,;-4.4,14.84,;-5.55,13.81,;-5.23,12.3,;-3.76,11.83,;-3.44,10.32,;-4.59,9.29,;-.61,4.21,;.92,4.05,;1.55,2.64,;.64,1.39,;-.89,1.55,;-1.51,2.96,;-3.05,3.12,;-4.58,3.28,;1.27,-.01,;1.9,-1.42,)|

BDBM360181

CO[C@@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1S(C)(=O)=O)C#N |r,wU:2.1,(4.44,-11.56,;3.11,-10.79,;3.11,-9.25,;1.78,-8.48,;.44,-9.25,;-.33,-10.58,;1.21,-10.58,;-.65,-8.16,;-1.42,-9.49,;-3.07,-9.67,;-3.67,-10.47,;-4.54,-9.35,;-2.76,-11.77,;-5.56,-8.57,;-2.13,-8.56,;-2.61,-10.02,;-4.15,-10.02,;-4.63,-8.56,;-6.11,-8.16,;-6.51,-6.67,;-8,-6.27,;-9.09,-7.36,;-8.69,-8.85,;-9.78,-9.94,;-9.38,-11.43,;-7.2,-9.25,;-3.38,-7.65,;-3.38,-6.11,;-2.05,-5.34,;-.71,-6.11,;.62,-5.34,;-2.05,-3.8,;-3.38,-3.03,;-4.71,-3.8,;-4.71,-5.34,;-6.05,-6.11,;-7.38,-5.34,;4.44,-8.48,;5.78,-9.25,;7.11,-8.48,;7.16,-6.91,;5.78,-6.17,;4.44,-6.94,;3.11,-6.17,;1.78,-6.94,;2.34,-4.83,;3.88,-4.83,;8.46,-6.16,;9.81,-5.38,)|

BDBM360186

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ccc(cc2S(C)(=O)=O)C#N)nnc1-c1cncc(C)c1 |r,wD:17.18,(.62,-9.33,;-.71,-10.1,;-2.05,-9.33,;-2.05,-7.79,;-3.38,-7.02,;-4.71,-7.79,;-4.71,-9.33,;-6.05,-10.1,;-7.38,-9.33,;-3.38,-10.1,;-3.38,-11.64,;-2.13,-12.54,;-.65,-12.14,;.44,-13.23,;-.33,-14.57,;1.21,-14.57,;1.78,-12.46,;3.11,-13.23,;3.11,-14.77,;4.44,-12.46,;5.78,-13.23,;7.11,-12.46,;7.16,-10.89,;5.78,-10.15,;4.44,-10.92,;3.11,-10.15,;1.78,-10.92,;2.34,-8.82,;3.88,-8.82,;8.49,-10.12,;9.83,-9.36,;-2.61,-14.01,;-4.15,-14.01,;-4.63,-12.54,;-6.11,-12.14,;-6.51,-10.66,;-8,-10.26,;-9.09,-11.35,;-8.69,-12.83,;-9.78,-13.92,;-7.2,-13.23,)|

BDBM360197

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)nc1 |r,wU:2.1,wD:3.3,(4.69,-10.47,;3.36,-9.7,;3.36,-8.16,;2.03,-7.39,;2.03,-5.85,;.69,-8.16,;-.08,-9.49,;1.46,-9.49,;-.4,-7.07,;-1.88,-7.47,;-2.36,-8.94,;-3.9,-8.94,;-4.38,-7.47,;-5.86,-7.07,;-6.26,-5.58,;-7.75,-5.19,;-8.84,-6.27,;-8.44,-7.76,;-9.53,-8.85,;-9.13,-10.34,;-6.95,-8.16,;-3.13,-6.57,;-3.13,-5.03,;-1.8,-4.26,;-.46,-5.03,;.87,-4.26,;-1.8,-2.72,;-3.13,-1.95,;-4.46,-2.72,;-4.46,-4.26,;-5.8,-5.03,;-7.13,-4.26,;4.69,-7.39,;6.03,-8.16,;7.36,-7.39,;7.36,-5.85,;8.69,-5.08,;6.03,-5.08,;4.69,-5.85,)|

BDBM360230

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@](C)(F)c2ncc(cn2)C#N)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,wD:18.20,(.53,20.29,;-.56,19.2,;-2.05,19.6,;-2.45,21.09,;-3.93,21.49,;-5.02,20.4,;-4.62,18.91,;-5.71,17.82,;-7.2,18.22,;-3.14,18.51,;-2.74,17.03,;-1.27,16.55,;.06,17.32,;1.39,16.55,;.62,15.22,;2.16,15.22,;2.16,17.88,;1.39,19.22,;3.7,17.88,;5.04,17.11,;3.7,16.34,;4.47,19.22,;6.01,19.22,;6.78,20.55,;6.04,21.93,;4.47,21.89,;3.7,20.55,;6.81,23.27,;7.58,24.6,;-1.27,15.01,;-2.74,14.54,;-3.64,15.78,;-5.18,15.78,;-5.95,17.11,;-7.49,17.11,;-8.26,15.78,;-7.49,14.45,;-8.26,13.11,;-5.95,14.45,)|

BDBM360234

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(6.15,-2.52,;4.66,-2.13,;4.27,-.64,;2.78,-.24,;2.38,1.25,;1.69,-1.33,;.92,-2.66,;2.46,-2.66,;.36,-.56,;-.98,-1.33,;-1.45,-2.79,;-2.99,-2.79,;-3.47,-1.33,;-4.96,-.93,;-5.36,.56,;-6.84,.96,;-7.93,-.13,;-7.53,-1.62,;-8.62,-2.71,;-8.22,-4.2,;-6.05,-2.02,;-2.22,-.42,;-2.22,1.12,;-3.56,1.89,;-4.89,1.12,;-6.22,1.89,;-3.56,3.43,;-2.22,4.2,;-.89,3.43,;-.89,1.89,;.44,1.12,;1.78,1.89,;5.36,.45,;6.84,.05,;7.93,1.14,;7.53,2.63,;8.62,3.72,;6.05,3.03,;4.96,1.94,)|

BDBM360236

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cn1)C#N |r,wU:2.1,wD:3.3,(5.94,-23.51,;4.45,-23.11,;4.05,-21.62,;2.56,-21.22,;2.16,-19.73,;1.47,-22.31,;.7,-23.64,;2.24,-23.64,;.38,-21.22,;-1.1,-21.62,;-1.58,-23.08,;-3.12,-23.08,;-3.59,-21.62,;-5.08,-21.22,;-6.17,-22.31,;-7.66,-21.91,;-8.06,-20.42,;-6.97,-19.34,;-7.37,-17.85,;-5.48,-19.73,;-2.35,-20.71,;-2.35,-19.17,;-3.68,-18.4,;-5.02,-19.17,;-6.35,-18.4,;-3.68,-16.86,;-2.35,-16.09,;-1.02,-16.86,;-1.02,-18.4,;.32,-19.17,;1.65,-18.4,;5.14,-20.53,;4.74,-19.04,;5.83,-17.95,;7.32,-18.35,;7.72,-19.84,;6.63,-20.93,;8.41,-17.26,;9.49,-16.18,)|

BDBM360252

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(3.68,4.58,;4.45,5.91,;3.68,7.24,;2.14,7.24,;1.37,8.58,;1.37,5.91,;2.71,5.14,;.6,4.58,;.04,6.68,;-1.29,5.91,;-1.29,4.37,;-2.76,3.89,;-3.66,5.14,;-5.2,5.14,;-5.97,6.47,;-7.51,6.47,;-8.28,5.14,;-7.51,3.81,;-8.28,2.47,;-9.8,2.74,;-5.97,3.81,;-2.76,6.39,;-3.16,7.87,;-4.64,8.27,;-5.73,7.18,;-7.22,7.58,;-5.04,9.76,;-3.95,10.85,;-2.47,10.45,;-2.07,8.96,;-.58,8.56,;.51,9.65,;4.45,8.58,;5.99,8.58,;6.76,9.91,;5.99,11.24,;6.76,12.58,;4.45,11.24,;3.68,9.91,)|

BDBM360257

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-9.79,1.95,;-8.28,1.68,;-7.51,3.02,;-8.28,4.35,;-7.51,5.68,;-5.97,5.68,;-5.2,4.35,;-5.97,3.02,;-3.66,4.35,;-2.75,3.11,;-1.29,3.58,;-1.29,5.12,;.05,5.89,;1.38,5.12,;2.71,4.35,;.61,3.79,;2.15,6.45,;1.38,7.79,;3.69,6.45,;4.46,5.12,;4.46,7.79,;6,7.79,;6.77,9.12,;6,10.46,;6.77,11.79,;4.46,10.46,;3.69,9.12,;-2.75,5.6,;-3.15,7.08,;-4.64,7.48,;-5.73,6.39,;-7.21,6.79,;-5.04,8.97,;-3.95,10.06,;-2.46,9.66,;-2.06,8.17,;-.57,7.78,;.52,8.86,)|

BDBM360260

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:4.4,3.2,(-2.17,-8.32,;-1.26,-9.57,;-1.89,-10.98,;-.98,-12.22,;.55,-12.06,;1.46,-13.31,;1.18,-10.65,;2.58,-11.28,;-.23,-10.03,;1.8,-9.25,;.9,-8,;-.64,-8,;-1.12,-6.54,;.13,-5.63,;.13,-4.09,;-1.21,-3.32,;-1.21,-1.78,;.13,-1.01,;1.46,-1.78,;2.8,-1.01,;3.98,-2,;1.46,-3.32,;1.37,-6.54,;2.84,-6.06,;3.98,-7.09,;3.66,-8.6,;4.81,-9.63,;5.45,-6.61,;5.77,-5.11,;4.62,-4.08,;3.16,-4.55,;2.01,-3.52,;2.33,-2.02,;-1.61,-13.63,;-.7,-14.87,;-1.33,-16.28,;-2.86,-16.44,;-3.49,-17.85,;-3.77,-15.2,;-3.14,-13.79,)|

BDBM360326

CNc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.73,-9.96,;-9.5,-8.63,;-8.73,-7.29,;-9.5,-5.96,;-8.73,-4.63,;-7.19,-4.63,;-6.42,-5.96,;-7.19,-7.29,;-4.88,-5.96,;-4.4,-7.42,;-2.86,-7.42,;-2.38,-5.96,;-.92,-5.48,;.22,-6.51,;.62,-8,;-1.11,-7.28,;1.56,-7.28,;1.56,-8.82,;2.89,-6.51,;4.23,-7.28,;4.23,-8.82,;5.56,-9.59,;6.89,-8.82,;8.23,-9.59,;6.89,-7.28,;5.56,-6.51,;-3.63,-5.05,;-3.63,-3.51,;-4.96,-2.74,;-6.3,-3.51,;-7.63,-2.74,;-4.96,-1.2,;-3.63,-.43,;-2.3,-1.2,;-2.3,-2.74,;-.96,-3.51,;.37,-2.74,)|

BDBM360335

C\C=C(\C)B1OC(C)(C)C(C)(C)O1

BDBM360357

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r,wD:16.17,18.19,(-7.2,5.24,;-5.87,4.47,;-4.54,5.24,;-4.54,6.78,;-3.2,7.55,;-1.87,6.78,;-1.87,5.24,;-.54,4.47,;.8,5.24,;-3.2,4.47,;-3.2,2.93,;-1.96,2.02,;-.49,2.5,;.84,1.73,;.07,.4,;1.61,.4,;2.17,2.5,;2.17,4.04,;3.51,1.73,;3.51,.19,;4.84,2.5,;6.18,1.73,;7.51,2.5,;7.51,4.04,;8.84,4.81,;6.18,4.81,;4.84,4.04,;-2.43,.56,;-3.97,.56,;-4.45,2.02,;-5.91,2.5,;-6.23,4.01,;-7.7,4.48,;-8.84,3.45,;-8.52,1.95,;-7.06,1.47,)|

BDBM360374

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(3.85,-10.07,;2.76,-8.98,;3.16,-7.49,;2.07,-6.41,;2.47,-4.92,;.58,-6.8,;-.19,-8.14,;1.35,-8.14,;-.51,-5.72,;-2,-6.11,;-2.47,-7.58,;-4.01,-7.58,;-4.49,-6.11,;-6.03,-6.11,;-6.8,-7.45,;-8.34,-7.45,;-9.11,-6.11,;-8.34,-4.78,;-6.8,-4.78,;-3.24,-5.21,;-3.24,-3.67,;-4.58,-2.9,;-5.91,-3.67,;-7.24,-2.9,;-4.58,-1.36,;-3.24,-.59,;-1.91,-1.36,;-1.91,-2.9,;-.57,-3.67,;.76,-2.9,;4.64,-7.1,;5.04,-5.61,;6.53,-5.21,;7.62,-6.3,;9.11,-5.9,;7.22,-7.79,;5.73,-8.18,)|

BDBM360375

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ccnc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(4.06,-4.59,;2.92,-3.56,;3.24,-2.05,;2.09,-1.02,;2.41,.49,;.63,-1.49,;-.14,-2.83,;1.4,-2.83,;-.52,-.46,;-1.98,-.94,;-2.46,-2.4,;-4,-2.4,;-4.47,-.94,;-6.01,-.94,;-6.78,-2.27,;-8.32,-2.27,;-9.09,-.94,;-8.32,.39,;-6.78,.39,;-3.23,-.03,;-3.23,1.51,;-4.56,2.28,;-5.9,1.51,;-7.23,2.28,;-4.56,3.82,;-3.23,4.59,;-1.89,3.82,;-1.89,2.28,;-.56,1.51,;.77,2.28,;4.7,-1.57,;5.02,-.07,;6.49,.41,;7.63,-.62,;9.09,-.15,;7.31,-2.13,;5.84,-2.6,)|

BDBM360377

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ccnc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(3.85,-10.07,;2.76,-8.98,;3.16,-7.49,;2.07,-6.41,;2.47,-4.92,;.58,-6.8,;-.19,-8.14,;1.35,-8.14,;-.51,-5.72,;-2,-6.11,;-2.47,-7.58,;-4.01,-7.58,;-4.49,-6.11,;-6.03,-6.11,;-6.8,-7.45,;-8.34,-7.45,;-9.11,-6.11,;-8.34,-4.78,;-6.8,-4.78,;-3.24,-5.21,;-3.24,-3.67,;-1.91,-2.9,;-.57,-3.67,;.76,-2.9,;-1.91,-1.36,;-3.24,-.59,;-4.58,-1.36,;-4.58,-2.9,;-5.91,-3.67,;-7.24,-2.9,;4.64,-7.1,;5.04,-5.61,;6.53,-5.21,;7.62,-6.3,;9.11,-5.9,;7.22,-7.79,;5.73,-8.18,)|

BDBM360379

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(9.64,2.67,;8.55,3.76,;7.06,3.36,;5.97,4.45,;4.49,4.05,;4.09,2.56,;5.18,1.47,;6.66,1.87,;2.6,2.16,;2.2,.68,;1.51,3.25,;1.91,4.74,;.02,2.85,;-.75,1.52,;.79,1.52,;-1.06,3.94,;-2.55,3.54,;-3.03,2.08,;-4.57,2.08,;-5.04,3.54,;-6.58,3.54,;-7.35,2.21,;-8.89,2.21,;-9.66,3.54,;-8.89,4.88,;-7.35,4.88,;-3.8,4.45,;-3.8,5.99,;-5.13,6.76,;-6.47,5.99,;-7.8,6.76,;-5.13,8.3,;-3.8,9.07,;-2.46,8.3,;-2.46,6.76,;-1.13,5.99,;.2,6.76,)|

BDBM360383

OCC1CC(F)(F)C1

BDBM360386

CC1(C)CC(C1)C(O)=O

BDBM360388

CO[C@H]([C@H](C)S(N)(=O)=O)C1CC(C)(C)C1 |r|

BDBM360392

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)ncnc1OC)C1CC(C)(C)C1 |r,wU:3.3,wD:2.1,(-4.64,-11.19,;-5.97,-10.42,;-5.97,-8.88,;-7.3,-8.11,;-7.3,-6.57,;-8.64,-8.88,;-9.41,-10.21,;-7.87,-10.21,;-9.97,-8.11,;-11.43,-8.58,;-11.91,-10.05,;-13.45,-10.05,;-13.93,-8.58,;-15.39,-8.11,;-15.71,-6.6,;-17.18,-6.12,;-18.32,-7.16,;-18,-8.66,;-19.14,-9.69,;-20.61,-9.22,;-16.54,-9.14,;-12.68,-7.68,;-12.68,-6.14,;-14.01,-5.37,;-15.35,-6.14,;-16.68,-5.37,;-14.01,-3.83,;-12.68,-3.06,;-11.35,-3.83,;-11.35,-5.37,;-10.01,-6.14,;-8.68,-5.37,;-4.64,-8.11,;-3.15,-8.51,;-2.75,-7.02,;-1.21,-7.02,;-1.98,-5.68,;-4.24,-6.62,)|

BDBM360399

CCO[C@@H]([C@H](C)S(N)(=O)=O)c1ncc(C)cn1 |r|

BDBM360403

COc1ncccc1N=C=S

BDBM360404

COc1cnc(cn1)[C@@H](OC(C)C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:8.9,wD:13.14,(9.51,6.9,;8.18,7.67,;6.84,6.9,;6.84,5.36,;5.51,4.59,;4.18,5.36,;4.18,6.9,;5.51,7.67,;2.84,4.59,;2.84,3.05,;4.18,2.28,;4.18,.74,;5.51,3.05,;1.51,5.36,;1.51,6.9,;.17,4.59,;-1.16,3.82,;1.51,3.82,;-1.16,5.36,;-2.62,4.88,;-3.1,3.42,;-4.64,3.42,;-5.12,4.88,;-6.58,5.36,;-7.73,4.33,;-9.19,4.8,;-9.51,6.31,;-8.37,7.34,;-8.69,8.84,;-6.9,6.86,;-3.87,5.79,;-3.87,7.33,;-5.2,8.1,;-6.54,7.33,;-7.87,8.1,;-5.2,9.64,;-3.87,10.41,;-2.54,9.64,;-2.54,8.1,;-1.2,7.33,;.13,8.1,)|

BDBM360405

COc1cnc(cn1)[C@@H](OC(C)C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:8.9,wD:13.14,(9.52,6.86,;8.19,7.63,;6.86,6.86,;6.86,5.32,;5.52,4.55,;4.19,5.32,;4.19,6.86,;5.52,7.63,;2.85,4.55,;2.85,3.01,;4.19,2.24,;4.19,.7,;5.52,3.01,;1.52,5.32,;1.52,6.86,;.19,4.55,;-1.15,3.78,;1.52,3.78,;-1.15,5.32,;-2.61,4.84,;-3.09,3.38,;-4.63,3.38,;-5.1,4.84,;-6.57,5.32,;-7.71,4.29,;-9.18,4.77,;-9.5,6.27,;-8.35,7.3,;-8.67,8.81,;-6.89,6.83,;-3.86,5.75,;-3.86,7.29,;-5.19,8.06,;-6.52,7.29,;-7.86,8.06,;-5.19,9.6,;-3.86,10.37,;-2.52,9.6,;-2.52,8.06,;-1.19,7.29,;.14,8.06,)|

BDBM360408

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-6.58,-2.86,;-5.25,-3.63,;-3.92,-2.86,;-3.92,-1.32,;-2.58,-.55,;-1.25,-1.32,;-1.25,-2.86,;.08,-3.63,;1.42,-2.86,;-2.58,-3.63,;-2.58,-5.17,;-1.34,-6.07,;.13,-5.6,;1.46,-6.37,;2.79,-7.14,;.13,-7.14,;2.79,-5.6,;2.79,-4.06,;4.13,-6.37,;4.13,-7.91,;5.46,-8.68,;5.46,-10.22,;6.8,-7.91,;5.46,-5.6,;5.46,-4.06,;6.8,-3.29,;8.13,-4.06,;9.46,-3.29,;8.13,-5.6,;6.8,-6.37,;-1.81,-7.54,;-3.35,-7.54,;-3.83,-6.07,;-5.29,-5.6,;-6.44,-6.63,;-7.9,-6.15,;-8.22,-4.64,;-7.08,-3.61,;-7.4,-2.11,;-5.61,-4.09,)|

BDBM360409

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,wD:18.19,(-6.58,-2.91,;-5.25,-3.68,;-3.92,-2.91,;-3.92,-1.37,;-2.58,-.6,;-1.25,-1.37,;-1.25,-2.91,;.08,-3.68,;1.42,-2.91,;-2.58,-3.68,;-2.58,-5.22,;-1.34,-6.12,;.13,-5.64,;1.46,-6.41,;2.79,-7.18,;.13,-7.18,;2.79,-5.64,;2.79,-4.1,;4.13,-6.41,;4.13,-7.95,;5.46,-8.72,;5.46,-10.26,;6.8,-7.95,;5.46,-5.64,;5.46,-4.1,;6.8,-3.33,;8.13,-4.1,;9.46,-3.33,;8.13,-5.64,;6.8,-6.41,;-1.81,-7.58,;-3.35,-7.58,;-3.83,-6.12,;-5.29,-5.64,;-6.44,-6.67,;-7.9,-6.2,;-8.22,-4.69,;-7.08,-3.66,;-7.4,-2.16,;-5.61,-4.14,)|

BDBM360410

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@H](O)c2ncc(C)cn2)cc1 |r|

BDBM360416

CN[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(5.35,-8.25,;4.01,-7.48,;4.01,-5.94,;2.68,-5.17,;2.68,-3.63,;1.35,-5.94,;.58,-7.28,;2.12,-7.28,;.01,-5.17,;-1.32,-5.94,;-1.48,-7.47,;-2.99,-7.79,;-3.76,-6.46,;-5.3,-6.46,;-6.07,-7.79,;-7.61,-7.79,;-8.38,-6.46,;-7.61,-5.13,;-8.38,-3.79,;-6.07,-5.13,;-2.73,-5.32,;-3.05,-3.81,;-1.9,-2.78,;-.44,-3.25,;1.05,-2.86,;-2.22,-1.27,;-3.69,-.8,;-4.83,-1.83,;-4.51,-3.33,;-6,-3.73,;-6.77,-2.4,;5.35,-5.17,;6.68,-5.94,;8.01,-5.17,;8.01,-3.63,;9.35,-2.86,;6.68,-2.86,;5.35,-3.63,)|

BDBM360421

COC1CN(C1)[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,7.8,(2.97,2.93,;4.3,3.7,;4.3,5.24,;3.21,6.33,;4.3,7.42,;5.39,6.33,;4.3,8.96,;2.97,9.73,;2.97,11.27,;1.63,8.96,;.86,7.62,;2.4,7.62,;.3,9.73,;-1.04,8.96,;-1.2,7.43,;-2.7,7.1,;-3.47,8.44,;-5.01,8.44,;-5.78,9.77,;-7.32,9.77,;-8.09,8.44,;-7.32,7.1,;-8.09,5.77,;-9.63,5.77,;-5.78,7.1,;-2.44,9.58,;-2.76,11.09,;-1.62,12.12,;-.15,11.64,;1.33,12.04,;-1.94,13.63,;-3.4,14.1,;-4.55,13.07,;-4.23,11.57,;-5.72,11.17,;-6.49,12.5,;5.63,9.73,;6.97,8.96,;8.3,9.73,;8.3,11.27,;9.63,12.04,;6.97,12.04,;5.63,11.27,)|

BDBM360422

COC1CN(C1)[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,7.8,(2.97,2.34,;4.3,3.11,;4.3,4.65,;3.21,5.74,;4.3,6.83,;5.39,5.74,;4.3,8.37,;2.97,9.14,;2.97,10.68,;1.63,8.37,;.86,7.03,;2.4,7.03,;.3,9.14,;-1.04,8.37,;-1.2,6.83,;-2.7,6.51,;-3.47,7.85,;-5.01,7.85,;-5.78,9.18,;-7.32,9.18,;-8.09,7.85,;-7.32,6.51,;-8.09,5.18,;-9.63,5.18,;-5.78,6.51,;-2.44,8.99,;-2.76,10.5,;-1.62,11.53,;-.15,11.05,;1.33,11.45,;-1.94,13.04,;-3.4,13.51,;-4.55,12.48,;-4.23,10.97,;-5.72,10.58,;-6.49,11.91,;5.63,9.14,;6.97,8.37,;8.3,9.14,;8.3,10.68,;9.63,11.45,;6.97,11.45,;5.63,10.68,)|

BDBM360423

COC1CN(C1)C([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:7.8,(2.97,1.96,;4.3,2.73,;4.3,4.27,;3.21,5.36,;4.3,6.45,;5.39,5.36,;4.3,7.99,;2.97,8.76,;2.97,10.3,;1.63,7.99,;.86,6.66,;2.4,6.66,;.3,8.76,;-1.04,7.99,;-1.2,6.46,;-2.7,6.14,;-3.47,7.47,;-5.01,7.47,;-5.78,8.81,;-7.32,8.81,;-8.09,7.47,;-7.32,6.14,;-8.09,4.81,;-9.63,4.81,;-5.78,6.14,;-2.44,8.62,;-2.76,10.12,;-1.62,11.16,;-.15,10.68,;1.33,11.08,;-1.94,12.66,;-3.4,13.14,;-4.55,12.11,;-4.23,10.6,;-5.72,10.2,;-6.49,11.54,;5.63,8.76,;6.97,7.99,;8.3,8.76,;8.3,10.3,;9.63,11.07,;6.97,11.07,;5.63,10.3,)|

BDBM360424

COC1CN(C1)C([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:7.8,(2.97,2.24,;4.3,3.01,;4.3,4.55,;3.21,5.64,;4.3,6.73,;5.39,5.64,;4.3,8.27,;2.97,9.04,;2.97,10.58,;1.63,8.27,;.86,6.94,;2.4,6.94,;.3,9.04,;-1.04,8.27,;-1.2,6.74,;-2.7,6.42,;-3.47,7.75,;-5.01,7.75,;-5.78,9.09,;-7.32,9.09,;-8.09,7.75,;-7.32,6.42,;-8.09,5.09,;-9.63,5.09,;-5.78,6.42,;-2.44,8.9,;-2.76,10.4,;-1.62,11.44,;-.15,10.96,;1.33,11.36,;-1.94,12.94,;-3.4,13.42,;-4.55,12.39,;-4.23,10.88,;-5.72,10.48,;-6.49,11.82,;5.63,9.04,;6.97,8.27,;8.3,9.04,;8.3,10.58,;9.63,11.35,;6.97,11.35,;5.63,10.58,)|

BDBM360426

CC#CC=O

BDBM360427

C\C=C\c1ccc(C)nn1

BDBM360443

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncnn1C |r,wU:2.1,wD:3.3,(-2.29,-.43,;-2.61,1.08,;-4.08,1.55,;-4.4,3.06,;-5.86,3.54,;-3.25,4.09,;-4.29,5.23,;-2.22,2.95,;-2.11,5.12,;-.65,4.65,;-.17,3.18,;1.37,3.18,;1.85,4.65,;3.31,5.12,;3.63,6.63,;5.1,7.1,;6.24,6.07,;5.92,4.57,;7.06,3.54,;4.46,4.09,;.6,5.55,;.6,7.09,;1.93,7.86,;3.27,7.09,;4.6,7.86,;1.93,9.4,;.6,10.17,;-.73,9.4,;-.73,7.86,;-2.07,7.09,;-3.4,7.86,;-5.22,.52,;-5.06,-1.01,;-6.47,-1.63,;-7.5,-.49,;-6.73,.84,;-7.36,2.25,)|

BDBM360473

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC)c1cnc(OC)cn1 |r,wU:3.3,2.1,(4.04,-9.76,;2.9,-8.73,;3.22,-7.22,;2.07,-6.19,;2.39,-4.69,;.61,-6.67,;-.16,-8,;1.38,-8,;-.53,-5.64,;-2,-6.12,;-2.48,-7.58,;-4.02,-7.58,;-4.49,-6.12,;-6.03,-6.12,;-6.8,-4.78,;-8.34,-4.78,;-9.11,-6.12,;-8.34,-7.45,;-6.8,-7.45,;-3.25,-5.21,;-3.25,-3.67,;-4.58,-2.9,;-5.91,-3.67,;-7.25,-2.9,;-4.58,-1.36,;-3.25,-.59,;-1.91,-1.36,;-1.91,-2.9,;-.58,-3.67,;.75,-2.89,;4.68,-6.75,;5.83,-7.78,;7.29,-7.3,;7.61,-5.8,;9.08,-5.32,;10.22,-6.35,;6.47,-4.77,;5,-5.24,)|

BDBM360474

CO[C@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wU:4.16,wD:2.1,(3.32,-1.77,;4.46,-2.81,;4.14,-4.31,;2.68,-4.79,;2.36,-6.29,;3.5,-7.32,;4.96,-6.85,;5.29,-5.34,;6.11,-7.88,;5.79,-9.39,;6.93,-10.42,;8.4,-9.94,;9.54,-10.97,;8.72,-8.43,;7.57,-7.4,;.89,-6.77,;.12,-8.1,;1.66,-8.1,;-.25,-5.74,;-1.72,-6.22,;-2.19,-7.68,;-3.73,-7.68,;-4.21,-6.22,;-5.75,-6.22,;-6.52,-4.88,;-8.06,-4.88,;-8.83,-6.22,;-8.06,-7.55,;-6.52,-7.55,;-2.96,-5.31,;-2.96,-3.77,;-4.3,-3,;-5.63,-3.77,;-6.96,-3,;-4.3,-1.46,;-2.96,-.69,;-1.63,-1.46,;-1.63,-3,;-.3,-3.77,;1.03,-2.99,)|

BDBM360475

CO[C@@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wU:4.16,2.1,(3.31,-1.79,;4.45,-2.82,;4.13,-4.33,;2.67,-4.8,;2.35,-6.31,;3.49,-7.34,;4.95,-6.87,;5.27,-5.36,;6.1,-7.9,;5.78,-9.4,;6.92,-10.43,;8.39,-9.96,;9.53,-10.99,;8.71,-8.45,;7.56,-7.42,;.88,-6.79,;.11,-8.12,;1.65,-8.12,;-.26,-5.76,;-1.73,-6.23,;-2.2,-7.7,;-3.74,-7.7,;-4.22,-6.23,;-5.76,-6.23,;-6.53,-4.9,;-8.07,-4.9,;-8.84,-6.23,;-8.07,-7.57,;-6.53,-7.57,;-2.97,-5.33,;-2.97,-3.79,;-4.31,-3.02,;-5.64,-3.79,;-6.98,-3.02,;-4.31,-1.48,;-2.97,-.71,;-1.64,-1.48,;-1.64,-3.02,;-.31,-3.79,;1.02,-3,)|

BDBM360476

CO[C@@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wU:4.16,2.1,(3.35,-1.78,;4.49,-2.81,;4.17,-4.32,;2.71,-4.79,;2.39,-6.3,;3.53,-7.33,;5,-6.85,;5.32,-5.35,;6.14,-7.88,;5.82,-9.39,;6.97,-10.42,;8.43,-9.94,;9.58,-10.97,;8.75,-8.44,;7.61,-7.41,;.92,-6.77,;.15,-8.11,;1.69,-8.11,;-.22,-5.74,;-1.68,-6.22,;-2.16,-7.68,;-3.7,-7.68,;-4.18,-6.22,;-5.72,-6.22,;-6.49,-4.89,;-8.03,-4.89,;-8.8,-6.22,;-8.03,-7.55,;-6.49,-7.55,;-2.93,-5.31,;-2.93,-3.77,;-4.26,-3,;-5.6,-3.77,;-6.93,-3,;-4.26,-1.46,;-2.93,-.69,;-1.6,-1.46,;-1.6,-3,;-.26,-3.77,;1.06,-2.99,)|

BDBM360477

CO[C@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC |r,wU:4.16,wD:2.1,(3.35,-1.77,;4.49,-2.8,;4.17,-4.31,;2.71,-4.78,;2.39,-6.29,;3.53,-7.32,;5,-6.84,;5.32,-5.34,;6.14,-7.88,;5.82,-9.38,;6.97,-10.41,;8.43,-9.94,;9.58,-10.97,;8.75,-8.43,;7.61,-7.4,;.92,-6.77,;.15,-8.1,;1.69,-8.1,;-.22,-5.74,;-1.68,-6.21,;-2.16,-7.68,;-3.7,-7.68,;-4.18,-6.21,;-5.72,-6.21,;-6.49,-4.88,;-8.03,-4.88,;-8.8,-6.21,;-8.03,-7.55,;-6.49,-7.55,;-2.93,-5.31,;-2.93,-3.77,;-4.26,-3,;-5.6,-3.77,;-6.93,-3,;-4.26,-1.46,;-2.93,-.69,;-1.6,-1.46,;-1.6,-3,;-.26,-3.77,;1.06,-2.98,)|

BDBM360478

CO[C@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:4.16,wD:2.1,(3.37,-1.76,;4.52,-2.79,;4.2,-4.3,;2.73,-4.77,;2.41,-6.28,;3.56,-7.31,;5.02,-6.84,;5.34,-5.33,;6.17,-7.87,;5.84,-9.37,;6.99,-10.4,;8.45,-9.93,;9.6,-10.96,;8.77,-8.42,;7.63,-7.39,;.95,-6.76,;.18,-8.09,;1.72,-8.09,;-.2,-5.73,;-1.66,-6.2,;-2.14,-7.67,;-3.68,-7.67,;-4.15,-6.2,;-5.69,-6.2,;-6.46,-4.87,;-8,-4.87,;-8.77,-6.2,;-8,-7.54,;-6.46,-7.54,;-2.91,-5.3,;-2.91,-3.76,;-4.24,-2.99,;-5.58,-3.76,;-6.91,-2.99,;-4.24,-1.45,;-2.91,-.68,;-1.57,-1.45,;-1.57,-2.99,;-.24,-3.76,;1.08,-2.97,)|

BDBM360479

CO[C@@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:4.16,2.1,(3.33,-1.77,;4.47,-2.8,;4.15,-4.3,;2.69,-4.78,;2.37,-6.29,;3.51,-7.32,;4.98,-6.84,;5.3,-5.34,;6.12,-7.87,;5.8,-9.38,;6.95,-10.41,;8.41,-9.93,;9.55,-10.96,;8.73,-8.43,;7.59,-7.4,;.9,-6.76,;.13,-8.1,;1.67,-8.1,;-.24,-5.73,;-1.71,-6.21,;-2.18,-7.67,;-3.72,-7.67,;-4.2,-6.21,;-5.74,-6.21,;-6.51,-4.87,;-8.05,-4.87,;-8.82,-6.21,;-8.05,-7.54,;-6.51,-7.54,;-2.95,-5.3,;-2.95,-3.76,;-4.29,-2.99,;-5.62,-3.76,;-6.95,-2.99,;-4.29,-1.45,;-2.95,-.68,;-1.62,-1.45,;-1.62,-2.99,;-.28,-3.76,;1.04,-2.98,)|

BDBM360480

CO[C@@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:4.16,2.1,(3.28,-1.72,;4.43,-2.75,;4.11,-4.26,;2.64,-4.73,;2.32,-6.24,;3.47,-7.27,;4.93,-6.79,;5.25,-5.29,;6.07,-7.82,;5.75,-9.33,;6.9,-10.36,;8.36,-9.89,;9.51,-10.92,;8.68,-8.38,;7.54,-7.35,;.86,-6.72,;.09,-8.05,;1.63,-8.05,;-.29,-5.69,;-1.75,-6.16,;-2.23,-7.63,;-3.77,-7.63,;-4.24,-6.16,;-5.78,-6.16,;-6.55,-4.83,;-8.09,-4.83,;-8.86,-6.16,;-8.09,-7.49,;-6.55,-7.49,;-3,-5.26,;-3,-3.72,;-4.33,-2.95,;-5.67,-3.72,;-7,-2.95,;-4.33,-1.41,;-3,-.64,;-1.67,-1.41,;-1.67,-2.95,;-.33,-3.72,;.99,-2.93,)|

BDBM360481

CO[C@H]1C[C@@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC |r,wU:4.16,wD:2.1,(3.37,-1.74,;4.51,-2.77,;4.19,-4.28,;2.73,-4.75,;2.41,-6.26,;3.55,-7.29,;5.01,-6.81,;5.33,-5.31,;6.16,-7.85,;5.84,-9.35,;6.98,-10.38,;8.45,-9.91,;9.59,-10.94,;8.77,-8.4,;7.62,-7.37,;.94,-6.74,;.17,-8.07,;1.71,-8.07,;-.2,-5.71,;-1.67,-6.18,;-2.14,-7.65,;-3.68,-7.65,;-4.16,-6.18,;-5.7,-6.18,;-6.47,-4.85,;-8.01,-4.85,;-8.78,-6.18,;-8.01,-7.52,;-6.47,-7.52,;-2.91,-5.28,;-2.91,-3.74,;-4.25,-2.97,;-5.58,-3.74,;-6.92,-2.97,;-4.25,-1.43,;-2.91,-.66,;-1.58,-1.43,;-1.58,-2.97,;-.25,-3.74,;1.08,-2.95,)|

BDBM360482

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1-c1cccnc1 |r,wD:16.16,18.31,(.68,9.07,;-.65,8.3,;-1.99,9.07,;-1.99,10.61,;-3.32,11.38,;-4.65,10.61,;-4.65,9.07,;-5.99,8.3,;-7.32,9.07,;-3.32,8.3,;-3.32,6.76,;-2.07,5.85,;-.61,6.33,;.53,5.3,;-.24,3.96,;1.3,3.96,;2,5.77,;2.32,7.28,;3.78,7.76,;4.93,6.73,;4.61,5.22,;3.14,4.74,;5.75,4.19,;5.43,2.68,;6.58,1.65,;8.04,2.13,;9.19,1.1,;8.36,3.63,;7.22,4.66,;4.1,9.26,;5.57,9.74,;6.71,8.71,;5.89,11.24,;-2.55,4.39,;-4.09,4.39,;-4.57,5.85,;-6.11,5.85,;-6.88,7.19,;-8.42,7.19,;-9.19,5.85,;-8.42,4.52,;-6.88,4.52,)|

BDBM360486

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cccc(C)n1 |r,wU:18.19,wD:16.17,(1.21,9.11,;-.12,8.34,;-1.46,9.11,;-1.46,10.65,;-2.79,11.42,;-4.12,10.65,;-4.12,9.11,;-5.46,8.34,;-6.79,9.11,;-2.79,8.34,;-2.79,6.8,;-1.55,5.9,;-.08,6.37,;1.25,5.6,;2.59,4.83,;-.08,4.83,;2.59,6.37,;2.59,7.91,;3.92,5.6,;3.92,4.06,;5.25,3.29,;5.25,1.75,;6.59,4.06,;5.25,6.37,;5.25,7.91,;6.59,8.68,;7.92,7.91,;9.26,8.68,;7.92,6.37,;6.59,5.6,;-2.02,4.43,;-3.56,4.43,;-4.04,5.9,;-5.5,6.37,;-5.82,7.88,;-7.29,8.35,;-8.43,7.32,;-8.11,5.82,;-9.26,4.79,;-6.65,5.34,)|

BDBM360487

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-9.99,4.69,;-8.52,4.21,;-7.38,5.24,;-7.7,6.75,;-6.55,7.78,;-5.09,7.3,;-4.77,5.79,;-5.91,4.76,;-3.3,5.32,;-2.83,3.85,;-1.29,3.85,;-.81,5.32,;.65,5.79,;1.99,5.02,;3.32,4.25,;.65,4.25,;3.32,5.79,;3.32,7.33,;4.65,5.02,;4.65,3.48,;5.99,2.71,;5.99,1.17,;7.32,3.48,;5.99,5.79,;5.99,7.33,;7.32,8.1,;8.65,7.33,;9.99,8.1,;8.65,5.79,;7.32,5.02,;-2.06,6.22,;-2.06,7.76,;-.73,8.53,;.61,7.76,;1.94,8.53,;-.73,10.07,;-2.06,10.84,;-3.39,10.07,;-3.39,8.53,;-4.73,7.76,;-6.06,8.53,)|

BDBM360488

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,(3.51,1.63,;3.51,3.17,;2.17,3.94,;2.17,5.48,;.84,3.17,;2.17,2.4,;-.49,2.4,;-.49,3.94,;-1.96,3.46,;-2.43,2,;-3.97,2,;-4.45,3.46,;-5.91,3.94,;-7.06,2.91,;-8.52,3.38,;-8.84,4.89,;-7.7,5.92,;-8.02,7.42,;-6.23,5.44,;-3.2,4.37,;-3.2,5.91,;-1.87,6.68,;-.54,5.91,;-1.87,8.22,;-3.2,8.99,;-4.54,8.22,;-4.54,6.68,;-5.87,5.91,;4.84,3.94,;6.18,3.17,;7.51,3.94,;7.51,5.48,;8.84,6.25,;6.18,6.25,;4.84,5.48,)|

BDBM360492

NS(=O)(=O)[C@H]1CCCNC1 |r|

BDBM360493

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wU:16.16,(-10.7,3.19,;-9.23,2.72,;-8.09,3.75,;-8.41,5.26,;-7.26,6.29,;-5.8,5.81,;-5.48,4.3,;-6.62,3.27,;-4.01,3.83,;-3.54,2.36,;-2,2.36,;-1.52,3.83,;-.06,4.3,;1.09,3.27,;2.18,2.18,;.03,2.16,;2.15,4.39,;1.71,5.87,;2.77,6.98,;4.27,6.62,;4.71,5.15,;3.65,4.03,;6.2,4.79,;6.64,3.31,;8.14,2.95,;9.2,4.07,;10.7,3.71,;8.76,5.55,;7.26,5.91,;-2.77,4.73,;-2.77,6.27,;-4.1,7.04,;-5.43,6.27,;-6.77,7.04,;-4.1,8.58,;-2.77,9.35,;-1.43,8.58,;-1.43,7.04,;-.1,6.27,;1.23,7.04,)|

BDBM363090

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(F)cn2)nnc1-c1cccc(OCC(C)(C)O)n1 |r,wU:16.17,18.19,(-6.38,1.46,;-4.89,1.06,;-3.8,2.15,;-4.2,3.64,;-3.11,4.73,;-1.62,4.33,;-1.22,2.84,;.27,2.44,;1.35,3.53,;-2.31,1.75,;-1.73,-.1,;-.27,-.57,;1.07,.2,;2.4,-.57,;1.63,-1.91,;3.73,-1.34,;3.17,.76,;2.4,2.1,;4.71,.76,;5.48,-.57,;5.48,2.1,;4.71,3.43,;5.48,4.76,;7.02,4.76,;7.79,6.1,;7.79,3.43,;7.02,2.1,;-.27,-2.11,;-1.73,-2.59,;-2.64,-1.34,;-4.12,-.94,;-4.52,.54,;-6.01,.94,;-7.1,-.15,;-6.7,-1.63,;-7.79,-2.72,;-7.39,-4.21,;-5.9,-4.61,;-5.51,-6.1,;-4.82,-3.52,;-4.42,-5.01,;-5.21,-2.03,)|

BDBM363091

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OCC(C)(C)O)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(7.02,-.57,;5.48,-.57,;4.71,.76,;3.17,.76,;2.4,2.1,;2.4,-.57,;1.63,-1.91,;3.73,-1.34,;1.07,.2,;-.27,-.57,;-.27,-2.11,;-1.73,-2.59,;-2.64,-1.34,;-4.12,-.94,;-4.52,.54,;-6.01,.94,;-7.1,-.15,;-6.7,-1.63,;-7.79,-2.72,;-7.39,-4.21,;-5.9,-4.61,;-5.51,-6.1,;-4.82,-3.52,;-4.42,-5.01,;-5.21,-2.03,;-1.73,-.1,;-2.31,1.75,;-3.8,2.15,;-4.89,1.06,;-6.38,1.46,;-4.2,3.64,;-3.11,4.73,;-1.62,4.33,;-1.22,2.84,;.27,2.44,;1.35,3.53,;5.48,2.1,;7.02,2.1,;7.79,3.43,;7.02,4.76,;7.79,6.1,;5.48,4.76,;4.71,3.43,)|

BDBM363094

COCCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:19.20,21.22,(-9.17,-8.62,;-8.08,-7.53,;-8.48,-6.04,;-7.39,-4.95,;-7.79,-3.47,;-6.7,-2.38,;-7.1,-.89,;-6.01,.2,;-4.52,-.2,;-4.12,-1.69,;-5.21,-2.78,;-2.64,-2.09,;-1.73,-3.33,;-.27,-2.86,;-.27,-1.32,;1.07,-.55,;2.4,-1.32,;1.63,-2.65,;3.73,-2.09,;3.17,.02,;2.4,1.35,;4.71,.02,;5.48,-1.32,;7.02,-1.32,;5.48,1.35,;7.02,1.35,;7.79,2.69,;7.02,4.02,;7.79,5.35,;5.48,4.02,;4.71,2.69,;-1.73,-.84,;-2.31,1.01,;-3.8,1.41,;-4.89,.32,;-6.38,.72,;-4.2,2.89,;-3.11,3.98,;-1.62,3.59,;-1.22,2.1,;.27,1.7,;1.35,2.79,)|

BDBM363104

COc1cccc(OC)c1-n1c(NS(=O)(=O)C(C)Cc2ncc(F)cn2)nnc1-c1cccnc1 |(-7.16,-3.61,;-5.82,-4.38,;-4.49,-3.61,;-4.49,-2.07,;-3.16,-1.3,;-1.82,-2.07,;-1.82,-3.61,;-.49,-4.38,;.85,-3.61,;-3.16,-4.38,;-3.16,-5.92,;-1.91,-6.82,;-.58,-6.05,;.76,-6.82,;-.01,-8.16,;1.53,-8.16,;2.09,-6.05,;2.09,-4.51,;3.43,-6.82,;4.76,-6.05,;6.09,-6.82,;7.43,-6.05,;7.43,-4.51,;8.76,-3.74,;6.09,-3.74,;4.76,-4.51,;-2.39,-8.29,;-3.93,-8.29,;-4.4,-6.82,;-5.94,-6.82,;-6.71,-5.49,;-8.25,-5.49,;-9.02,-6.82,;-8.25,-8.16,;-6.71,-8.16,)|

BDBM363154

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)c2cc(C)n(C)n2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.71,-4.2,;-9.11,-2.71,;-8.02,-1.62,;-8.42,-.13,;-7.33,.96,;-5.84,.56,;-5.45,-.93,;-6.54,-2.02,;-3.96,-1.33,;-3.48,-2.79,;-1.94,-2.79,;-1.47,-1.33,;-.13,-.56,;1.2,-1.33,;.43,-2.66,;1.97,-2.66,;2.53,-.56,;2.53,.98,;3.87,-1.33,;3.87,-2.87,;5.2,-.56,;5.2,.98,;6.67,1.46,;7.44,2.79,;7.57,.21,;9.11,.21,;6.67,-1.03,;-2.71,-.42,;-2.71,1.12,;-1.38,1.89,;-.05,1.12,;1.29,1.89,;-1.38,3.43,;-2.71,4.2,;-4.05,3.43,;-4.05,1.89,;-5.38,1.12,;-6.71,1.89,)|

BDBM363164

CO[C@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wD:2.1,(2.29,-10.26,;3.62,-9.49,;3.62,-7.95,;2.29,-7.18,;.95,-7.95,;-.14,-9.04,;1.35,-9.44,;-.14,-6.87,;.26,-5.38,;1.75,-4.98,;2.15,-3.49,;3.64,-3.09,;2.55,-2,;1.06,-2.4,;-1.62,-7.26,;-2.1,-8.73,;-3.64,-8.73,;-4.12,-7.26,;-5.6,-6.87,;-6,-5.38,;-7.49,-4.98,;-8.58,-6.07,;-8.18,-7.56,;-9.27,-8.64,;-8.87,-10.13,;-6.69,-7.95,;-2.87,-6.36,;-2.87,-4.82,;-4.2,-4.05,;-5.54,-4.82,;-6.87,-4.05,;-4.2,-2.51,;-2.87,-1.74,;-1.54,-2.51,;-1.54,-4.05,;-.2,-4.82,;1.13,-4.05,;4.95,-7.18,;4.95,-5.64,;6.29,-4.87,;7.62,-5.64,;8.95,-4.87,;7.62,-7.18,;6.29,-7.95,;6.29,-9.49,;4.95,-10.26,;7.62,-10.26,;7.62,-8.72,)|

BDBM363174

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wD:24.25,22.23,(-8.87,-19.79,;-9.27,-18.3,;-8.18,-17.22,;-8.58,-15.73,;-7.49,-14.64,;-6,-15.04,;-5.6,-16.53,;-6.69,-17.61,;-4.12,-16.92,;-3.64,-18.39,;-2.1,-18.39,;-1.62,-16.92,;-.14,-16.53,;.69,-14.96,;2.23,-14.96,;3,-13.62,;4.54,-13.62,;2.23,-12.29,;3.77,-12.29,;.95,-17.61,;-.14,-18.7,;1.35,-19.1,;2.29,-16.84,;2.29,-15.3,;3.62,-17.61,;3.62,-19.15,;4.95,-16.84,;6.29,-17.61,;7.62,-16.84,;7.62,-15.3,;8.95,-14.53,;6.29,-14.53,;4.95,-15.3,;-2.87,-16.02,;-2.87,-14.48,;-4.2,-13.71,;-5.54,-14.48,;-6.87,-13.71,;-4.2,-12.17,;-2.87,-11.4,;-1.54,-12.17,;-1.54,-13.71,;-.2,-14.48,;1.13,-13.71,)|

BDBM363726

COc1cnc(cn1)[C@@H](O)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |wU:8.9,10.11,(-14.97,-11.94,;-13.51,-12.41,;-12.37,-11.38,;-10.9,-11.86,;-9.76,-10.83,;-10.08,-9.32,;-11.54,-8.84,;-12.69,-9.87,;-8.93,-8.29,;-9.25,-6.78,;-7.47,-8.77,;-7.15,-10.27,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-5.18,-6.7,;-3.71,-7.18,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;4,-8.29,;1.39,-7.73,;-2.47,-6.27,;-2.47,-4.73,;-1.13,-3.96,;.2,-4.73,;1.53,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,)|

BDBM363198

COc1cnc(cn1)[C@@H](O)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(-1.67,3.63,;-2.76,4.71,;-4.25,4.32,;-4.65,2.83,;-6.13,2.43,;-7.22,3.52,;-6.82,5.01,;-5.34,5.4,;-8.71,3.12,;-9.11,1.63,;-9.8,4.21,;-9.4,5.7,;-11.29,3.81,;-12.06,2.48,;-10.52,2.48,;-12.37,4.9,;-13.86,4.5,;-14.34,3.04,;-15.88,3.04,;-16.35,4.5,;-17.89,4.5,;-18.66,3.17,;-20.2,3.17,;-20.97,4.5,;-20.2,5.83,;-20.97,7.17,;-18.66,5.83,;-15.11,5.41,;-15.11,6.95,;-16.44,7.72,;-17.78,6.95,;-19.11,7.72,;-16.44,9.26,;-15.11,10.03,;-13.77,9.26,;-13.77,7.72,;-12.44,6.95,;-11.11,7.72,)|

BDBM363199

COc1cnc(cn1)[C@@H](O)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(-1.48,3.63,;-2.57,4.71,;-4.06,4.32,;-4.46,2.83,;-5.95,2.43,;-7.03,3.52,;-6.64,5.01,;-5.15,5.4,;-8.52,3.12,;-8.92,1.63,;-9.61,4.21,;-9.21,5.7,;-11.1,3.81,;-11.87,2.48,;-10.33,2.48,;-12.19,4.9,;-13.68,4.5,;-14.15,3.04,;-15.69,3.04,;-16.17,4.5,;-17.71,4.5,;-18.48,3.17,;-20.02,3.17,;-20.79,4.5,;-20.02,5.83,;-20.79,7.17,;-18.48,5.83,;-14.92,5.41,;-14.92,6.95,;-16.25,7.72,;-17.59,6.95,;-18.92,7.72,;-16.25,9.26,;-14.92,10.03,;-13.59,9.26,;-13.59,7.72,;-12.25,6.95,;-10.92,7.72,)|

BDBM363200

CO[C@@H]([C@H](C)S(=O)(=O)N(Cc1ccc(OC)cc1)Cc1ccc(OC)cc1)c1cnc(OC)cn1 |r|

BDBM363201

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1cnc(OC)cn1 |r,wU:3.3,wD:2.1,(14.35,-10.98,;13.26,-9.89,;13.66,-8.4,;12.57,-7.31,;12.97,-5.83,;11.09,-7.71,;10.32,-9.05,;11.86,-9.05,;10,-6.62,;8.51,-7.02,;8.03,-8.49,;6.49,-8.49,;6.02,-7.02,;4.48,-7.02,;3.71,-8.36,;2.17,-8.36,;1.4,-7.02,;2.17,-5.69,;1.4,-4.36,;3.71,-5.69,;7.26,-6.12,;7.26,-4.58,;5.93,-3.81,;4.6,-4.58,;3.26,-3.81,;5.93,-2.27,;7.26,-1.5,;8.6,-2.27,;8.6,-3.81,;9.93,-4.58,;11.26,-3.81,;15.15,-8,;15.55,-6.52,;17.04,-6.12,;18.12,-7.21,;19.61,-6.81,;20.7,-7.9,;17.73,-8.69,;16.24,-9.09,)|

BDBM363728

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |wU:16.17,18.19,(3.81,-2.74,;2.35,-3.22,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;1.39,-7.73,;.24,-6.7,;.56,-5.2,;-1.22,-7.18,;-1.7,-8.64,;-3.24,-8.64,;-3.71,-7.18,;-5.18,-6.7,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-7.47,-8.77,;-7.15,-10.27,;-8.93,-8.29,;-9.25,-6.78,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,;-2.47,-6.27,;-2.47,-4.73,;-1.13,-3.96,;.2,-4.73,;1.53,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,)|

BDBM363205

COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)C[C@H](O)c2ccc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:23.24,(-17.25,-4.77,;-17.65,-3.28,;-16.56,-2.19,;-16.96,-.7,;-15.87,.38,;-14.38,-.01,;-13.98,-1.5,;-15.07,-2.59,;-12.49,-1.9,;-12.02,-3.36,;-10.48,-3.36,;-10,-1.9,;-8.67,-1.13,;-8.67,.41,;-7.33,1.18,;-7.33,2.72,;-5.79,2.72,;-8.87,2.72,;-7.33,4.26,;-7.33,-1.9,;-6,-2.67,;-8.1,-3.23,;-6.56,-.57,;-5.02,-.57,;-4.25,-1.9,;-4.25,.77,;-5.02,2.1,;-4.25,3.43,;-2.71,3.43,;-1.94,4.77,;-1.94,2.1,;-2.71,.77,;-11.25,-.99,;-12.12,1.76,;-13.6,2.15,;-14.69,1.07,;-16.18,1.46,;-14,3.64,;-12.91,4.73,;-11.43,4.33,;-11.03,2.84,;-9.54,2.45,;-8.45,3.54,)|

BDBM363729

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(cc2F)C#N)nnc1-c1cncc(C)c1 |wD:16.17,18.19,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;;.77,1.33,;-.77,-1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-4,.77,;-2.67,-1.54,;-1.33,-2.31,;-1.33,-3.85,;-2.67,-4.62,;-4,-3.85,;-4,-2.31,;-5.33,-1.54,;-2.67,-6.16,;-2.67,-7.7,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;4.54,-5.76,;5.45,-7.01,;4.82,-8.42,;3.29,-8.58,;2.66,-9.99,;2.38,-7.33,)|

BDBM363730

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |wU:18.19,16.17,(1.53,-3.96,;.2,-4.73,;-1.13,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,;-2.47,-4.73,;-2.47,-6.27,;-3.71,-7.18,;-5.18,-6.7,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-7.47,-8.77,;-7.15,-10.27,;-8.93,-8.29,;-9.25,-6.78,;-10.08,-9.32,;-11.54,-8.84,;-12.69,-9.87,;-12.37,-11.38,;-13.51,-12.41,;-10.9,-11.86,;-9.76,-10.83,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;4,-8.29,;1.39,-7.73,)|

BDBM363731

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ccc(cc1F)C#N |wU:2.1,wD:3.3,(-4,2.31,;-4,.77,;-2.67,,;-1.33,.77,;-1.33,2.31,;;.77,1.33,;-.77,-1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;4.54,-5.76,;5.45,-7.01,;4.82,-8.42,;3.29,-8.58,;2.66,-9.99,;2.38,-7.33,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-2.67,-1.54,;-1.33,-2.31,;-1.33,-3.85,;-2.67,-4.62,;-4,-3.85,;-4,-2.31,;-5.33,-1.54,;-2.67,-6.16,;-2.67,-7.7,)|

BDBM363732

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccccn1 |(-3.15,1.18,;-1.81,.41,;-.48,1.18,;-.48,2.72,;.85,3.49,;2.19,2.72,;2.19,1.18,;3.52,.41,;4.85,1.18,;.85,.41,;.85,-1.13,;2.1,-2.03,;3.59,-1.63,;4.68,-2.72,;4.28,-4.21,;5.77,-3.81,;6.16,-2.32,;7.25,-3.41,;8.74,-3.01,;9.88,-4.04,;11.35,-3.57,;11.67,-2.06,;13.13,-1.58,;10.53,-1.03,;9.06,-1.51,;1.62,-3.49,;.08,-3.49,;-.39,-2.03,;-1.88,-1.63,;-2.28,-.14,;-3.77,.25,;-4.85,-.83,;-4.46,-2.32,;-2.97,-2.72,)|

BDBM363733

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccnc1 |(-3.15,1.18,;-1.81,.41,;-.48,1.18,;-.48,2.72,;.85,3.49,;2.19,2.72,;2.19,1.18,;3.52,.41,;4.85,1.18,;.85,.41,;.85,-1.13,;2.1,-2.03,;3.59,-1.63,;4.68,-2.72,;4.28,-4.21,;5.77,-3.81,;6.16,-2.32,;7.25,-3.41,;8.74,-3.01,;9.88,-4.04,;11.35,-3.57,;11.67,-2.06,;13.13,-1.58,;10.53,-1.03,;9.06,-1.51,;1.62,-3.49,;.08,-3.49,;-.39,-2.03,;-1.88,-1.63,;-2.28,-.14,;-3.77,.25,;-4.85,-.83,;-4.46,-2.32,;-2.97,-2.72,)|

BDBM363264

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](N)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |wU:16.17,wD:18.19,(-.24,-15.2,;-1.14,-13.95,;-.51,-12.54,;1.02,-12.38,;1.64,-10.98,;.74,-9.73,;-.79,-9.89,;-1.42,-11.3,;-1.7,-8.64,;-3.24,-8.64,;-3.71,-7.18,;-2.47,-6.27,;-2.47,-4.73,;-3.8,-3.96,;-4.57,-5.3,;-3.03,-2.63,;-5.14,-3.19,;-6.47,-3.96,;-5.14,-1.65,;-3.8,-.88,;-6.47,-.88,;-7.8,-1.65,;-9.14,-.88,;-9.14,.66,;-10.47,1.43,;-7.8,1.43,;-6.47,.66,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;-.58,-4.17,;-.26,-2.66,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;1.39,-7.73,;1.07,-9.24,;2.21,-10.27,)|

BDBM363734

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |wD:2.1,(6.47,.66,;6.47,-.88,;7.8,-1.65,;7.8,-3.19,;6.47,-3.96,;7.24,-5.3,;5.7,-2.63,;5.14,-4.73,;5.14,-6.27,;6.38,-7.18,;5.91,-8.64,;4.37,-8.64,;3.46,-9.89,;1.93,-9.73,;1.02,-10.98,;1.65,-12.38,;3.18,-12.54,;3.81,-13.95,;2.9,-15.2,;4.09,-11.3,;3.89,-7.18,;2.42,-6.7,;2.1,-5.2,;3.25,-4.17,;2.93,-2.66,;.64,-4.72,;-.5,-5.75,;-.18,-7.26,;1.28,-7.73,;1.6,-9.24,;.46,-10.27,;9.14,-.88,;9.14,.66,;10.47,1.43,;11.8,.66,;13.14,1.43,;11.8,-.88,;10.47,-1.65,)|

BDBM363272

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)C1CCC1 |r,wU:3.3,2.1,(-3.76,1.58,;-5.1,2.35,;-5.1,3.89,;-6.43,4.66,;-6.43,6.2,;-7.76,3.89,;-8.53,2.55,;-6.99,2.55,;-9.1,4.66,;-10.43,3.89,;-10.91,2.42,;-12.45,2.42,;-12.92,3.89,;-14.41,4.29,;-14.81,5.77,;-16.3,6.17,;-17.39,5.08,;-16.99,3.59,;-18.08,2.51,;-19.56,2.9,;-15.5,3.2,;-11.68,4.79,;-11.68,6.33,;-13.01,7.1,;-14.34,6.33,;-15.68,7.1,;-13.01,8.64,;-11.68,9.41,;-10.34,8.64,;-10.34,7.1,;-9.01,6.33,;-7.68,7.1,;-3.76,4.66,;-2.28,4.26,;-1.88,5.75,;-3.36,6.14,)|

BDBM363307

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,wD:3.3,(4.81,-4.54,;3.48,-3.77,;3.48,-2.23,;2.14,-1.46,;2.14,.08,;.81,-2.23,;.04,-3.57,;1.58,-3.57,;-.52,-1.46,;-1.86,-2.23,;-2.33,-3.7,;-3.87,-3.7,;-4.35,-2.23,;-5.78,-1.91,;-6.77,-3.09,;-8.29,-2.82,;-8.81,-1.37,;-7.82,-.19,;-8.35,1.25,;-6.31,-.46,;-3.1,-1.33,;-3.57,1.51,;-5.02,2.04,;-6.2,1.05,;-7.65,1.57,;-5.29,3.55,;-4.11,4.54,;-2.66,4.02,;-2.39,2.5,;-.94,1.97,;.24,2.96,;4.81,-1.46,;6.15,-2.23,;7.48,-1.46,;7.48,.08,;8.81,.85,;6.15,.85,;4.81,.08,)|

BDBM363735

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@H](C)CCN(C)C2=O)nnc1-c1cncc(C)c1 |wU:19.20,(9.14,-3.96,;7.8,-4.73,;6.47,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;5.14,-4.73,;5.14,-6.27,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;11.6,-8.29,;12.74,-9.32,;12.42,-10.83,;10.96,-11.3,;13.57,-11.86,;15.03,-11.38,;15.35,-9.87,;16.82,-9.4,;14.21,-8.84,;14.53,-7.34,;5.91,-8.64,;4.37,-8.64,;3.89,-7.18,;2.42,-6.7,;1.28,-7.73,;-.18,-7.26,;-.5,-5.75,;.64,-4.72,;.32,-3.22,;2.1,-5.2,)|

BDBM363736

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |wU:16.16,18.19,(1.33,-5.39,;,-6.16,;-1.33,-5.39,;-1.33,-3.85,;-2.67,-3.08,;-4,-3.85,;-4,-5.39,;-5.33,-6.16,;-6.67,-5.39,;-2.67,-6.16,;-2.67,-7.7,;-1.42,-8.61,;.04,-8.13,;1.19,-9.16,;.16,-10.3,;2.22,-8.02,;2.33,-10.19,;2.01,-11.7,;3.16,-12.73,;2.84,-14.23,;4.62,-12.25,;4.94,-10.74,;3.8,-9.71,;6.41,-10.27,;6.73,-8.76,;8.19,-8.29,;9.34,-9.32,;10.8,-8.84,;9.01,-10.82,;7.55,-11.3,;-1.9,-10.07,;-3.44,-10.07,;-3.91,-8.61,;-5.38,-8.13,;-5.7,-6.62,;-7.16,-6.15,;-8.31,-7.18,;-7.99,-8.68,;-9.13,-9.71,;-6.52,-9.16,)|

BDBM363353

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wU:2.1,wD:3.3,(4.31,6.38,;2.85,5.9,;2.53,4.4,;1.06,3.92,;.74,2.41,;-.08,4.95,;-1.11,3.81,;.95,6.1,;-1.23,5.98,;-2.69,5.51,;-3.17,4.04,;-4.71,4.04,;-5.18,5.51,;-6.65,5.98,;-6.97,7.49,;-8.43,7.96,;-9.58,6.93,;-9.26,5.43,;-10.4,4.4,;-11.87,4.87,;-7.79,4.95,;-3.94,6.41,;-3.94,7.95,;-2.6,8.72,;-1.27,7.95,;.06,8.72,;-2.6,10.26,;-3.94,11.03,;-5.27,10.26,;-5.27,8.72,;-6.61,7.95,;-7.94,8.72,;3.67,3.37,;3.35,1.86,;4.49,.83,;5.96,1.31,;6.28,2.81,;5.14,3.84,;5.46,5.35,;5.78,6.86,;7.1,.28,;8.25,-.76,)|

BDBM363364

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@H](O)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-9.13,1.85,;-9.53,3.34,;-8.44,4.43,;-8.84,5.91,;-7.75,7,;-6.26,6.6,;-5.86,5.12,;-6.95,4.03,;-4.37,4.72,;-3.9,3.25,;-2.36,3.25,;-1.88,4.72,;-.55,5.49,;.79,4.72,;.02,3.38,;1.56,3.38,;2.12,5.49,;3.45,4.72,;3.45,3.18,;4.79,5.49,;6.12,4.72,;7.46,5.49,;7.46,7.03,;8.79,7.8,;6.12,7.8,;4.79,7.03,;-3.13,5.62,;-3.13,7.16,;-4.46,7.93,;-5.79,7.16,;-7.13,7.93,;-4.46,9.47,;-3.13,10.24,;-1.79,9.47,;-1.79,7.93,;-.46,7.16,;.87,7.93,)|

BDBM363380

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.29,1.57,;-.05,.8,;-1.38,1.57,;-1.38,3.11,;-2.71,3.88,;-4.05,3.11,;-4.05,1.57,;-5.38,.8,;-6.71,1.57,;-2.71,.8,;-2.71,-.74,;-1.47,-1.65,;.02,-1.25,;1.11,-2.34,;.34,-3.67,;1.88,-3.67,;2.44,-1.57,;2.44,-.03,;3.78,-2.34,;3.78,-3.88,;5.11,-1.57,;6.44,-2.34,;7.78,-1.57,;7.78,-.03,;9.11,.74,;6.44,.74,;5.11,-.03,;-1.94,-3.11,;-3.48,-3.11,;-3.96,-1.65,;-5.45,-1.25,;-5.84,.24,;-7.33,.64,;-8.42,-.45,;-8.02,-1.94,;-9.11,-3.03,;-6.54,-2.34,)|

BDBM363381

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.71,-4.2,;-9.11,-2.71,;-8.02,-1.62,;-8.42,-.13,;-7.33,.96,;-5.84,.56,;-5.45,-.93,;-6.54,-2.02,;-3.96,-1.33,;-3.48,-2.79,;-1.94,-2.79,;-1.47,-1.33,;.02,-.93,;1.11,-2.02,;.34,-3.35,;1.88,-3.35,;2.44,-1.25,;2.44,.29,;3.78,-2.02,;3.78,-3.56,;5.11,-1.25,;6.44,-2.02,;7.78,-1.25,;7.78,.29,;9.11,1.06,;6.44,1.06,;5.11,.29,;-2.71,-.42,;-2.71,1.12,;-1.38,1.89,;-.05,1.12,;1.29,1.89,;-1.38,3.43,;-2.71,4.2,;-4.05,3.43,;-4.05,1.89,;-5.38,1.12,;-6.71,1.89,)|

BDBM363392

COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@H](O)c2ncc(Cl)s2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-8.67,1.92,;-9.07,3.4,;-7.98,4.49,;-8.38,5.98,;-7.29,7.07,;-5.8,6.67,;-5.4,5.18,;-6.49,4.09,;-3.91,4.78,;-3.44,3.32,;-1.9,3.32,;-1.42,4.78,;.07,5.18,;1.16,4.09,;.39,2.76,;1.93,2.76,;2.49,4.86,;3.82,4.09,;3.82,2.55,;5.16,4.86,;5.16,6.4,;6.62,6.88,;7.53,5.63,;9.07,5.63,;6.62,4.39,;-2.67,5.69,;-2.67,7.23,;-1.33,8,;0,7.23,;1.33,8,;-1.33,9.54,;-2.67,10.31,;-4,9.54,;-4,8,;-5.33,7.23,;-6.67,8,)|

BDBM363420

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(-4.76,3.2,;-3.99,4.53,;-4.76,5.86,;-6.3,5.86,;-7.07,7.2,;-7.07,4.53,;-7.84,3.2,;-5.74,3.76,;-8.41,5.3,;-9.74,4.53,;-9.74,2.99,;-11.21,2.51,;-12.11,3.76,;-13.6,4.16,;-14,5.65,;-15.49,6.05,;-16.57,4.96,;-16.18,3.47,;-17.26,2.38,;-14.69,3.07,;-11.21,5.01,;-11.78,7.15,;-13.27,7.55,;-14.36,6.46,;-15.85,6.86,;-13.67,9.04,;-12.58,10.13,;-11.09,9.73,;-10.69,8.24,;-9.2,7.84,;-8.12,8.93,;-3.99,7.2,;-2.45,7.2,;-1.68,8.53,;-2.45,9.87,;-1.68,11.2,;-3.99,9.87,;-4.76,8.53,)|

BDBM363421

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(-4.76,3.71,;-3.99,5.05,;-4.76,6.38,;-6.3,6.38,;-7.07,7.71,;-7.07,5.05,;-7.84,3.71,;-5.74,4.28,;-8.41,5.82,;-9.74,5.05,;-9.74,3.51,;-11.21,3.03,;-12.11,4.28,;-13.6,4.67,;-14,6.16,;-15.49,6.56,;-16.57,5.47,;-16.18,3.98,;-17.26,2.9,;-14.69,3.59,;-11.21,5.52,;-11.78,7.67,;-13.27,8.06,;-14.36,6.98,;-15.85,7.37,;-13.67,9.55,;-12.58,10.64,;-11.09,10.24,;-10.69,8.75,;-9.2,8.36,;-8.12,9.45,;-3.99,7.71,;-2.45,7.71,;-1.68,9.05,;-2.45,10.38,;-1.68,11.71,;-3.99,10.38,;-4.76,9.05,)|

BDBM363422

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(-4.76,4.45,;-3.99,5.79,;-4.76,7.12,;-6.3,7.12,;-7.07,8.45,;-7.07,5.79,;-7.84,4.45,;-5.74,5.02,;-8.4,6.56,;-9.74,5.79,;-9.74,4.25,;-11.2,3.77,;-12.11,5.02,;-13.59,5.42,;-13.99,6.9,;-15.48,7.3,;-16.57,6.21,;-16.17,4.72,;-17.26,3.64,;-14.68,4.33,;-11.2,6.26,;-11.78,8.41,;-13.26,8.81,;-14.35,7.72,;-15.84,8.11,;-13.66,10.29,;-12.57,11.38,;-11.09,10.98,;-10.69,9.5,;-9.2,9.1,;-8.11,10.19,;-3.99,8.45,;-2.45,8.45,;-1.68,9.79,;-2.45,11.12,;-1.68,12.45,;-3.99,11.12,;-4.76,9.79,)|

BDBM363423

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(-4.96,3.78,;-4.19,5.11,;-4.96,6.44,;-6.5,6.44,;-7.27,7.78,;-7.27,5.11,;-8.04,3.78,;-5.93,4.34,;-8.6,5.88,;-9.94,5.11,;-9.94,3.57,;-11.4,3.09,;-12.3,4.34,;-13.79,4.74,;-14.19,6.23,;-15.68,6.62,;-16.77,5.54,;-16.37,4.05,;-17.46,2.96,;-14.88,3.65,;-11.4,5.59,;-11.97,7.73,;-13.46,8.13,;-14.55,7.04,;-16.04,7.44,;-13.86,9.62,;-12.77,10.71,;-11.28,10.31,;-10.89,8.82,;-9.4,8.42,;-8.31,9.51,;-4.19,7.78,;-2.65,7.78,;-1.88,9.11,;-2.65,10.45,;-1.88,11.78,;-4.19,10.45,;-4.96,9.11,)|

BDBM363466

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(-6.52,3.32,;-5.19,2.55,;-3.86,3.32,;-3.86,4.86,;-2.52,5.63,;-1.19,4.86,;-1.19,3.32,;.14,2.55,;1.48,3.32,;-2.52,2.55,;-2.52,1.01,;-1.28,.11,;.21,.5,;1.3,-.58,;2.39,.5,;.21,-1.67,;2.39,-1.67,;1.99,-3.16,;3.88,-1.28,;4.27,.21,;4.96,-2.36,;4.57,-3.85,;5.66,-4.94,;7.14,-4.54,;8.23,-5.63,;7.54,-3.05,;6.45,-1.97,;-1.75,-1.36,;-3.29,-1.36,;-3.77,.11,;-5.26,.5,;-6.35,-.58,;-7.83,-.19,;-8.23,1.3,;-7.14,2.39,;-7.54,3.88,;-5.66,1.99,)|

BDBM363506

CNc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.79,-4.76,;-9.56,-3.43,;-8.79,-2.1,;-9.56,-.76,;-8.79,.57,;-7.25,.57,;-6.48,-.76,;-7.25,-2.1,;-4.94,-.76,;-4.46,-2.23,;-2.92,-2.23,;-2.45,-.76,;-1.11,.01,;.22,-.76,;-.55,-2.1,;.99,-2.1,;1.56,.01,;2.89,-.76,;2.89,-2.3,;4.22,.01,;5.56,-.76,;5.56,-2.3,;6.89,-3.07,;8.22,-2.3,;9.56,-3.07,;8.22,-.76,;6.89,.01,;-3.69,.14,;-3.69,1.68,;-2.36,2.45,;-1.02,1.68,;.31,2.45,;-2.36,3.99,;-3.69,4.76,;-5.03,3.99,;-5.03,2.45,;-6.36,1.68,;-7.69,2.45,)|

BDBM363737

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |wU:18.19,wD:16.17,(1.53,-3.96,;.2,-4.73,;-1.13,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,;-2.47,-4.73,;-2.47,-6.27,;-3.71,-7.18,;-5.18,-6.7,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-7.47,-8.77,;-7.15,-10.27,;-8.93,-8.29,;-9.25,-6.78,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;4,-8.29,;1.39,-7.73,)|

BDBM363517

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(C)cccc1C)c1ncc(C)cn1 |r,wU:1.0,2.2,(.91,-3.53,;.91,-1.99,;-.43,-1.22,;-.43,.32,;-1.76,-1.99,;-2.53,-3.33,;-.99,-3.33,;-3.09,-1.22,;-4.43,-1.99,;-4.9,-3.46,;-6.44,-3.46,;-6.92,-1.99,;-8.41,-1.59,;-9.5,-2.68,;-10.98,-2.28,;-11.38,-.8,;-10.29,.29,;-10.69,1.78,;-8.81,-.11,;-5.67,-1.09,;-5.67,.45,;-7.01,1.22,;-8.34,.45,;-7.01,2.76,;-5.67,3.53,;-4.34,2.76,;-4.34,1.22,;-3.01,.45,;2.24,-1.22,;3.57,-1.99,;4.91,-1.22,;4.91,.32,;6.24,1.09,;3.57,1.09,;2.24,.32,)|

BDBM363738

COc1cccc(n1)-c1nnc(NS(=O)(=O)CCc2ncc(F)cn2)n1-c1c(OC)cccc1OC |(3.81,-2.74,;2.35,-3.22,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;1.39,-7.73,;.24,-6.7,;.56,-5.2,;-1.22,-7.18,;-1.7,-8.64,;-3.24,-8.64,;-3.71,-7.18,;-5.18,-6.7,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-7.47,-8.77,;-8.93,-8.29,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,;-2.47,-6.27,;-2.47,-4.73,;-1.13,-3.96,;.2,-4.73,;1.53,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,)|

BDBM363554

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)ncnc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(3.85,-4.74,;2.76,-3.65,;3.16,-2.16,;2.07,-1.08,;2.47,.41,;.58,-1.47,;-.19,-2.81,;1.35,-2.81,;-.51,-.39,;-2,-.78,;-2.47,-2.25,;-4.01,-2.25,;-4.49,-.78,;-6.03,-.78,;-6.8,-2.12,;-8.34,-2.12,;-9.11,-.78,;-8.34,.55,;-6.8,.55,;-3.24,.12,;-3.24,1.66,;-4.58,2.43,;-5.91,1.66,;-7.24,2.43,;-4.58,3.97,;-3.24,4.74,;-1.91,3.97,;-1.91,2.43,;-.57,1.66,;.76,2.43,;4.64,-1.77,;5.04,-.28,;6.53,.12,;7.62,-.97,;9.11,-.57,;7.22,-2.46,;5.73,-2.86,)|

BDBM363562

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)C1CCC1 |r,wU:2.1,wD:3.3,(14.72,-10.66,;13.38,-9.89,;13.38,-8.35,;12.05,-7.58,;12.05,-6.04,;10.72,-8.35,;9.95,-9.69,;11.49,-9.69,;9.38,-7.58,;8.05,-8.35,;7.57,-9.82,;6.03,-9.82,;5.56,-8.35,;4.22,-7.58,;3.14,-8.67,;1.65,-8.27,;1.25,-6.78,;2.34,-5.7,;1.94,-4.21,;3.83,-6.09,;6.8,-7.45,;6.8,-5.55,;5.47,-4.78,;4.14,-5.55,;2.8,-4.78,;5.47,-3.24,;6.8,-2.47,;8.14,-3.24,;8.14,-4.78,;9.47,-5.55,;10.81,-4.78,;14.72,-7.58,;16.21,-7.98,;16.6,-6.49,;15.12,-6.09,)|

BDBM363739

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)C2CC(F)(F)C2)n1-c1c(OC)cccc1OC |wU:16.17,18.19,(4.91,1.83,;4.01,.58,;4.63,-.82,;6.17,-.99,;6.79,-2.39,;5.89,-3.64,;4.36,-3.48,;3.73,-2.07,;3.45,-4.72,;1.91,-4.72,;1.43,-6.19,;2.68,-7.09,;2.68,-8.63,;1.35,-9.4,;2.12,-10.74,;.58,-8.07,;.01,-10.17,;.01,-11.71,;-1.32,-9.4,;-2.65,-10.17,;-1.32,-7.86,;-.23,-6.77,;-1.32,-5.68,;-2.41,-4.6,;-.23,-4.6,;-2.41,-6.77,;3.93,-6.19,;5.39,-6.66,;5.71,-8.17,;4.57,-9.2,;4.89,-10.71,;7.18,-8.65,;8.32,-7.61,;8,-6.11,;6.54,-5.63,;6.22,-4.13,;7.36,-3.1,)|

BDBM363740

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)C1CC(C)(C)C1 |wU:2.1,3.3,(3.74,-15.02,;2.41,-15.79,;1.08,-15.02,;-.26,-15.79,;-1.59,-15.02,;-.26,-17.33,;-1.8,-17.33,;1.28,-17.33,;-.26,-18.87,;-1.59,-19.64,;-3,-19.01,;-4.03,-20.15,;-3.26,-21.49,;-3.89,-22.89,;-2.98,-24.14,;-3.61,-25.55,;-5.14,-25.71,;-6.04,-24.46,;-7.58,-24.62,;-5.42,-23.06,;-1.75,-21.17,;-.61,-22.2,;-.93,-23.7,;-2.39,-24.18,;-2.71,-25.69,;.22,-24.73,;1.68,-24.26,;2,-22.75,;.86,-21.72,;1.18,-20.22,;2.64,-19.74,;1.08,-13.48,;-.01,-12.39,;1.08,-11.3,;.27,-9.98,;1.88,-9.98,;2.16,-12.39,)|

BDBM363570

COc1cccc(OC)c1-n1c(NS(=O)(=O)CC(O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |(-6.71,-4.85,;-5.38,-5.62,;-4.05,-4.85,;-4.05,-3.31,;-2.71,-2.54,;-1.38,-3.31,;-1.38,-4.85,;-.04,-5.62,;1.29,-4.85,;-2.71,-5.62,;-2.71,-7.25,;-1.47,-8.16,;-.13,-7.39,;1.2,-8.16,;.43,-9.49,;1.97,-9.49,;2.53,-7.39,;3.87,-8.16,;3.87,-9.7,;5.2,-7.39,;6.54,-8.16,;7.87,-7.39,;7.87,-5.85,;9.2,-5.08,;6.54,-5.08,;5.2,-5.85,;-1.94,-9.62,;-3.48,-9.62,;-3.96,-8.16,;-5.45,-7.76,;-6.53,-8.85,;-8.02,-8.45,;-8.42,-6.96,;-7.33,-5.87,;-7.73,-4.38,;-5.84,-6.27,)|

BDBM363742

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |wU:3.2,4.4,(-11.04,-4.8,;-10.72,-6.31,;-9.25,-6.78,;-8.93,-8.29,;-7.47,-8.77,;-7.15,-10.27,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-5.18,-6.7,;-3.71,-7.18,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;4,-8.29,;1.39,-7.73,;-2.47,-6.27,;-2.47,-4.73,;-1.13,-3.96,;.2,-4.73,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,)|

BDBM363743

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccnc1OC)c1ncc(C)cn1 |wD:2.1,3.3,(6.47,.66,;6.47,-.88,;7.8,-1.65,;7.8,-3.19,;9.14,-3.96,;6.47,-3.96,;7.24,-5.3,;5.7,-2.63,;5.14,-4.73,;5.14,-6.27,;6.38,-7.18,;5.91,-8.64,;4.37,-8.64,;3.46,-9.89,;4.09,-11.3,;3.18,-12.54,;1.65,-12.38,;1.02,-10.98,;-.51,-10.81,;-1.41,-12.06,;1.93,-9.73,;3.89,-7.18,;2.42,-6.7,;1.28,-7.73,;-.18,-7.26,;-.5,-5.75,;.64,-4.72,;2.1,-5.2,;3.25,-4.17,;2.93,-2.66,;9.14,-.88,;9.14,.66,;10.47,1.43,;11.8,.66,;13.14,1.43,;11.8,-.88,;10.47,-1.65,)|

BDBM363593

COC1CN(C1)[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:7.8,wD:6.6,(4.94,1.77,;3.6,2.54,;3.6,4.08,;2.51,5.17,;3.6,6.26,;4.69,5.17,;3.6,7.8,;2.27,8.57,;2.27,10.11,;.93,7.8,;1.7,6.46,;.16,6.46,;-.4,8.57,;-1.73,7.8,;-1.73,6.26,;-3.2,5.78,;-4.1,7.03,;-5.64,7.03,;-6.41,8.36,;-7.95,8.36,;-8.72,7.03,;-7.95,5.69,;-8.72,4.36,;-10.26,4.36,;-6.41,5.69,;-3.2,8.27,;-3.6,9.76,;-2.51,10.85,;-1.02,10.45,;.07,11.54,;-2.91,12.34,;-4.39,12.74,;-5.48,11.65,;-5.08,10.16,;-6.57,9.76,;-7.34,11.09,;4.94,8.57,;6.27,7.8,;7.6,8.57,;7.6,10.11,;8.94,10.88,;6.27,10.88,;4.94,10.11,)|

BDBM363603

COC1CN(C1)[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:7.8,wD:6.6,(2.19,1.01,;3.52,1.78,;3.52,3.32,;2.43,4.41,;3.5,5.5,;4.61,4.41,;3.5,7.04,;2.17,7.81,;2.17,9.35,;.84,7.04,;1.61,5.71,;.07,5.71,;-.5,7.81,;-1.83,7.04,;-2.31,5.58,;-3.85,5.58,;-4.32,7.04,;-5.86,7.04,;-6.63,8.37,;-8.17,8.37,;-8.94,7.04,;-8.17,5.71,;-8.94,4.37,;-10.48,4.37,;-6.63,5.71,;-3.08,7.95,;-3.08,9.49,;-4.41,10.26,;-5.75,9.49,;-7.08,10.26,;-4.41,11.8,;-3.08,12.57,;-1.74,11.8,;-1.74,10.26,;-.41,9.49,;.92,10.26,;4.84,7.81,;6.17,7.04,;7.5,7.81,;7.5,9.35,;8.84,10.12,;6.17,10.12,;4.84,9.35,)|

BDBM363744

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)C#CC)nnc1-c1cncc(C)c1 |wU:16.17,18.19,(5.33,,;4,-.77,;2.67,,;2.67,1.54,;1.33,2.31,;,1.54,;;-1.33,-.77,;-2.67,,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;-1.38,-2.74,;-2.52,-3.77,;-1.49,-4.91,;-3.55,-2.63,;-3.67,-4.8,;-5.13,-4.32,;-3.35,-6.31,;-1.88,-6.78,;-4.49,-7.34,;-5.63,-8.37,;-6.78,-9.4,;.56,-4.68,;2.1,-4.68,;2.58,-3.22,;4.04,-2.74,;4.36,-1.23,;5.83,-.76,;6.97,-1.79,;6.65,-3.29,;7.8,-4.32,;5.19,-3.77,)|

BDBM363745

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(C)nn2)nnc1-c1cncc(C)c1 |wU:18.19,16.17,(1.53,-3.96,;.2,-4.73,;-1.13,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,;-2.47,-4.73,;-2.47,-6.27,;-3.71,-7.18,;-5.18,-6.7,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-7.47,-8.77,;-7.15,-10.27,;-8.93,-8.29,;-9.25,-6.78,;-10.08,-9.32,;-11.54,-8.84,;-12.69,-9.87,;-12.37,-11.38,;-13.51,-12.41,;-10.9,-11.86,;-9.76,-10.83,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;4,-8.29,;1.39,-7.73,)|

BDBM363629

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(F)cccc1F |r,wU:10.11,8.9,(9.56,1.55,;8.22,2.32,;6.89,1.55,;6.89,.01,;5.56,-.76,;4.22,.01,;4.22,1.55,;5.56,2.32,;2.89,-.76,;2.89,-2.3,;1.56,.01,;1.56,1.55,;.22,-.76,;-.55,-2.1,;.99,-2.1,;-1.11,.01,;-2.45,-.76,;-2.92,-2.23,;-4.46,-2.23,;-4.94,-.76,;-6.48,-.76,;-7.25,.57,;-8.79,.57,;-9.56,-.76,;-8.79,-2.1,;-9.56,-3.43,;-8.79,-4.76,;-7.25,-2.1,;-3.69,.14,;-3.69,1.68,;-5.03,2.45,;-6.36,1.68,;-5.03,3.99,;-3.69,4.76,;-2.36,3.99,;-2.36,2.45,;-1.02,1.68,)|

BDBM363636

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(F)cccc1F |r,wU:10.11,8.9,(9.56,.88,;8.22,1.65,;6.89,.88,;6.89,-.66,;5.56,-1.43,;4.22,-.66,;4.22,.88,;5.56,1.65,;2.89,-1.43,;2.89,-2.97,;1.56,-.66,;1.56,.88,;.22,-1.43,;-.55,-2.76,;.99,-2.76,;-1.11,-.66,;-2.45,-1.43,;-2.92,-2.89,;-4.46,-2.89,;-4.94,-1.43,;-6.48,-1.43,;-7.25,-.1,;-8.79,-.1,;-9.56,-1.43,;-8.79,-2.76,;-9.56,-4.1,;-7.25,-2.76,;-3.69,-.52,;-3.69,1.02,;-5.03,1.79,;-6.36,1.02,;-5.03,3.33,;-3.69,4.1,;-2.36,3.33,;-2.36,1.79,;-1.02,1.02,)|

BDBM363746

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H]2CCCN(C2)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |wU:16.16,(-.9,-11.23,;.01,-9.99,;-.62,-8.58,;-2.15,-8.42,;-2.78,-7.01,;-1.87,-5.76,;-.34,-5.93,;.28,-7.33,;.56,-4.68,;2.1,-4.68,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;2.67,,;1.9,1.33,;3.44,-1.33,;4,.77,;5.33,,;6.67,.77,;6.67,2.31,;5.33,3.08,;4,2.31,;5.33,4.62,;6.67,5.39,;6.67,6.93,;5.33,7.7,;5.33,9.24,;4,6.93,;4,5.39,;.09,-3.22,;-1.38,-2.74,;-1.7,-1.23,;-.55,-.2,;-.87,1.3,;-3.16,-.76,;-4.31,-1.79,;-3.99,-3.29,;-2.52,-3.77,;-2.2,-5.28,;-3.35,-6.31,)|

BDBM67147

Cc1ccc2n(nnc2c1)C1CCN(CC(=O)NCCc2nc3ccccc3[nH]2)CC1

BDBM32033

CCCCn1c(NC(=O)c2ccco2)c(C(=O)OCC)c2nc3ccccc3nc12

BDBM43348

COCc1cc(=O)[nH]c(Nc2nc3ccc(C)cc3o2)n1

BDBM67148

ON1[C@H]2CCCC[C@H]2N(O)C1c1ccc(Cl)cc1Cl

BDBM67149

CC(C)CCn1c(N)c(C(=O)OCC2CCCO2)c2nc3ccccc3nc12

BDBM36947

COC(=O)CS(=O)(=O)c1nnc(o1)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C

BDBM32264

C1CCCN(CC1)c1nc(nc2ccccc12)-c1ccccn1

BDBM67150

CCn1c(=O)cc(NC2=NCC(C)CN2c2cccc(Cl)c2)n(C)c1=O |t:8|

BDBM67151

COc1cccc(c1)N1CC(C)Cn2c1nc1n(C)c(=O)n(CCN3CCOCC3)c(=O)c21

BDBM38921

CCSc1nnc(NC(=O)c2ccccn2)s1

BDBM67152

COC(=O)c1ccc(NCC(=O)c2ccccc2)cc1

BDBM38931

Cc1cc(Nc2ccc(C)cc2)n(n1)-c1nc(C)cc(=O)[nH]1

BDBM52141

CC(NC(=O)COc1ccccc1)C(=O)OCC(=O)c1cc2ccccc2o1

BDBM67153

Fc1ccc(CC(=O)OCC(=O)c2cc3ccccc3o2)cc1

BDBM67154

Cn1c(=O)c(C(=S)NC(=O)C2CC2)c(N)n(Cc2ccccc2)c1=O

BDBM60373

CCSC1(SCC)N=C(N)C2(C#N)C(c3ccc(OC)c(OC)c3OC)C12C#N |t:7|

BDBM42317

CC1CCCCN1C(=O)CSc1nc2cc3OCOc3cc2c(=O)n1Cc1ccc2OCOc2c1

BDBM67155

COc1cccc2sc(Nc3nc(C)c(s3)C(C)=O)nc12

BDBM64943

Cc1cc(C)c2ccc(N)nc2c1O

BDBM38993

CCCCS(=O)(=O)\C=C/C=C\S(=O)(=O)CCCC

BDBM31072

O=S1(=O)C=C(Sc2nnc(o2)-c2ccccc2)c2ccccc12 |t:3|

BDBM34443

CCOC(=O)c1c(NC(=O)c2ccco2)scc1C1COc2ccccc2O1

BDBM59728

CCN(CC)CC(=O)c1ccc(cc1)-c1ccccc1

BDBM31074

COc1cc(NS(=O)(=O)c2ccc(C)cc2)c2ncccc2c1

BDBM67156

CCOc1ccc(CCNC(=O)c2cccnc2N2CCCC2)cc1OCC

BDBM67157

CC1=NC(Nc2nc(C)c3ccccc3n2)=NC(C)(C)C1 |c:17,t:1|

BDBM55339

CN(C)CC(=O)c1ccc(cc1)-c1ccccc1

BDBM40988

CCOCCOC(=O)C1C(c2ccsc2)C2=C(CC(CC2=O)c2cccs2)N=C1C |c:30,t:16|

BDBM37257

CCOC(=O)\C=C\S(=O)(=O)c1ccc(NC(C)=O)cc1

BDBM21629

Cc1ccc(cc1)-c1cc2C(=O)c3ccccc3-c2nn1

BDBM67158

CC1(C)CC(=O)C2=C(C1)OC1=C(C2c2ccc(O)cc2O)C(=O)CC(C)(C)C1 |c:6,11|

BDBM67159

CC(C)OC(=O)CN1C(=O)C(=O)c2ccccc12

BDBM67160

CCOC(=O)C1C(c2cccs2)C2=C(CC(CC2=O)c2cccs2)N=C1C |c:27,t:13|

BDBM41585

CC(C)(C)C(=O)C(=C/c1cccc(c1)[N+]([O-])=O)\n1cncn1

BDBM67161

Clc1ccc(cc1Cl)C(=O)COC(=O)Cn1nnc2ccccc12

BDBM49381

Cc1cccnc1Nc1nc(cs1)-c1ccccn1

BDBM67162

Clc1ccc(cc1Cl)C(=O)COC(=O)c1cccnc1

BDBM67163

Cc1cccc2C(=O)C(=O)N(CCCOc3ccccc3)c12

BDBM67164

Clc1ccccc1-c1ccc(C=NNS(=O)(=O)c2ccccc2)o1

BDBM67165

Clc1ccccc1C1c2ccccc2CCNC1=S

BDBM67166

COc1ccc2O[C@@H](C(=O)C(O)c2c1)c1ccc(OC)c(Br)c1

BDBM67167

COc1ccc2O[C@H](C(=O)C(O)c2c1)c1ccc(OC)c(Br)c1

BDBM41591

COc1ccc(NC(=O)C(Cl)=C(Cl)S(=O)Cc2ccc(C)cc2)cn1 |w:11.11|

BDBM19164

O=C1c2ccccc2-c2nnc(cc12)-c1ccccc1

BDBM41593

COc1ccc(NC(=O)C(Cl)=C(Cl)S(=O)Cc2ccccc2)cn1 |w:11.11|

BDBM33080

CCC(=O)OCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O

BDBM60223

Cc1ccc(cc1)S(=O)(=O)Nc1cccc2cccnc12

BDBM33081

CN(CCO)c1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O

BDBM67168

Oc1cccc2ccc(\C=C\c3cccs3)nc12

BDBM40197

Oc1c(C=Nc2cccc3cccnc23)sc2ccccc12 |w:4.4|

BDBM54798

Cc1[nH]c2ccccc2c1\C=C1/SC(=N)N(C1=O)c1nccs1

BDBM67169

COc1cc(\C=C\c2ccc3cccc(OC)c3n2)c(OC(C)=O)c(c1)[N+]([O-])=O

BDBM67170

CC1CC2=C(CC1C=NNC(N)=S)C(C)(C)CCC2 |w:8.9,c:3|

BDBM67171

Oc1ccc2c(oc(=O)c3ccccc23)c1CN(CC=C)CC=C

BDBM67172

CC1(C)Cc2c(CS1)c(nc1sc3c(NN)ncnc3c21)N1CCOCC1

BDBM67173

CC(C)Cc1nc2oc3c(Cl)ncnc3c2c2CCCc12

BDBM67174

Cc1c(Cl)cccc1NC(=S)NNc1ncc(cc1Cl)C(F)(F)F

BDBM67175

OCC1(CO)COC(=O)C(NNc2cc(Cl)ccc2Cl)=N1 |c:20|

BDBM67176

Clc1ccc(C(=O)COC(=O)c2cccnc2Cl)c(Cl)c1

BDBM67177

COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C3CCCC3)cc2)nc(OC)n1

BDBM67178

Brc1ccc2=NC(=O)C(Nc3ccc(cc3)-c3nnc4CCCCCn34)=c2c1 |c:28,t:4|

BDBM67179

Cc1ccccc1NC(=S)NNc1ncc(cc1Cl)C(F)(F)F

BDBM67180

COc1ccc(NS(=O)(=O)c2cc(ccc2N=[NH+]Cc2c(C)[n-]c3ccccc23)[N+]([O-])=O)cc1 |w:16.16|

BDBM39739

Brc1ccc2=NC(=O)C(NN=CC3=C(N4CCOCC4)C(CC3)=Cc3ccccc3)=c2c1 |w:10.9,23.25,c:12,32,t:4|

BDBM67181

CSCCC(NC(=O)COc1ccccc1)C(=O)OCC(=O)c1cc2ccccc2o1

BDBM67182

CC(C)NC(=S)NN=C1CCCCC1C1CCCCC1 |w:7.6|

BDBM54799

Fc1c(F)c(F)c(c(F)c1F)-c1cc(=O)c2ccccc2o1

BDBM67183

N#C\[#6](=[#6]\[#6]-1=[#6]-2-[#8]-[#6](=[#6]-[#6](=[#6]-2-[#6]-[#6]-[#6]1)-c1ccccc1)-c1ccccc1)C#N |c:4,7,9|

BDBM67184

CC(C)CNC(=S)NNC(=O)CCn1nc(C)c(Br)c1C

BDBM59888

Cc1ccc(cc1)N=Nc1c2[nH]c(C)cc(=O)n2[nH]c1=O |w:8.9|

BDBM67185

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CCC(=O)Nc1ccccc1Cl

BDBM62430

CC(C)C(=O)Nc1cccc(c1)C(=O)OCC(=O)c1ccc(Cl)cc1Cl

BDBM67186

Clc1ccc(C(=O)COC(=O)c2ccc3C(=O)N(C(=O)c3c2)c2cccc3ncccc23)c(Cl)c1

BDBM67187

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CCC(=O)Nc1cccc(Cl)c1Cl

BDBM60226

COc1cccc(c1)C(=O)NN=C(c1ccccc1)c1ccccn1

BDBM67188

OCC1(CO)COC(=O)C(NNc2ccc(Cl)c(Cl)c2)=N1 |c:20|

BDBM60227

Cc1cccc(CSc2cccc3cccnc23)c1

BDBM60228

CC(Oc1ccc(cc1)[N+]([O-])=O)C(=O)NN=C(C)c1ccccn1 |w:15.15|

BDBM33096

OCCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O

BDBM67189

NNc1nc(cc(n1)-c1ccccc1O)-c1ccccc1

BDBM33097

CC(=O)OCCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O

BDBM33098

OCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O

BDBM67190

FC(F)(F)c1cnc(NNC(=O)c2c(Cl)cccc2Cl)c(Cl)c1

BDBM67191

ClCC(=O)NNc1cccc(Cl)n1

BDBM60229

CCCOc1ccc(cc1)C(=O)NNC(=S)NC(=O)CC

BDBM67192

CN1C(=c2sc(=C3C(Nc4ccccc4)=NN(C3=O)c3ccccc3)n(C)c2=O)C(C)(C)c2ccccc12 |w:2.1,6.6,c:15|

BDBM67193

CCCCNC(=S)NNC(=O)CCn1nc(C)c(Br)c1C

BDBM50943

Cc1ccc(C)c2nc3sc(C(=O)N4CCCc5ccccc45)c(N)c3cc12

BDBM67194

Cc1ccc(cc1)C(=O)CNc1ccc(Br)cc1

BDBM67195

Cc1ccc(NCC(=O)c2ccccc2)cc1Cl

BDBM65098

CN(C)CCCNC(=O)c1ccc(cc1)-c1nc(cs1)-c1ccc(Cl)cc1

BDBM67196

FC(F)(F)c1cccc(Sc2nc(nnc2C(F)(F)F)-c2ccccc2)c1

BDBM65102

Cc1nc([nH]c(=O)c1Cc1ccccc1)-n1[nH]c2CCCCc2c1=O

BDBM67197

CCCCN(CCCC)C(=S)NN=Cc1c(C)[nH]n(-c2ccccc2)c1=O |w:12.11|

BDBM67198

Cc1ccc2nc(C)cc(C(=O)OCC(=O)c3ccc(Cl)c(c3)[N+]([O-])=O)c2c1

BDBM67199

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)CNC(=O)Cc1ccccc1

BDBM67200

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)CNS(=O)(=O)c1ccccc1

BDBM67201

COc1ccc(NC2(C(=O)c3ccccc3C2=O)c2ccc(Cl)cc2)cc1

BDBM67202

[O-][N+](=O)c1ccc2C(=O)N(C(=O)c3cccc1c23)c1ccc(Cl)cn1

BDBM56514

COc1ccc(cc1[N+]([O-])=O)C(=O)NC(=S)Nc1cccc(Cl)c1N1CCOCC1

BDBM67203

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)CNC(=O)C(c1ccccc1)c1ccccc1

BDBM67204

CC(=NNC(=S)Nc1cccc(C)c1)c1ccccc1 |w:2.2|

BDBM67205

Clc1ccc(cc1)C(=O)CNc1cccc(Cl)c1

BDBM67206

Brc1ccc(NCC(=O)c2ccccc2)cc1

BDBM67207

Clc1ccc(C(=O)COC(=O)CCC(=O)Nc2cccc3cccnc23)c(Cl)c1

BDBM67208

Fc1ccc2NC(=O)C3(Nc4ccccc4-c4nnc(SCc5ccccc5Cl)nc4O3)c2c1

BDBM67209

FC(F)(F)c1ccc(Cl)c(NC(=O)CCCC(=O)OCC(=O)c2ccc(Cl)cc2Cl)c1

BDBM67210

Cc1ccccc1NCC(=O)c1ccc(Br)cc1

BDBM50169

[O-][N+](=O)c1ccc(=O)[c-](C[NH+]=Nc2ccc(Cl)nn2)c1 |w:10.9|

BDBM67211

Brc1ccc(cc1)C(=O)NN=Cc1ccccn1

BDBM67212

[O-][N+](=O)c1cc(ccc1Cl)C(=O)COC(=O)CNC(=O)Cc1ccccc1

BDBM67213

Cc1ccc(cc1)C(=O)NCC(=O)OCC(=O)c1ccc(C)c(c1)[N+]([O-])=O

BDBM67214

Cc1cc(C(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)c2ccccc2n1

BDBM67215

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CNC(=O)Cc1ccccc1

BDBM67216

COc1ccccc1C(=O)NNC(=S)NC(=O)c1ccco1

BDBM67217

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)CCC(=O)Nc1ccccc1Cl

BDBM67218

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)c1cc2ccccc2oc1=O

BDBM67219

CN(\[NH+]=C\[c-]1cc(ccc1=O)[N+]([O-])=O)c1ccccc1

BDBM67220

Cc1ccc(cc1)C(=O)CNc1ccc(C)c(Cl)c1

BDBM67221

[H]C12CCC([H])(C1)C1C2C(=O)N(C(C)C(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)C1=O |TLB:9:8:6:3.2,THB:29:7:6:3.2|

BDBM67222

[H]C12CCC([H])(C1)C1C2C(=O)N(CC(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)C1=O |TLB:28:7:6:2.3,THB:9:8:6:2.3|

BDBM67223

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CNS(=O)(=O)c1ccccc1

BDBM67224

CC(C)Oc1cccc(c1)C(=O)NC(=S)Nc1cccnc1

BDBM67225

Cc1ccc(cc1)C(=O)CNc1cccc(Cl)c1

BDBM67226

Brc1ccc2[nH]c(=S)n(Cc3ccccn3)c(=O)c2c1

BDBM67227

Cc1ccc(NC(=S)NNC(=O)c2ccc(N3CCOCC3)c(c2)[N+]([O-])=O)cc1Cl

BDBM67228

[O-][N+](=O)c1cc(ccc1N1CCOCC1)C(=O)NNC(=S)Nc1ccc(Cl)cc1Cl

BDBM67229

Clc1ccc2[nH]c(=S)n(Cc3ccccn3)c(=O)c2c1

BDBM67230

CCC[N+](CCC)(CC#Cc1ccccc1)CC(=O)c1ccc(Cl)cc1

BDBM51017

CN1\C(=C\C=C2\SC(=S)N(CC=C)C2=O)C(C)(C)c2ccccc12

BDBM63210

CC(=O)OCCCNc1cc(Sc2ccc(C)cc2)c2nonc2c1[N+]([O-])=O

BDBM67231

CCCSc1cc(NCCOC(=O)CCC)c([N+]([O-])=O)c2nonc12

BDBM60234

CC(=O)C(Sc1cccc2cccnc12)=NNc1ccc(Cl)cc1Cl |w:15.17|

BDBM57567

COc1ccc(CN=Nc2cc(C)nc(n2)-n2nc(C)cc2C)c(OC)c1 |w:8.8|

BDBM67232

CC(C)N1CCc2c(C1)sc(NC(=O)c1cc(nc3ccccc13)-c1cccs1)c2C(N)=O

BDBM32307

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(Cl)c(c3)[N+]([O-])=O)co2)n1

BDBM59989

CC(C)(C)c1cc(CCC(=O)NNC(=S)NC(=O)c2ccccc2)cc(c1O)C(C)(C)C

BDBM67233

CCC1CCCCN1CC(=O)c1ccc(OC(F)F)cc1

BDBM67234

COC(=O)c1[nH]nc(C(O)c2ccc(Cl)cc2)c1-c1ccc(OC)cc1

BDBM67235

COc1ccc(\C=C\C(=O)NC(=S)NNC(=O)c2c(C)onc2-c2ccccc2)cc1

BDBM67236

Cc1cccc(NC(=S)NNc2ncc(cc2Cl)C(F)(F)F)c1

BDBM67237

COc1ccc(cc1)\N=C1\C(=O)N2c3c1cccc3C(C)=CC2(C)C |c:23|

BDBM67238

COc1ccc(cc1)C(=O)NC(=S)Nc1nnn(C)n1

BDBM57652

Cc1ccc(C)c(NC(=S)NN=C2CCCCc3ccccc23)c1 |w:11.10|

BDBM67239

Cc1csc(NC(=S)Nc2cccc(Cl)c2)n1

BDBM67240

S=C(NN=Cc1ccccc1)N1CCOCC1 |w:3.2|

BDBM67241

Cc1cccc(NC(=S)NN=C2CCCCc3ccccc23)c1 |w:10.9|

BDBM67242

COc1cc(cc(OC)c1OC)C(=O)NN=C(c1ccccc1)c1ccccn1

BDBM67243

CCN(CC)c1ccc(cc1)C(=O)NC(=S)Nc1cc(ccc1-n1cncn1)S(=O)(=O)N1CCOCC1

BDBM57711

CN1C(=O)C(=NNc2nc(cs2)-c2ccccc2)c2ccccc12 |w:5.5|

BDBM45262

Clc1ccc(C=NNC(=S)N2CCOCC2)cc1 |w:6.6|

BDBM67244

CCc1cc2c(nc([nH]c2=O)-c2ccccn2)s1

BDBM67245

Cc1nn(CCC(=O)NNC(=S)Nc2ccc(F)cc2)c(C)c1Br

BDBM60241

Clc1ccc(cc1)-c1cc(C(=O)NN=Cc2ccccn2)c2ccccc2n1

BDBM67246

Cc1nn(CCC(=O)NNC(=S)Nc2ccccc2)c(C)c1Br

BDBM67247

Cc1ccc(OCCN2C(=O)c3ccccc3C2=O)c(c1)[N+]([O-])=O

BDBM67248

Cn1cccc1\C=C(\C#N)C(N)=S

BDBM67249

Cc1ccc(C=NNC(=S)N2CCOCC2)cc1 |w:6.6|

BDBM67250

CCOC(=O)c1[nH]nc(C(O)c2ccc(Cl)cc2)c1-c1ccccc1

BDBM67251

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)c1ccncc1

BDBM67252

Cc1ccc(cc1)C(=O)CNc1ccccc1C

BDBM50392

COc1ccc(C=CC(=O)NC(=S)Nc2cc(ccc2O)[N+]([O-])=O)cc1OC |w:6.5|

BDBM67253

Fc1ccc(CSc2nnc(NC(=O)c3cnccn3)s2)cc1

BDBM67254

CCN1C(=O)C(N(C)C1=S)=c1sc(=C2Sc3cc(OC)ccc3N2C)c(=O)n1CC=C

BDBM64647

CCC(C)c1ccc(O)c(NC(=S)NC(=O)c2cccnc2)c1

BDBM67255

COc1cc(\C=C2/SC(=S)N(N3CCOCC3)C2=O)ccc1O

BDBM67256

Fc1ccc(NCC(=O)c2ccccc2)cc1

BDBM61076

Cc1ccc(NS(=O)(=O)c2cc(ccc2N=NCc2sc(nc2-c2ccccc2)N2CCOCC2)[N+]([O-])=O)c(C)c1 |w:15.15|

BDBM67257

CC(C)(C)c1cc(Cl)c(O)c(NC(=S)NC(=O)c2cccnc2)c1

BDBM67258

COc1ccc(C(=O)\C=C\C(=O)N(CC2CCCO2)CC(=O)NC2CCCCC2)c(O)c1

BDBM67259

CN(C)c1ccc(\C=C2/[NH+]=C([N-]C2=O)c2ccc(Cl)c(c2)[N+]([O-])=O)cc1 |c:9|

BDBM67260

Fc1ccc(NC(=S)Nc2ccc(Cl)cc2Cl)cc1

BDBM65328

CC(C)(C)C(=O)NC(=S)NNC(=O)c1ccc(cc1)-c1ccccc1

BDBM55728

Cc1ccc2oc(Nc3nc(cc(=O)[nH]3)-c3ccccc3)nc2c1

BDBM67261

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)c1cnccn1

BDBM67262

NC(=S)NNC(=S)Nc1ccccc1

BDBM45612

CC(C)c1ccc(O)c(NC(=S)NC(=O)c2cccnc2)c1

BDBM67263

Nc1c(N2CCCC2)c2ccccc2oc1=O

BDBM48833

COc1cc(\C=C2/SC(=O)N(C2=O)c2cccc(Cl)c2)cc(c1O)[N+]([O-])=O

BDBM67264

COC(=O)CSc1[nH]c2ccc(Br)cc2c1[N+]([O-])=O

BDBM67265

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CNC(=O)CN1C(=O)c2ccccc2C1=O

BDBM54814

Cc1c(Nc2cc(Cl)c3nonc3c2[N+]([O-])=O)c(=O)n(-c2ccccc2)n1C

BDBM67266

CCn1c2ccccc2c(Cl)c([N+]([O-])=O)c1=O

BDBM55762

Cc1ccccc1NC(=O)CCC(=O)OCC(=O)c1cccc(c1)[N+]([O-])=O

BDBM67267

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CNC(=O)c1ccc(Br)o1

BDBM67268

CC(=O)Nc1ccc(NC(=O)CCC(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)cc1

BDBM67269

CC(=O)Nc1ccc(NC(=O)CCC(=O)OCC(=O)c2ccc(C)c(c2)[N+]([O-])=O)cc1

BDBM67270

NNc1nc(cc(n1)-c1ccccc1)-c1ccccc1

BDBM67271

Clc1ccc(cc1Cl)C(=O)COC(=O)c1ccncc1

BDBM49862

Fc1ccc(NC(=S)Nc2nccs2)cc1

BDBM67272

Clc1ccc(cc1)C(=O)C[N+]1(CC#Cc2ccccc2)CCOCC1

BDBM57870

CCN1\C(Sc2ccc3sccc3c12)=C\c1ccc2cc(C)ccc2[n+]1CC

BDBM60249

[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)N\N=C\c1ccccn1

BDBM60251

[O-][N+](=O)c1cccc(c1)C(=O)N\N=C\c1ccccn1

BDBM67273

CCN1CCN(CC1)c1ncnc2n(cc(-c3ccccc3)c12)-c1ccc(F)cc1

BDBM52656

CC(=O)[C-]1Sc2nn[c-](C)[n+]2[N+](C(C)=O)=C1c1cccc(c1)[N+]([O-])=O |c:15|

BDBM67274

CC1(C)CC2(CC(c3ccccc3F)c3cc(Cl)c(O)cc3O2)NC(=S)N1

BDBM52665

CC(=O)N1C(=C(Sc2nnc(C)n12)C(C)=O)c1ccccc1 |c:4|

BDBM67275

Cc1ccc(cc1C)N=Nc1ccc(O)c2ncccc12 |w:8.8|

BDBM54335

Cc1ccc(C)c(c1)N=Nc1ccc(O)c2ncccc12 |w:8.8|

BDBM34922

OCc1cccc(c1)\[NH+]=C1/C(=O)[N-]c2ccc(cc12)[N+]([O-])=O

BDBM43463

COc1ccc(CS(=O)C(Cl)=C(Cl)C(=O)Nc2ccc(OC)nc2)cc1 |w:9.9|

BDBM67276

[H]C12CC([H])(C(Br)C1Br)C1C2C(=O)N(CC(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)C1=O |TLB:6:5:10.9:2,30:9:2:7.5,THB:8:7:10.9:2,11:10:2:7.5|

BDBM43465

COc1ccc(NC(=O)C(Cl)=C(Cl)S(=O)Cc2ccc(Cl)cc2)cn1 |w:11.11|

BDBM61540

CNC(=O)c1nnsc1S(=O)(=O)c1ccc(Cl)cc1

BDBM67277

[O-][N+](=O)c1cccc([CH+][N-]NS(=O)(=O)c2ccccc2)c1

BDBM61541

COc1ccc(NC(=O)C(Cl)=C(Cl)S(=O)Cc2ccccc2Cl)cn1 |w:11.11|

BDBM21618

COc1ccc(cc1)-c1cc2C(=O)c3ccccc3-c2nn1

BDBM67278

CCCCCC1CCC(CC1)c1n[nH]c(=S)n1C |(3.08,-7.2,;3.08,-5.66,;4.41,-4.89,;4.41,-3.35,;5.75,-2.58,;5.75,-1.04,;7.08,-.27,;7.08,1.27,;5.75,2.04,;4.41,1.27,;4.41,-.27,;5.75,3.58,;4.5,4.49,;4.98,5.95,;6.52,5.95,;7.42,7.2,;6.99,4.49,;8.46,4.01,)|

BDBM54819

CC(C)(C)c1ccc(cc1)-n1nc(C#N)c(Cl)cc1=O

BDBM67279

CN(C)CCN(Cc1ccco1)C(=O)c1cc2c(Cl)nc3ccccc3c2s1

BDBM66061

N=C1S\C(=C/c2ccco2)C(=O)N1c1nccs1

BDBM57944

Fc1ccc2nc(NC(=O)c3ccccn3)sc2c1

BDBM67280

COc1ccc(cc1)C(=O)CNc1ccccc1CO

BDBM47677

[O-][N+](=O)c1cccc(c1)C(=O)N[N-][C+](c1ccccc1)c1ccccn1

BDBM67281

FC(F)(F)c1cnc(NNC(=S)Nc2cccnc2)c(Cl)c1

BDBM67282

[O-][N+](=O)c1ccc(Cl)cc1C(=O)Nc1nc(cs1)-c1ccccn1

BDBM67283

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CCc1ccccc1

BDBM52732

CCOC(=O)C1=C2NC(=O)c3ccccc3N2C(=O)C1 |c:5|

BDBM67284

Fc1ccc(NC(=S)NNc2ncc(cc2Cl)C(F)(F)F)c(F)c1

BDBM67285

[H]C12CCC(C)(C(C1)=NNC(=S)Nc1cccc(OC)c1)C2(C)C |w:8.9,TLB:8:6:21:3.2|

BDBM67286

CC1CCCN(CC(=O)c2ccc(Cl)c(Cl)c2)C1

BDBM67287

CCN(CC)c1nc(C)c(s1)C(=S)Nc1cc(ccc1Cl)[N+]([O-])=O

BDBM67288

CC(=NNC(=O)COc1ccccc1-c1ccccc1)c1ccccn1 |w:2.2|

BDBM60259

Fc1cc(F)c2nc(NC(=O)c3ccccn3)sc2c1

BDBM67289

CNS(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1cc2ccccc2o1

BDBM67290

[O-][N+](=O)c1cccc(c1)C(=O)C[n+]1ccc(cc1)-c1cc(C(=O)Nc2cccc(c2)C(F)(F)F)c2ccccc2n1

BDBM64703

Oc1c(ccc2cccnc12)C(N1CCCC1)c1ccccc1Cl

BDBM54365

Cc1cc(C)n(n1)-c1nc(C)cc(N=NCc2ccccc2[N+]([O-])=O)n1 |w:13.13|

BDBM60262

[H]C12CC3([H])CC([H])(C1)CC(C2)(C3)C(=O)NNC(=O)c1ccccn1 |TLB:8:6:12:1.11.2,8:1:12:6.9.5,THB:2:1:9:3.12.5|

BDBM54371

Oc1ccccc1C(=O)NN=Cc1cccc2cccnc12

BDBM67291

Cc1ccc(cc1)S(=O)(=O)NN=Cc1ccc2nccnc2c1

BDBM67292

[O-][N+](=O)c1cc(ccc1Cl)C(=O)COC(=O)c1cnccn1

BDBM67293

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)c1cnccn1

BDBM67294

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)CNC(=O)c1ccc(Br)o1

BDBM60263

O=C(NN=Cc1ccccn1)c1cc(nc2ccccc12)-c1ccccc1

BDBM60264

Brc1ccc(cc1)-c1cc(C(=O)NN=Cc2ccccn2)c2ccccc2n1

BDBM60265

Clc1c(sc2ccccc12)C(=O)NN=Cc1ccccn1

BDBM67295

Brc1ccc(cc1)\N=N\c1ccc2ccccc2n1

BDBM62230

[O-][N+](=O)c1cnc(Sc2ccncn2)s1

BDBM67296

[O-][N+](=O)c1cccc(c1)C(=O)COC(=O)CCC(=O)NC1CCCCC1

BDBM67297

CC(C)c1nc(C#N)c(NN)o1

BDBM67298

Oc1ccc(cc1\C=C1\SC(NS(=O)(=O)Cc2ccccc2)=NC1=O)[N+]([O-])=O |c:23|

BDBM54825

CCn1c(Cl)c(C=O)sc1=NS(=O)(=O)c1ccccc1

BDBM43482

C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](OC(C)=O)[C@@]2(C)[C@H]1C=CC2=O |c:20|

BDBM54827

C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](OC(=O)CC(=O)O[C@H]2[C@H]3[C@@H](C[C@@H](C)[C@@H]4C=CC(=O)[C@@]24C)OC(=O)C3=C)[C@@]2(C)[C@H]1C=CC2=O |c:26,44|

BDBM43484

C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@@]2(C)[C@H]1C=CC2=O |c:17|

BDBM67299

[O-][N+](=O)c1c(Nc2ccccn2)cc(Cl)c2nonc12

BDBM67300

Cc1nnsc1C(=O)NNc1ccc(cc1)C(C)(C)C

BDBM58188

Cc1ccc(NNC(=O)c2cc(nn2Cc2ccccc2)C(C)(C)C)cc1

BDBM67301

Cc1cc(no1)C(=O)NNc1ccc(C)c(C)c1

BDBM67302

CCc1ccc(cc1)C(=O)NNc1ccc(C)c(Cl)c1

BDBM67303

Clc1ccsc1C(=O)NNc1ccc(Cl)cc1

BDBM67304

Cc1noc(C)c1C(=O)NNc1ccc(C)c(Cl)c1

BDBM67305

CC(C)c1ccc(NNC(=O)c2c(C)noc2C)cc1

BDBM67306

CCc1ccc(cc1)C(=O)NNc1ccc(Cl)cc1

BDBM67307

OC(=O)c1ccccc1NCC(=O)c1ccccc1

BDBM67308

Cc1ccc(cc1)C(C[N+]([O-])=O)Sc1ccc(N)cc1

BDBM67309

Clc1ccc(NC(=S)NNC(=O)CN2c3ccccc3Sc3ccccc23)cc1

BDBM67310

Clc1cc(Cl)cc(c1)C(=O)NNc1ccc(cc1)-c1csnn1

BDBM44170

CNc1ccc2oc(C[C@H]3O[C@@]4(CC[C@H]3C)O[C@H]([C@H](C)C(=O)c3ccc[nH]3)[C@H](C)C[C@H]4C)nc2c1C(O)=O

BDBM66072

CC(=NNC(=O)c1ccc(cc1)C(C)(C)C)c1ccccn1 |w:2.2|

BDBM67311

CCNC(=S)NNc1nnc(-c2ccccc2)c(n1)-c1ccccc1

BDBM67312

COc1ccc(cc1OC)-c1cc(nc(NN)n1)-c1ccccc1

BDBM67313

Cc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)\C=C\c1ccncc1

BDBM67314

Clc1cccc(NCC(=O)c2ccc(Br)cc2)c1

BDBM67315

NNc1nc(cc(n1)-c1ccc(Br)cc1)-c1ccccc1

BDBM67316

Cc1ccc(cc1)-c1cc(nc(NN)n1)-c1ccccc1

BDBM67317

OC(=O)c1cccc(NC(=S)NC(=O)c2cncc(Br)c2)c1

BDBM66694

CS(=O)(=O)c1ncc(Cl)c(n1)C(=O)Nc1ccc(OC(F)F)cc1

BDBM67318

Cc1cccc2=C(Nc3ccc(Cl)cc3)C(=O)N=c12 |c:5,t:18|

BDBM67319

CSc1cccc(NC2=c3ccccc3=NC2=O)c1 |c:8,15|

BDBM67320

COc1ccc(NC2=c3c(Br)c(C)ccc3=NC2=O)cc1 |c:7,16|

BDBM60275

CC(=NNC(=O)c1ccc(Cl)cc1)c1ccccn1 |w:2.2|

BDBM64720

Cc1cc(O)ccc1NC(=S)NC(=O)c1cncc(Br)c1

BDBM67321

Cc1ccc(cc1)C(=O)CNc1cc(C)ccc1C

BDBM67322

CC1(C)Oc2ccc3ccc(=O)oc3c2C(=CNNC(N)=O)C1=O |w:16.18|

BDBM67323

Cc1cccc(NC2=c3cccc(Cl)c3=NC2=O)c1 |c:7,15|

BDBM67324

Cc1ccc(NC2=c3cccc(C)c3=NC2=O)cc1 |c:6,14|

BDBM67325

Brc1ccc(NC2=c3ccccc3=NC2=O)cc1 |c:6,13|

BDBM67326

COc1cc(\C=C\[N+]([O-])=O)ccc1OC(=O)c1cc2ccccc2oc1=O

BDBM67327

Cc1ccc(C)c(NCC(=O)c2ccc(Cl)cc2)c1

BDBM66727

COc1cc(\C=C\[N+]([O-])=O)ccc1OC(=O)c1cccnc1

BDBM67328

CC(=O)c1ccc(NC2=c3ccccc3=NC2=O)cc1 |c:8,15|

BDBM67329

CC1=[NH+]N(C(=O)\C1=C/c1ccc(o1)-[c-]1cc(ccc1=O)[N+]([O-])=O)c1ccc(C)cc1 |t:1|

BDBM66074

Cc1ccc(cc1)C(=O)Sc1cccccc1=O

BDBM67330

COc1cccc(c1)N1CC(C)Cn2c1nc1n(C)c(=O)[nH]c(=O)c21

BDBM67331

CCCN(CCC)c1nc(nc2ccccc12)-c1ccccn1

BDBM58380

Clc1ccc(SCc2cc(=O)[nH]c(n2)-c2ccccn2)cc1

BDBM58385

COc1cc(\C=C\c2ccc3cccc(O)c3n2)cc(OC)c1OC

BDBM67332

Oc1cccc2ccc(\C=C\c3ccccc3Cl)nc12

BDBM50271181

COc1cccc(\C=C\c2ccc3cccc(O)c3n2)c1

BDBM67333

CN(C)c1ccc2nc3c(nc(=O)[nH]c3=O)n(CC(O)C(O)C(O)CO)c2c1

BDBM67334

COc1cccc(c1)\[NH+]=C1/[N-]C(=O)\C(S1)=C\c1cc(ccc1O)[N+]([O-])=O

BDBM67335

Cc1[nH]n(C(N)=S)c(=O)c1N=Nc1ccc(cc1)[N+]([O-])=O |w:10.10|

BDBM64104

[O-][N+](=O)c1ccc(nc1)S(=O)(=O)c1ccccc1

BDBM54432

COc1cccc(\C=C\c2ccc3cccc(O)c3n2)c1OC

BDBM67336

CCOc1ccc(NC2=c3c(Br)c(C)ccc3=NC2=O)cc1 |c:8,17|

BDBM67337

CC(=NNC(=O)c1ccc(F)cc1)c1ccccn1 |w:2.2|

BDBM60277

CC(=NNC(=O)c1ccccc1Cl)c1ccccn1 |w:2.2|

BDBM67338

CC(=O)Oc1ccc(\C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc1

BDBM67339

CCN1C(=S)S\C(=C\c2cccc(OC)c2Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)C1=O

BDBM67340

CCOc1cccc(\C=C\c2ccc3cccc(O)c3n2)c1OC

BDBM58440

CCn1nc(C)cc1-c1nnc(Sc2ncc(s2)[N+]([O-])=O)n1C

BDBM67341

NC(=O)c1ccccc1NCC(=O)c1ccc(F)cc1

BDBM50171923

OC(C(=O)c1ccco1)c1ccco1

BDBM67342

Fc1ccc(NC2=c3ccccc3=NC2=O)cc1 |c:6,13|

BDBM66793

Cc1ccc(NC2=c3ccccc3=NC2=O)cc1 |c:6,13|

BDBM67343

Cc1cccc(C=NNC(=O)c2cccc(Cl)c2)n1

BDBM67344

COc1ccccc1NCC(=O)c1ccc(Cl)cc1

BDBM60279

Brc1ccccc1C(=O)Sc1cccc2cccnc12

BDBM64173

O=C(C#Cc1ccccc1)c1ccco1

BDBM67345

Cc1ccc(cc1)C(=O)CNc1ccccc1

BDBM51918

CCOC(=O)c1c(NC(=O)CNCCN(C)C)scc1-c1ccc(cc1)-c1ccccc1

BDBM67346

Brc1ccc(s1)C(=O)CNc1ccc(Br)cc1

BDBM67347

COc1ccc(cc1)C(=O)CNc1cccc(F)c1

BDBM67348

Cc1[n-]n(C(N)=S)c(=O)c1N=[NH+]c1ccc(cc1Cl)[N+]([O-])=O |w:11.12|

BDBM48020

[O-][N+](=O)c1ccc(cc1)\[NH+]=N\c1ncc[n-]1

BDBM67349

Cc1ccc(NC2=c3cc(Br)ccc3=NC2=O)cc1 |c:6,14|

BDBM67350

NC(=O)c1ccccc1NCC(=O)c1ccc(Cl)cc1

BDBM67351

Cc1ncc(C=O)c(CNNc2ccc(cn2)C(F)(F)F)c1O

BDBM67352

Fc1ccc(NC(=O)Nc2nc(cs2)-c2ccccn2)c(F)c1

BDBM50242271

C1[C@@H]([C@H]([C@@H]([C@H]([N@@]1CCO)CO)O)O)O

BDBM67353

[H]C12CC([H])(C=C1)C1C2C(=O)N(CC(=O)OCC(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)C1=O |c:5,TLB:29:7:2:6.5,THB:9:8:2:6.5|

BDBM67354

CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2nc(ncc2Cl)S(C)(=O)=O)cc1

BDBM59071

CCS(=O)(=O)c1ncc(Cl)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(C)CC1

BDBM59072

CCS(=O)(=O)c1ncc(Cl)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C)C1

BDBM54838

CCS(=O)(=O)c1ncc(Cl)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)N(C)c1ccccc1

BDBM67355

Fc1ccc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2)cc1

BDBM58565

Cc1ccc2cccc(NS(=O)(=O)c3ccccc3)c2n1

BDBM58569

Cc1ccc(c(c1)[N+]([O-])=O)S(=O)(=O)Nc1cccc2cccnc12

BDBM67356

OC(=O)c1ccccc1N[NH+]=C1C(=O)[N-]c2ccc(cc12)[N+]([O-])=O |w:10.10|

BDBM67357

[H]C12CC([H])(C(Br)C1Br)C1C2C(=O)N(CCC(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)C1=O |TLB:8:7:9.10:2,11:10:2:5.7,THB:6:5:9.10:2,31:9:2:5.7|

BDBM50227494

O=S(=O)(Nc1cccc2cccnc12)c1ccccc1

BDBM58588

COc1ccc(NS(=O)(=O)c2ccc3ccccc3c2)c2ncccc12

BDBM54849

CCC1CCCCN1S(=O)(=O)c1ccc(NC(=O)c2nc(ncc2Cl)S(C)(=O)=O)cc1

BDBM67358

[H]C12CC([H])(C=C1)C1C2C(=O)N(C(C)C(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)C1=O |c:5,TLB:29:7:2:5.6,THB:9:8:2:5.6|

BDBM67359

COc1ccc(OC)c(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2)c1

BDBM67360

CC(=O)c1ccc(NC(=O)CCC(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)cc1

BDBM58626

Cc1ccc(CS(=O)(=O)c2ncc(Cl)c(n2)C(=O)Nc2ccc(OC(F)F)cc2)cc1

BDBM67361

COc1ccccc1C(=O)NNC(=S)NC(=O)c1cccs1

BDBM67362

[O-][N+](=O)c1cc(ccc1Cl)C(=O)COC(=O)CN1C(=O)C2CC=CCC2C1=O |c:23|

BDBM67363

COc1ccccc1NC(=O)CCC(=O)OCC(=O)c1ccc(C)c(c1)[N+]([O-])=O

BDBM67364

[O-][N+](=O)c1cc(ccc1Cl)C(=O)COC(=O)CNC(=O)CNC(=O)c1ccco1

BDBM67365

O=C(COC(=O)c1ccco1)c1ccc(cc1)S(=O)(=O)N1CCCCC1

BDBM67366

Cc1ccc(OCC(=O)OCC(=O)c2cccc(c2)[N+]([O-])=O)cc1C

BDBM67367

Cn1nnc(NC(=S)NC(=O)c2cccc3ccccc23)n1

BDBM67368

Cc1ccc(cc1)-c1c(nnn1-c1nonc1N)C(=O)NN=Cc1cccc(Cl)c1

BDBM67369

Cn1nnc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)n1

BDBM60285

CCCOc1cccc(c1)-c1cc(C(=O)NN=Cc2ccccn2)c2ccccc2n1

BDBM67370

COc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NNc1nc(C)cc(C)n1

BDBM58705

Fc1cccc(c1)C(=O)NN=C(c1ccccc1)c1cccnc1

BDBM58709

Clc1ccc(cc1Cl)C(=O)NN=Cc1ccccn1

BDBM54529

Clc1ccc(cc1)C(=O)NN=Cc1ccccn1

BDBM60286

CC(=NNC(=O)c1cccc(Br)c1)c1ccccn1 |w:2.2|

BDBM67371

[O-][N+](=O)c1ccc(=O)[c-](\C=[NH+]\NC(=O)CCCC(=O)Nc2cccc(Br)c2)c1

BDBM54534

CC(=NNC(=O)c1ccccc1F)c1ccccn1 |w:2.2|

BDBM67372

Cc1ccc(cc1[N+]([O-])=O)C(=O)COC(=O)CN1C(=O)C2CC=CCC2C1=O |c:23|

BDBM67373

CC(=NNC(=O)c1cccc2ccccc12)c1ccccn1 |w:2.2|

BDBM67374

Clc1ccccc1C(=O)NN=C(c1ccccc1)c1ccccn1

BDBM67375

CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCCc2ccccc12)c1nc2cc(C)cc(C)c2s1

BDBM60965

Cc1ccc(SSc2cc(C)ccc2N)c(N)c1

BDBM67376

COc1ccc(cc1Br)S(=O)(=O)NNc1nc(C)cc(C)n1

BDBM67377

CNS(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

BDBM67378

CCN(CC)S(=O)(=O)c1ccc2oc(SCC(=O)Nc3cc(C)on3)nc2c1

BDBM67379

Cc1cc(C)nc(NNS(=O)(=O)c2ccc(F)c(Cl)c2)n1

BDBM67380

CC(=O)Nc1cccc(c1)C(=O)OCC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

BDBM50058655

CCN(CC)C(=S)SSC(=S)N(CC)CC

BDBM67381

O=C(COc1ccccc1)OCC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

BDBM67382

CC(=NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccccn1 |w:2.2|

BDBM67383

Brc1ccc(o1)C(=O)OCC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

BDBM67384

COc1ccc(CC(=O)OCC(=O)c2ccc(cc2)S(=O)(=O)N2CCCCC2)cc1

BDBM67385

CCC1Nc2ncnc(N3CCCCC3)c2N(Cc2ccc(Cl)cc2)C1=O

BDBM67386

COC(=O)C1=C(C)N(Cc2ccccc2)C(N[C@H]1c1cccc(F)c1)=NCC(C)C |w:25.28,c:4|

BDBM67387

Clc1ccc(C(=O)COC(=O)c2ccccn2)c(Cl)c1

BDBM67388

Cc1cc(C)nc(NNS(=O)(=O)c2c(F)cc(F)cc2Br)n1

BDBM67389

Cn1c(N)c(C(=O)COC(=O)c2ccccc2C(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)c(=O)n(C)c1=O

BDBM67390

OCCN(Cc1ccccc1)C(=O)C[C@H]1C\C=C\CC[C@H](Cc2ccc(F)cc2)C(=O)O[C@H](CNC1=O)c1ccccc1 |t:17|

BDBM67391

Cc1ccc2N(C(=O)C(=O)c2c1)c1ccc(Cl)cc1

BDBM67392

COc1ccc(NC(=O)Nc2cccc3c2O[C@@H](CN(C)CC2CCCCC2)[C@@H](C)CN([C@H](C)CO)C3=O)cc1

BDBM67393

Cc1cc(C)nc(NNS(=O)(=O)c2ccc(Cl)cc2)n1

BDBM67394

O=C(NN=C(c1ccccc1)c1ccccn1)c1ccccc1

BDBM67395

COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)c1ccc(C)c(c1)[N+]([O-])=O

BDBM67396

CCC[C@@H](CN1CCC[C@H]1CN1[C@H](CC(C)C)CN=C1N)N1C[C@@H](Cc2ccccc2)N(CCc2ccc(Cl)c(Cl)c2)C1=N |c:19|

BDBM67397

Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45C(Oc1c24)C(=O)C(C[C@@]35O)=Cc1ccccc1 |w:25.31|

BDBM76097

CCc1nnc(NC(=O)CSc2nc3cccnc3n2C2CCCCC2)s1

BDBM76098

CCOc1ccc2[nH]c(=O)c(CN(Cc3ccco3)C(CC)c3nnnn3Cc3ccccc3)cc2c1

BDBM76099

COc1ccc2[nH]c(=O)c(cc2c1)C(N1CCc2ccccc2C1)c1nnnn1CC1CCCO1

BDBM76100

CCOc1ccc2[nH]c(=O)c(CN(CCO)C(C(C)C)c3nnnn3C3CCCCC3)cc2c1

BDBM76101

CCC(N(CC1CCCO1)Cc1cc2cc(OC)ccc2[nH]c1=O)c1nnnn1Cc1ccccc1

BDBM76102

CCC(N(Cc1ccc(C)cc1)Cc1cc2cc(OC)ccc2[nH]c1=O)c1nnnn1CCOC

BDBM38416

Cc1cc(C)n2nc3nc(nc(-c4ccco4)c3c2n1)N1CCCCC1

BDBM76103

CCC(C)NC(=O)CSC1=Nc2ccccc2C2=NC(CC(=O)NCc3ccccc3)C(=O)N12 |t:9,18|

BDBM76104

CCOc1cc2[nH]c(=S)n(CC3CCCN3CC)c(=O)c2cc1OCC

BDBM76105

CCC(C)NC(=O)CSC1=Nc2ccccc2C2=NC(CC(=O)NCc3ccc(F)cc3)C(=O)N12 |t:9,18|

BDBM76106

COC(=O)C1C(NC(=O)N=C1Cn1cnc2ccccc12)c1cc(C)ccc1C |c:9|

BDBM76107

CCCSc1nc(O)c(CC)c(=O)n1C(C)CC

BDBM39035

CCOC(=O)C1C(NC(=O)N=C1Cn1cnc2ccccc12)c1cc(C)ccc1C |c:10|

BDBM76108

COc1ccccc1-n1c(SC)nc(O)cc1=O |(3.08,-2.31,;4.41,-1.54,;5.75,-2.31,;5.75,-3.85,;7.08,-4.62,;8.41,-3.85,;8.41,-2.31,;7.08,-1.54,;7.08,,;8.41,.77,;9.75,,;11.08,.77,;8.41,2.31,;7.08,3.08,;7.08,4.62,;5.75,2.31,;5.75,.77,;4.41,,)|

BDBM76109

CCCc1cc(no1)C(=O)Nc1sc2CCCCc2c1C(=O)OCC

BDBM76110

CCSc1nc(O)c(CC)c(=O)n1C(C)CC

BDBM76111

CCC(C)n1c(SCC=C)nc(O)c(CC)c1=O

BDBM76112

CCCCCCC1=Cc2c\c(=C3\NN=C(O3)c3cc(OC)c(OC)c(OC)c3)c(=O)oc2=CC1=O |c:13,34,t:6|

BDBM76113

COc1ccc2[nH]c(=O)c(CN(Cc3ccco3)C(C(C)C)c3nnnn3Cc3ccccc3)cc2c1

BDBM51796

CCN1\C(SC(=C1c1ccccc1)c1ccccc1)=C\C=C1/SC(=S)N(C)C1=O |c:5|

BDBM76114

CCOc1cc2[nH]c(=S)n(CCC(=O)N3CCc4ccccc4C3)c(=O)c2cc1OCC

BDBM76115

CCOc1cc2[nH]c(=S)n(CCN3CCC(C)CC3)c(=O)c2cc1OCC

BDBM76116

CCOc1cc2[nH]c(=S)n(CCN3CCCCC3CC)c(=O)c2cc1OCC

BDBM76117

NC(=NOS(=O)(=O)c1ccc2ccccc2c1)c1ccncc1 |w:2.2|

BDBM50895

CC1=NOC(=O)\C1=C/c1ccc(o1)-c1cc(Cl)ccc1Cl |t:1|

BDBM8551

Clc1ccccc1CSc1nnc(o1)-c1ccncc1

BDBM76118

[O-][N+](=O)c1ccc(COc2ccc3c4CCCCc4c(=O)oc3c2)cc1

BDBM76119

COc1cc2c(cc1NC(=O)c1cc(nc3ccc(C)cc13)-c1ccncc1)oc1ccccc21

BDBM76120

COc1cc2c(cc1NC(=O)c1cc(nc3ccc(C)cc13)-c1cccnc1)oc1ccccc21

BDBM70670

Cc1ccc2nc([nH]c2c1)C(=Cc1ccc(o1)[N+]([O-])=O)C#N |w:11.13|

BDBM76121

COc1cc2c(cc1NC(=O)c1cccc(c1)[N+]([O-])=O)oc1ccccc21

BDBM43203

Cc1ccc(C=NNC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2-c2ccccc2)o1 |w:6.6|

BDBM76122

Cc1ccc(C=NNC(=O)CSc2nnc(-c3ccccc3)n2-c2ccc(Cl)cc2)o1

BDBM57596

Cc1cc(C)c2nc(NNC(=O)c3ccc(cc3)S(=O)(=O)N3CCc4ccccc4C3)sc2c1

BDBM57597

Cc1ccc2nc(NNC(=O)c3ccc(cc3)S(=O)(=O)N3CCc4ccccc4C3)sc2c1

BDBM76123

Cc1cc(C)c2sc(NNC(=O)c3ccc(cc3)S(=O)(=O)N3CCc4ccccc4C3)nc2c1

BDBM76124

CC(C)C(=O)N1CCN(CC1)c1ccc(NC(=O)COc2ccccc2[N+]([O-])=O)cc1

BDBM45657

CC1CCN(CC1)S(=O)(=O)c1ccc2nc(cc(C(=O)NCCN(C)Cc3ccccc3)c2c1)-c1ccccn1

BDBM46978

CC(=C)c1cc(NOS(=O)(=O)c2ccccc2)c(C)cc1O

BDBM76125

CCCCC1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:24,t:4,6|

BDBM76126

CCCCC1=CC2=CC(=O)C(C)(OC(=O)CC)C(=O)C2=CN1c1ccccc1 |c:20,t:4,6|

BDBM76127

COC(=O)CCCC1=CC2=CC(=O)C(C)(OC(=O)c3cccs3)C(=O)C2=CN1C1CCCCC1 |c:27,t:7,9|

BDBM76128

COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)c3cnc4ccccc4n3)C(=O)C2=CN1c1ccccc1 |c:31,t:5,7|

BDBM76129

CCCCC1=CC2=CC(=O)C(C)(OC(=O)CC)C(=O)C2=CN1C1CCCCC1 |c:20,t:4,6|

BDBM76130

CC1(OC(=O)C2CCCC2)C(=O)C=C2C=C(N(C=C2C1=O)C1CCCC1)c1ccsc1 |c:15,18,t:13|

BDBM63893

Cn1ncc2c(ON=C(N)c3ccc(cc3)C(C)(C)C)ncnc12 |w:7.6|

BDBM50061921

Cc1ccc(cc1)S(=O)(=O)Nc1nc(cs1)-c1ccccc1

BDBM76131

Clc1cccc(CN2CCc3c(C2)[nH]c2ccccc32)c1

BDBM76132

COc1ccc(CN=Nc2cc(C)nc3ccc(C)cc23)c(OC)c1 |w:8.8|

BDBM76133

COc1ccc(CN=Nc2cc(C)nc3ccc(OC)cc23)c(OC)c1 |w:8.8|

BDBM76134

CCOc1cc2[nH]c(=S)n(CCCC(=O)NCc3ccccn3)c(=O)c2cc1OCC

BDBM76135

CCN(CC)CCNC(=O)c1cc(nc2ccc(cc12)S(=O)(=O)N1CCC(C)CC1)-c1cccnc1

BDBM76136

CSc1cccc(NC(=S)NC(=O)CCc2ccccc2)c1

BDBM76137

COc1cc(NC(=S)NC(=O)CCc2ccccc2)cc(OC)c1

BDBM76138

O=C(Cn1ncc2c3ccccc3[nH]c2c1=O)Nc1ccc(CN2CCCCC2)cc1

BDBM76139

CC1CCN(CC1)S(=O)(=O)c1ccc2nc(ccc2c1)N1CCN(CC1)c1ccccc1

BDBM76140

COc1cccc2sc3ccc(NCCC4CCCN4C)cc3c(=O)c12

BDBM76141

CCN(CC)CCNC(=O)c1ccc(NC(=O)c2cc(nc3ccccc23)-c2ccco2)cc1

BDBM76142

CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2cc(C)cc(C)c2s1

BDBM76143

COc1cccc2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM76144

CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2c(F)cccc2s1

BDBM76145

CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(=O)N(CCCN(C)C)c1nc2ccc(Cl)cc2s1

BDBM51939

CCOc1cccc2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM66944

CN(C)CCCN(C(=O)c1cc2cc(ccc2s1)[N+]([O-])=O)c1nc2cc3OCCOc3cc2s1

BDBM66945

COc1ccc2sc(nc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM66946

CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2ccc(F)cc2s1

BDBM76146

CC1CCCCN1S(=O)(=O)c1ccc(cc1)C(=O)N(CCCN(C)C)c1nc2ccc(Br)cc2s1

BDBM76147

CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2c(C)cccc2s1

BDBM64465

COc1ccc(OC)c2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM76148

C=CCn1c(SCC(=O)N2CCN(CC2)c2ccccc2)nc2c3ccccc3[nH]c2c1=O

BDBM58876

CCCCNc1c(nc2ccc(C)cn12)-c1cccc(c1)-c1ccc(OC)cc1

BDBM66950

CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM76149

CCOc1cccc2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N(C)Cc1ccccc1

BDBM66953

CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2ccc(C)cc2s1

BDBM76150

CCOc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM76151

CC(C)(C)OC(=O)NCCCCCc1cn(nn1)[C@@H](CO)C(=O)NCCCCCCCCCCC(=O)N1CCN(CC1)C(=O)OC(C)(C)C

BDBM76152

COc1cccc2sc3cc(NCC[C@@H]4CCCN4C)ccc3c(=O)c12

BDBM70948

COC(=O)C1=NN(C(=O)c2cccc(Br)c2)C(O)(C1)c1ccc(Cl)cc1 |t:4|

BDBM79987

Cc1ccc(O)c(NC(=S)NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)c1

BDBM37226

[H]C12OC(CO)(C=C1)c1c(O)n(c(O)c21)-c1ccccc1-c1ccccc1 |c:6,TLB:12:14:2:6.7,THB:9:8:2:6.7,(14.72,4.09,;14.74,2.55,;13.6,4.07,;14.34,1.07,;13.94,-.42,;15.03,-1.51,;17.16,-.1,;17.56,1.38,;11.67,-.47,;10.64,-1.61,;10.96,-3.12,;9.24,-.99,;9.4,.54,;9.19,2.06,;10.9,.86,;7.91,-1.76,;7.91,-3.3,;6.58,-4.07,;5.24,-3.3,;5.24,-1.76,;6.58,-.99,;5.59,.19,;6.11,1.64,;5.12,2.82,;3.61,2.55,;3.08,1.11,;4.07,-.07,)|

BDBM80031

O=C(CSc1cccc2cccnc12)Nc1ccc(cc1)S(=O)(=O)N1CCOCC1

BDBM80039

CN(C)CCSc1nc2sc(C)c(-c3ccc(F)cc3)c2c(=O)n1-c1ccccc1

BDBM83205

CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)N)O

BDBM52304

COCCCn1c(N)c(-c2nc3ccccc3n2C)c2nc3ccccc3nc12 |(9.35,-7.82,;8.88,-6.36,;9.91,-5.21,;9.43,-3.75,;10.46,-2.6,;9.98,-1.14,;10.88,.1,;12.42,.1,;9.98,1.34,;10.46,2.81,;11.91,3.28,;11.92,4.81,;13.07,5.83,;12.75,7.34,;11.28,7.82,;10.14,6.79,;10.46,5.28,;9.56,4.05,;8.02,4.05,;8.52,.87,;7.19,1.64,;5.85,.87,;4.48,1.7,;3.08,.91,;3.08,-.7,;4.48,-1.49,;5.85,-.67,;7.19,-1.44,;8.52,-.67,)|

BDBM60214

Clc1ccc(cc1)C(=O)Nc1nnc(o1)-c1ccccc1

BDBM83206

Cc1cccc2C(=O)C(=O)N(CCCOc3ccc(cc3)C(C)(C)C)c12

BDBM80006

O=C(NNC(=O)c1ccccc1)c1cc(nn1-c1ccccc1)-c1ccccc1

BDBM80050

CCOC(=O)N1CCN(CC1)C(=O)C1CCN(CC1)C(=O)c1ccccc1C

BDBM54506

Cc1ccccc1CS(=O)(=O)c1ncc(Cl)c(n1)C(=O)Nc1ccc(F)cc1

BDBM80094

C\C=C(/C)C(=O)OC1[C@H](OC(C)=O)C2(CO)[C@H](O)C[C@]3(C)C(=CCC4C5(C)CCC(O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(O)=O)[C@](C)(CO)C5CCC34C)C2CC1(C)C |c:21|

BDBM70650

CN1CCc2nc(SCc3ccc(Cl)cc3)c(C#N)c(-c3cccs3)c2C1

BDBM80072

CC(N=Nc1ccc2ccccc2n1)c1ccccc1O |w:2.1|

BDBM54428

Cc1ccc(cc1)S(=O)(=O)c1ccc(cn1)[N+]([O-])=O

BDBM72680

CN1C(=O)C(C2CC(N=N2)c2ccc(Cl)cc2)C(=O)N(C)C1=O |c:8|

BDBM83208

CC(C)(C)c1ccc2OCC(Oc2c1)C(=O)N\N=C/c1ccccn1

BDBM66015

[O-][N+](=O)c1ccc(nc1)S(=O)(=O)c1cccc(c1)C(F)(F)F

BDBM406410

CCCCc1nc(O)c(-c2nnc(Cc3ccccc3)o2)c(O)c1-c1c(OC)cc(C)cc1OC |(-7.93,-.5,;-6.6,-1.27,;-5.26,-.5,;-3.93,-1.27,;-2.6,-.5,;-2.6,1.04,;-1.26,1.81,;-1.26,3.35,;.07,1.04,;1.4,1.81,;2.81,1.18,;3.84,2.33,;3.07,3.66,;3.47,5.15,;4.96,5.55,;6.05,4.46,;7.53,4.86,;7.93,6.34,;6.84,7.43,;5.36,7.03,;1.56,3.34,;.07,-.5,;1.4,-1.27,;-1.26,-1.27,;-1.26,-2.81,;.07,-3.58,;1.4,-2.81,;2.74,-3.58,;.07,-5.12,;-1.26,-5.89,;-1.26,-7.43,;-2.6,-5.12,;-2.6,-3.58,;-3.93,-2.81,;-5.26,-3.58,)|

BDBM406411

CCCCc1nc(O)c(-c2nnc(Cc3ccncc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;1.56,2.57,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406412

CCCCc1nc(O)c(-c2nnc(CCc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-2.56,;-6.25,-3.33,;-4.92,-2.56,;-3.59,-3.33,;-2.25,-2.56,;-2.25,-1.02,;-.92,-.25,;-.92,1.29,;.42,-1.02,;1.75,-.25,;3.16,-.88,;4.19,.27,;3.42,1.6,;3.81,3.09,;5.3,3.49,;5.7,4.98,;7.19,5.37,;7.59,6.86,;6.5,7.95,;5.01,7.55,;4.61,6.06,;1.91,1.28,;.42,-2.56,;1.75,-3.33,;-.92,-3.33,;-.92,-4.87,;.42,-5.64,;1.75,-4.87,;3.08,-5.64,;.42,-7.18,;-.92,-7.95,;-2.25,-7.18,;-2.25,-5.64,;-3.59,-4.87,;-4.92,-5.64,)|

BDBM406413

CCCCc1nc(O)c(-c2nnc(Cc3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.62,;-6.6,-2.39,;-5.26,-1.62,;-3.93,-2.39,;-2.6,-1.62,;-2.6,-.08,;-1.26,.69,;-1.26,2.23,;.07,-.08,;1.4,.69,;2.81,.07,;3.84,1.21,;3.07,2.54,;3.47,4.03,;4.96,4.43,;6.05,3.34,;7.53,3.74,;7.93,5.23,;6.84,6.32,;5.36,5.92,;4.27,7.01,;1.56,2.22,;.07,-1.62,;1.4,-2.39,;-1.26,-2.39,;-1.26,-3.93,;.07,-4.7,;1.4,-3.93,;2.74,-4.7,;.07,-6.24,;-1.26,-7.01,;-2.6,-6.24,;-2.6,-4.7,;-3.93,-3.93,;-5.26,-4.7,)|

BDBM406414

CCCCc1nc(O)c(-c2nnc(Cc3ccccc3OC)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-2.36,;-6.6,-3.13,;-5.26,-2.36,;-3.93,-3.13,;-2.6,-2.36,;-2.6,-.82,;-1.26,-.05,;-1.26,1.49,;.07,-.82,;1.4,-.05,;2.81,-.68,;3.84,.47,;3.07,1.8,;3.47,3.29,;4.96,3.69,;6.05,2.6,;7.53,3,;7.93,4.48,;6.84,5.57,;5.36,5.17,;4.27,6.26,;4.67,7.75,;1.56,1.48,;.07,-2.36,;1.4,-3.13,;-1.26,-3.13,;-1.26,-4.67,;.07,-5.44,;1.4,-4.67,;2.74,-5.44,;.07,-6.98,;-1.26,-7.75,;-2.6,-6.98,;-2.6,-5.44,;-3.93,-4.67,;-5.26,-5.44,)|

BDBM406415

CCCCc1nc(O)c(-c2nnc(Cc3cccc(OC)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-2.21,;-7,-2.98,;-5.66,-2.21,;-4.33,-2.98,;-3,-2.21,;-3,-.67,;-1.66,.1,;-1.66,1.64,;-.33,-.67,;1.01,.1,;2.41,-.53,;3.44,.61,;2.67,1.95,;3.07,3.43,;4.56,3.83,;5.65,2.74,;7.13,3.14,;7.53,4.63,;6.44,5.72,;6.84,7.21,;8.33,7.6,;4.96,5.32,;1.17,1.63,;-.33,-2.21,;1.01,-2.98,;-1.66,-2.98,;-1.66,-4.52,;-.33,-5.29,;1.01,-4.52,;2.34,-5.29,;-.33,-6.83,;-1.66,-7.6,;-3,-6.83,;-3,-5.29,;-4.33,-4.52,;-5.66,-5.29,)|

BDBM406416

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.68,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;4.61,6.26,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.68,-3.58,;-6.01,-4.35,)|

BDBM406417

CCCCc1nc(O)c(-c2nnc(Cc3ccc(OC)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.22,-1.27,;-7.89,-2.04,;-6.55,-1.27,;-5.22,-2.04,;-3.89,-1.27,;-3.89,.27,;-2.55,1.04,;-2.55,2.58,;-1.22,.27,;.12,1.04,;1.52,.41,;2.55,1.56,;1.78,2.89,;2.18,4.38,;3.67,4.78,;4.76,3.69,;6.25,4.09,;6.64,5.57,;8.13,5.97,;9.22,4.88,;5.56,6.66,;4.07,6.26,;.28,2.57,;-1.22,-1.27,;.12,-2.04,;-2.55,-2.04,;-2.55,-3.58,;-1.22,-4.35,;.12,-3.58,;1.45,-4.35,;-1.22,-5.89,;-2.55,-6.66,;-3.89,-5.89,;-3.89,-4.35,;-5.22,-3.58,;-6.55,-4.35,)|

BDBM406418

CCCCc1nc(O)c(-c2nnc(o2)-c2cccc(Cl)c2)c(O)c1-c1c(OC)cccc1OC |(-7.39,-1.62,;-6.05,-2.39,;-4.72,-1.62,;-3.39,-2.39,;-2.05,-1.62,;-2.05,-.08,;-.72,.69,;-.72,2.23,;.61,-.08,;1.95,.69,;3.35,.07,;4.39,1.21,;3.62,2.54,;2.11,2.22,;4.01,4.03,;2.93,5.12,;3.32,6.61,;4.81,7.01,;5.9,5.92,;7.39,6.32,;5.5,4.43,;.61,-1.62,;1.95,-2.39,;-.72,-2.39,;-.72,-3.93,;.61,-4.7,;1.95,-3.93,;3.28,-4.7,;.61,-6.24,;-.72,-7.01,;-2.05,-6.24,;-2.05,-4.7,;-3.39,-3.93,;-4.72,-4.7,)|

BDBM406419

CCCCc1nc(O)c(-c2nnc(o2)-c2ccccc2Cl)c(O)c1-c1c(OC)cccc1OC |(-6.64,-1.62,;-5.31,-2.39,;-3.98,-1.62,;-2.64,-2.39,;-1.31,-1.62,;-1.31,-.08,;.02,.69,;.02,2.23,;1.36,-.08,;2.69,.69,;4.1,.07,;5.13,1.21,;4.36,2.54,;2.85,2.22,;4.76,4.03,;6.25,4.43,;6.64,5.92,;5.56,7.01,;4.07,6.61,;3.67,5.12,;2.18,4.72,;1.36,-1.62,;2.69,-2.39,;.02,-2.39,;.02,-3.93,;1.36,-4.7,;2.69,-3.93,;4.03,-4.7,;1.36,-6.24,;.02,-7.01,;-1.31,-6.24,;-1.31,-4.7,;-2.64,-3.93,;-3.98,-4.7,)|

BDBM406420

CCCCc1nc(O)c(-c2nnc(o2)-c2cnccn2)c(O)c1-c1c(OC)cccc1OC |(-6.64,-1.62,;-5.31,-2.39,;-3.98,-1.62,;-2.64,-2.39,;-1.31,-1.62,;-1.31,-.08,;.02,.69,;.02,2.23,;1.36,-.08,;2.69,.69,;4.1,.07,;5.13,1.21,;4.36,2.54,;2.85,2.22,;4.76,4.03,;3.67,5.12,;4.07,6.61,;5.56,7.01,;6.64,5.92,;6.25,4.43,;1.36,-1.62,;2.69,-2.39,;.02,-2.39,;.02,-3.93,;1.36,-4.7,;2.69,-3.93,;4.03,-4.7,;1.36,-6.24,;.02,-7.01,;-1.31,-6.24,;-1.31,-4.7,;-2.64,-3.93,;-3.98,-4.7,)|

BDBM406421

CCCCc1nc(O)c(-c2nnc(o2)C2(CC2)c2ccccc2)c(O)c1-c1c(OC)cccc1OC |(-6.44,-1.67,;-5.11,-2.44,;-3.78,-1.67,;-2.44,-2.44,;-1.11,-1.67,;-1.11,-.13,;.22,.64,;.22,2.18,;1.56,-.13,;2.89,.64,;4.3,.01,;5.33,1.16,;4.56,2.49,;3.05,2.17,;4.96,3.98,;6.44,4.38,;5.36,5.47,;3.62,4.75,;3.62,6.29,;2.29,7.06,;.96,6.29,;.96,4.75,;2.29,3.98,;1.56,-1.67,;2.89,-2.44,;.22,-2.44,;.22,-3.98,;1.56,-4.75,;2.89,-3.98,;4.22,-4.75,;1.56,-6.29,;.22,-7.06,;-1.11,-6.29,;-1.11,-4.75,;-2.44,-3.98,;-3.78,-4.75,)|

BDBM406422

CCCCc1nc(O)c(-c2nnc(o2)C2CC2)c(O)c1-c1c(OC)cccc1OC |(-6.25,-.87,;-4.91,-1.64,;-3.58,-.87,;-2.24,-1.64,;-.91,-.87,;-.91,.67,;.42,1.44,;.42,2.98,;1.76,.67,;3.09,1.44,;4.5,.81,;5.53,1.95,;4.76,3.29,;3.25,2.97,;5.16,4.78,;6.25,5.86,;4.76,6.26,;1.76,-.87,;3.09,-1.64,;.42,-1.64,;.42,-3.18,;1.76,-3.95,;3.09,-3.18,;4.42,-3.95,;1.76,-5.49,;.42,-6.26,;-.91,-5.49,;-.91,-3.95,;-2.24,-3.18,;-3.58,-3.95,)|

BDBM406423

CCCCc1nc(O)c(-c2nnc(o2)C(C)(C)c2ccccc2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;1.56,2.57,;3.47,4.38,;3.07,5.86,;1.98,4.78,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406424

CCCCc1nc(O)c(-c2nnc(COc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-2.56,;-6.25,-3.33,;-4.92,-2.56,;-3.59,-3.33,;-2.25,-2.56,;-2.25,-1.02,;-.92,-.25,;-.92,1.29,;.42,-1.02,;1.75,-.25,;3.16,-.88,;4.19,.27,;3.42,1.6,;3.81,3.09,;5.3,3.49,;5.7,4.98,;7.19,5.37,;7.59,6.86,;6.5,7.95,;5.01,7.55,;4.61,6.06,;1.91,1.28,;.42,-2.56,;1.75,-3.33,;-.92,-3.33,;-.92,-4.87,;.42,-5.64,;1.75,-4.87,;3.08,-5.64,;.42,-7.18,;-.92,-7.95,;-2.25,-7.18,;-2.25,-5.64,;-3.59,-4.87,;-4.92,-5.64,)|

BDBM406425

COc1cccc(OC)c1-c1c(CCC=C)nc(O)c(-c2nnc(Cc3ccccc3)o2)c1O |(2.74,-4.35,;1.4,-3.58,;.07,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,;-1.26,-3.58,;-1.26,-2.04,;-2.6,-1.27,;-3.93,-2.04,;-5.26,-1.27,;-6.6,-2.04,;-7.93,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;1.56,2.57,;.07,-1.27,;1.4,-2.04,)|

BDBM406426

CCCCc1nc(O)c(-c2nnc(o2)-c2cc(C)[nH]n2)c(O)c1-c1c(OC)cccc1OC |(-7.52,-1.27,;-6.18,-2.04,;-4.85,-1.27,;-3.51,-2.04,;-2.18,-1.27,;-2.18,.27,;-.85,1.04,;-.85,2.58,;.49,.27,;1.82,1.04,;3.23,.41,;4.26,1.56,;3.49,2.89,;1.98,2.57,;4.26,4.22,;5.79,4.38,;6.11,5.89,;7.52,6.52,;4.78,6.66,;3.63,5.63,;.49,-1.27,;1.82,-2.04,;-.85,-2.04,;-.85,-3.58,;.49,-4.35,;1.82,-3.58,;3.15,-4.35,;.49,-5.89,;-.85,-6.66,;-2.18,-5.89,;-2.18,-4.35,;-3.51,-3.58,;-4.85,-4.35,)|

BDBM406427

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.94,-.9,;-7.61,-1.67,;-6.27,-.9,;-4.94,-1.67,;-3.6,-.9,;-3.6,.64,;-2.27,1.41,;-2.27,2.95,;-.94,.64,;.4,1.41,;1.8,.78,;2.83,1.93,;2.06,3.26,;2.46,4.75,;3.95,5.15,;4.98,6.29,;6.49,5.97,;6.96,4.5,;8.47,4.17,;8.94,2.71,;7.9,1.57,;6.4,1.89,;5.93,3.36,;.56,2.94,;-.94,-.9,;.4,-1.67,;-2.27,-1.67,;-2.27,-3.21,;-.94,-3.98,;.4,-3.21,;1.73,-3.98,;-.94,-5.52,;-2.27,-6.29,;-3.6,-5.52,;-3.6,-3.98,;-4.94,-3.21,;-6.27,-3.98,)|

BDBM406428

CCCCc1nc(O)c(-c2nnc(Cc3cnccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;5.36,6.26,;6.84,6.66,;7.93,5.57,;7.53,4.09,;6.05,3.69,;1.56,2.57,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406429

CCCCc1nc(O)c(-c2nnc(Cc3cncnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;1.56,2.57,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406430

CCCCc1nc(O)c(-c2nnc(Cc3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-2.02,;-6.6,-2.79,;-5.26,-2.02,;-3.93,-2.79,;-2.6,-2.02,;-2.6,-.48,;-1.26,.29,;-1.26,1.83,;.07,-.48,;1.4,.29,;2.81,-.33,;3.84,.81,;3.07,2.15,;3.47,3.63,;4.96,4.03,;6.05,2.94,;7.53,3.34,;7.93,4.83,;6.84,5.92,;7.24,7.41,;5.36,5.52,;1.56,1.83,;.07,-2.02,;1.4,-2.79,;-1.26,-2.79,;-1.26,-4.33,;.07,-5.1,;1.4,-4.33,;2.74,-5.1,;.07,-6.64,;-1.26,-7.41,;-2.6,-6.64,;-2.6,-5.1,;-3.93,-4.33,;-5.26,-5.1,)|

BDBM406431

CCCCc1nc(O)c(-c2nnc(o2)C(F)(F)c2ccccc2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;1.56,2.57,;3.47,4.38,;3.07,5.86,;1.98,4.78,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406432

CCCCc1nc(O)c(-c2nnc(Cc3nc4ccccc4o3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.98,-1.55,;-7.64,-2.32,;-6.31,-1.55,;-4.98,-2.32,;-3.64,-1.55,;-3.64,-.01,;-2.31,.76,;-2.31,2.3,;-.97,-.01,;.36,.76,;1.77,.13,;2.8,1.28,;2.03,2.61,;2.42,4.1,;3.91,4.5,;4.46,5.93,;6,5.85,;7.09,6.94,;8.58,6.54,;8.98,5.06,;7.89,3.97,;6.4,4.37,;5.11,3.53,;.52,2.29,;-.97,-1.55,;.36,-2.32,;-2.31,-2.32,;-2.31,-3.86,;-.97,-4.63,;.36,-3.86,;1.69,-4.63,;-.97,-6.17,;-2.31,-6.94,;-3.64,-6.17,;-3.64,-4.63,;-4.98,-3.86,;-6.31,-4.63,)|

BDBM406433

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(OC)cc(C)cc1OC |(-8.42,-.28,;-7.08,-1.05,;-5.75,-.28,;-4.41,-1.05,;-3.08,-.28,;-3.08,1.26,;-1.75,2.03,;-1.75,3.57,;-.41,1.26,;.92,2.03,;2.33,1.41,;3.36,2.55,;2.59,3.88,;2.99,5.37,;4.47,5.77,;5.03,7.21,;6.56,7.13,;6.96,5.64,;8.33,4.94,;8.42,3.4,;7.12,2.56,;5.75,3.26,;5.67,4.8,;1.08,3.56,;-.41,-.28,;.92,-1.05,;-1.75,-1.05,;-1.75,-2.59,;-.41,-3.36,;.92,-2.59,;2.25,-3.36,;-.41,-4.9,;-1.75,-5.67,;-1.75,-7.21,;-3.08,-4.9,;-3.08,-3.36,;-4.41,-2.59,;-5.75,-3.36,)|

BDBM406434

COc1cccc(OC)c1-c1c(CCC=C)nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c1O |(2.25,-4.13,;.92,-3.36,;-.41,-4.13,;-.41,-5.67,;-1.75,-6.44,;-3.08,-5.67,;-3.08,-4.13,;-4.41,-3.36,;-5.75,-4.13,;-1.75,-3.36,;-1.75,-1.82,;-3.08,-1.05,;-4.41,-1.82,;-5.75,-1.05,;-7.08,-1.82,;-8.42,-1.05,;-3.08,.49,;-1.75,1.26,;-1.75,2.8,;-.41,.49,;.92,1.26,;2.33,.64,;3.36,1.78,;2.59,3.11,;2.99,4.6,;4.47,5,;5.03,6.44,;6.56,6.36,;6.96,4.87,;8.33,4.17,;8.42,2.63,;7.12,1.79,;5.75,2.49,;5.67,4.03,;1.08,2.79,;-.41,-1.05,;.92,-1.82,)|

BDBM406435

CCCCc1nc(O)c(-c2nnc(CCc3ncc(o3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.43,-3.58,;-8.09,-4.35,;-6.76,-3.58,;-5.43,-4.35,;-4.09,-3.58,;-4.09,-2.04,;-2.76,-1.27,;-2.76,.27,;-1.43,-2.04,;-.09,-1.27,;1.31,-1.9,;2.34,-.75,;1.57,.58,;1.97,2.07,;3.46,2.47,;3.86,3.95,;3.02,5.25,;3.99,6.44,;5.43,5.89,;5.35,4.35,;6.76,6.66,;8.09,5.89,;9.43,6.66,;9.43,8.2,;8.09,8.97,;6.76,8.2,;.07,.26,;-1.43,-3.58,;-.09,-4.35,;-2.76,-4.35,;-2.76,-5.89,;-1.43,-6.66,;-.09,-5.89,;1.24,-6.66,;-1.43,-8.2,;-2.76,-8.97,;-4.09,-8.2,;-4.09,-6.66,;-5.43,-5.89,;-6.76,-6.66,)|

BDBM406436

CCCCc1nc(O)c(-c2nnc(CCc3nccn3C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.99,-2.32,;-6.65,-3.09,;-5.32,-2.32,;-3.98,-3.09,;-2.65,-2.32,;-2.65,-.78,;-1.32,-.01,;-1.32,1.53,;.02,-.78,;1.35,-.01,;2.76,-.63,;3.79,.51,;3.02,1.84,;3.42,3.33,;4.9,3.73,;5.3,5.22,;4.46,6.51,;5.43,7.71,;6.87,7.15,;6.79,5.62,;7.99,4.65,;1.51,1.52,;.02,-2.32,;1.35,-3.09,;-1.32,-3.09,;-1.32,-4.63,;.02,-5.4,;1.35,-4.63,;2.68,-5.4,;.02,-6.94,;-1.32,-7.71,;-2.65,-6.94,;-2.65,-5.4,;-3.98,-4.63,;-5.32,-5.4,)|

BDBM406437

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)nc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.68,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;4.61,6.26,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.68,-3.58,;-6.01,-4.35,)|

BDBM406438

CCCCc1nc(O)c(-c2nnc(o2)C(C)(C)c2ccc(Cl)cc2)c(O)c1-c1c(OC)cccc1OC |(-6.37,-2.31,;-5.03,-3.08,;-3.7,-2.31,;-2.37,-3.08,;-1.03,-2.31,;-1.03,-.77,;.3,0,;.3,1.54,;1.63,-.77,;2.97,0,;4.37,-.62,;5.41,.52,;4.64,1.85,;3.13,1.53,;5.03,3.34,;6.37,4.11,;6.37,2.57,;3.95,4.43,;4.34,5.92,;3.25,7.01,;1.77,6.61,;.68,7.7,;1.37,5.12,;2.46,4.03,;1.63,-2.31,;2.97,-3.08,;.3,-3.08,;.3,-4.62,;1.63,-5.39,;2.97,-4.62,;4.3,-5.39,;1.63,-6.93,;.3,-7.7,;-1.03,-6.93,;-1.03,-5.39,;-2.37,-4.62,;-3.7,-5.39,)|

BDBM406439

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.68,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;4.61,6.26,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.68,-3.58,;-6.01,-4.35,)|

BDBM406440

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)c(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-2.02,;-7.34,-2.79,;-6.01,-2.02,;-4.68,-2.79,;-3.34,-2.02,;-3.34,-.48,;-2.01,.29,;-2.01,1.83,;-.67,-.48,;.66,.29,;2.07,-.33,;3.1,.81,;2.33,2.15,;2.73,3.63,;4.21,4.03,;5.3,2.94,;6.79,3.34,;7.19,4.83,;8.68,5.23,;6.1,5.92,;6.5,7.41,;4.61,5.52,;.82,1.83,;-.67,-2.02,;.66,-2.79,;-2.01,-2.79,;-2.01,-4.33,;-.67,-5.1,;.66,-4.33,;1.99,-5.1,;-.67,-6.64,;-2.01,-7.41,;-3.34,-6.64,;-3.34,-5.1,;-4.68,-4.33,;-6.01,-5.1,)|

BDBM406441

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(c3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.82,-1.27,;-7.49,-2.04,;-6.15,-1.27,;-4.82,-2.04,;-3.49,-1.27,;-3.49,.27,;-2.15,1.04,;-2.15,2.58,;-.82,.27,;.51,1.04,;1.92,.41,;2.95,1.56,;2.18,2.89,;2.58,4.38,;4.07,4.78,;4.47,6.26,;5.95,6.66,;7.04,5.57,;8.53,5.97,;6.64,4.09,;5.16,3.69,;7.73,3,;8.82,1.91,;8.82,4.09,;6.64,1.91,;.67,2.57,;-.82,-1.27,;.51,-2.04,;-2.15,-2.04,;-2.15,-3.58,;-.82,-4.35,;.51,-3.58,;1.85,-4.35,;-.82,-5.89,;-2.15,-6.66,;-3.49,-5.89,;-3.49,-4.35,;-4.82,-3.58,;-6.15,-4.35,)|

BDBM406442

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.62,;-7.34,-2.39,;-6.01,-1.62,;-4.67,-2.39,;-3.34,-1.62,;-3.34,-.08,;-2.01,.69,;-2.01,2.23,;-.67,-.08,;.66,.69,;2.07,.07,;3.1,1.21,;2.33,2.54,;2.73,4.03,;4.21,4.43,;5.3,3.34,;6.79,3.74,;7.19,5.23,;8.68,5.63,;6.1,6.32,;4.61,5.92,;3.52,7.01,;.82,2.22,;-.67,-1.62,;.66,-2.39,;-2.01,-2.39,;-2.01,-3.93,;-.67,-4.7,;.66,-3.93,;1.99,-4.7,;-.67,-6.24,;-2.01,-7.01,;-3.34,-6.24,;-3.34,-4.7,;-4.67,-3.93,;-6.01,-4.7,)|

BDBM406443

CCCCc1nc(O)c(-c2nnc(Cc3c(C)n[nH]c3C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.69,-1.69,;-6.36,-2.46,;-5.02,-1.69,;-3.69,-2.46,;-2.35,-1.69,;-2.35,-.15,;-1.02,.62,;-1.02,2.16,;.31,-.15,;1.65,.62,;3.05,-.01,;4.08,1.13,;3.31,2.47,;3.71,3.96,;5.2,4.35,;6.4,3.39,;6.32,1.85,;7.69,4.22,;7.29,5.71,;5.75,5.79,;4.91,7.08,;1.81,2.15,;.31,-1.69,;1.65,-2.46,;-1.02,-2.46,;-1.02,-4,;.31,-4.77,;1.65,-4,;2.98,-4.77,;.31,-6.31,;-1.02,-7.08,;-2.35,-6.31,;-2.35,-4.77,;-3.69,-4,;-5.02,-4.77,)|

BDBM406444

CCCCc1nc(O)c(-c2nnc(Cc3ccc(cc3)C#N)o2)c(O)c1-c1c(OC)cccc1OC |(-9.42,-1.27,;-8.09,-2.04,;-6.75,-1.27,;-5.42,-2.04,;-4.09,-1.27,;-4.09,.27,;-2.75,1.04,;-2.75,2.58,;-1.42,.27,;-.08,1.04,;1.32,.41,;2.35,1.56,;1.58,2.89,;1.98,4.38,;3.47,4.78,;4.56,3.69,;6.05,4.09,;6.44,5.57,;5.36,6.66,;3.87,6.26,;7.93,5.97,;9.42,6.37,;.08,2.57,;-1.42,-1.27,;-.08,-2.04,;-2.75,-2.04,;-2.75,-3.58,;-1.42,-4.35,;-.08,-3.58,;1.25,-4.35,;-1.42,-5.89,;-2.75,-6.66,;-4.09,-5.89,;-4.09,-4.35,;-5.42,-3.58,;-6.75,-4.35,)|

BDBM406445

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-2.02,;-7.34,-2.79,;-6.01,-2.02,;-4.67,-2.79,;-3.34,-2.02,;-3.34,-.48,;-2.01,.29,;-2.01,1.83,;-.67,-.48,;.66,.29,;2.07,-.33,;3.1,.81,;2.33,2.15,;2.73,3.63,;4.21,4.03,;5.3,2.94,;6.79,3.34,;7.19,4.83,;8.68,5.23,;6.1,5.92,;6.5,7.41,;4.61,5.52,;.82,1.83,;-.67,-2.02,;.66,-2.79,;-2.01,-2.79,;-2.01,-4.33,;-.67,-5.1,;.66,-4.33,;1.99,-5.1,;-.67,-6.64,;-2.01,-7.41,;-3.34,-6.64,;-3.34,-5.1,;-4.67,-4.33,;-6.01,-5.1,)|

BDBM406446

CCCCc1nc(O)c(-c2nnc(Cc3csc(n3)-c3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.34,-1.01,;-9.01,-1.79,;-7.67,-1.01,;-6.34,-1.79,;-5.01,-1.01,;-5.01,.52,;-3.67,1.3,;-3.67,2.83,;-2.34,.52,;-1.01,1.3,;.4,.67,;1.43,1.81,;.66,3.15,;1.06,4.63,;2.55,5.03,;3.25,6.4,;4.77,6.16,;5.01,4.64,;3.64,3.94,;6.34,3.87,;6.34,2.33,;7.67,1.56,;9.01,2.33,;10.34,1.56,;9.01,3.87,;7.67,4.64,;-.85,2.83,;-2.34,-1.01,;-1.01,-1.79,;-3.67,-1.79,;-3.67,-3.33,;-2.34,-4.09,;-1.01,-3.33,;.33,-4.09,;-2.34,-5.63,;-3.67,-6.4,;-5.01,-5.63,;-5.01,-4.09,;-6.34,-3.33,;-7.67,-4.09,)|

BDBM406447

CCCCc1nc(O)c(-c2nnc(o2)C(C)c2ccc(Cl)cc2)c(O)c1-c1c(OC)cccc1OC |(-6.44,-2.31,;-5.11,-3.08,;-3.78,-2.31,;-2.44,-3.08,;-1.11,-2.31,;-1.11,-.77,;.22,0,;.22,1.54,;1.56,-.77,;2.89,0,;4.3,-.62,;5.33,.52,;4.56,1.85,;3.05,1.53,;4.96,3.34,;6.44,3.74,;3.87,4.43,;4.27,5.92,;3.18,7.01,;1.69,6.61,;.6,7.7,;1.29,5.12,;2.38,4.03,;1.56,-2.31,;2.89,-3.08,;.22,-3.08,;.22,-4.62,;1.56,-5.39,;2.89,-4.62,;4.22,-5.39,;1.56,-6.93,;.22,-7.7,;-1.11,-6.93,;-1.11,-5.39,;-2.44,-4.62,;-3.78,-5.39,)|

BDBM406448

CCCCc1nc(O)c(-c2nnc(Cc3nonc3C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.69,-1.69,;-6.36,-2.46,;-5.02,-1.69,;-3.69,-2.46,;-2.35,-1.69,;-2.35,-.15,;-1.02,.62,;-1.02,2.16,;.31,-.15,;1.65,.62,;3.05,-.01,;4.08,1.13,;3.31,2.47,;3.71,3.96,;5.2,4.35,;6.4,3.39,;7.69,4.22,;7.29,5.71,;5.75,5.79,;4.91,7.08,;1.81,2.15,;.31,-1.69,;1.65,-2.46,;-1.02,-2.46,;-1.02,-4,;.31,-4.77,;1.65,-4,;2.98,-4.77,;.31,-6.31,;-1.02,-7.08,;-2.35,-6.31,;-2.35,-4.77,;-3.69,-4,;-5.02,-4.77,)|

BDBM406449

CCCCc1nc(O)c(-c2nnc(COc3ccc(F)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-3.3,;-6.25,-4.07,;-4.92,-3.3,;-3.59,-4.07,;-2.25,-3.3,;-2.25,-1.76,;-.92,-.99,;-.92,.55,;.42,-1.76,;1.75,-.99,;3.16,-1.62,;4.19,-.48,;3.42,.86,;3.81,2.35,;5.3,2.74,;5.7,4.23,;7.19,4.63,;7.59,6.12,;6.5,7.21,;6.9,8.69,;5.01,6.81,;4.61,5.32,;1.91,.54,;.42,-3.3,;1.75,-4.07,;-.92,-4.07,;-.92,-5.61,;.42,-6.38,;1.75,-5.61,;3.08,-6.38,;.42,-7.92,;-.92,-8.69,;-2.25,-7.92,;-2.25,-6.38,;-3.59,-5.61,;-4.92,-6.38,)|

BDBM406450

CCCCc1nc(O)c(-c2nnc(Cc3n[nH]c4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-7.91,-2.38,;-6.58,-3.15,;-5.24,-2.38,;-3.91,-3.15,;-2.57,-2.38,;-2.57,-.84,;-1.24,-.07,;-1.24,1.47,;.09,-.84,;1.43,-.07,;2.83,-.7,;3.86,.45,;3.09,1.78,;3.49,3.27,;4.98,3.67,;6.18,2.7,;7.47,3.54,;7.07,5.03,;7.91,6.32,;7.21,7.69,;5.67,7.77,;4.83,6.48,;5.53,5.11,;1.59,1.46,;.09,-2.38,;1.43,-3.15,;-1.24,-3.15,;-1.24,-4.69,;.09,-5.46,;1.43,-4.69,;2.76,-5.46,;.09,-7,;-1.24,-7.77,;-2.57,-7,;-2.57,-5.46,;-3.91,-4.69,;-5.24,-5.46,)|

BDBM406451

CCCCc1nc(O)c(-c2nnc(Cc3n[nH]c(=O)c4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-2.56,;-7.34,-3.33,;-6.01,-2.56,;-4.67,-3.33,;-3.34,-2.56,;-3.34,-1.02,;-2.01,-.25,;-2.01,1.29,;-.67,-1.02,;.66,-.25,;2.07,-.88,;3.1,.27,;2.33,1.6,;2.73,3.09,;4.21,3.49,;5.3,2.4,;6.79,2.8,;7.19,4.28,;8.68,4.68,;6.1,5.37,;6.5,6.86,;5.41,7.95,;3.92,7.55,;3.52,6.06,;4.61,4.98,;.82,1.28,;-.67,-2.56,;.66,-3.33,;-2.01,-3.33,;-2.01,-4.87,;-.67,-5.64,;.66,-4.87,;1.99,-5.64,;-.67,-7.18,;-2.01,-7.95,;-3.34,-7.18,;-3.34,-5.64,;-4.67,-4.87,;-6.01,-5.64,)|

BDBM406452

CCCCc1nc(O)c(-c2nnc(o2)C(OC)c2ccccc2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;1.56,2.57,;3.47,4.38,;2.38,5.47,;.89,5.07,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406453

CCCCc1nc(O)c(-c2nnc(Cc3csc(n3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.18,-.9,;-8.85,-1.67,;-7.51,-.9,;-6.18,-1.67,;-4.85,-.9,;-4.85,.64,;-3.51,1.41,;-3.51,2.95,;-2.18,.64,;-.85,1.41,;.56,.78,;1.59,1.93,;.82,3.26,;1.22,4.75,;2.71,5.15,;3.74,6.29,;5.25,5.96,;5.72,4.5,;4.68,3.36,;7.21,4.1,;7.6,2.61,;9.09,2.21,;10.18,3.3,;9.78,4.79,;8.3,5.19,;-.68,2.94,;-2.18,-.9,;-.85,-1.67,;-3.51,-1.67,;-3.51,-3.21,;-2.18,-3.98,;-.85,-3.21,;.49,-3.98,;-2.18,-5.52,;-3.51,-6.29,;-4.85,-5.52,;-4.85,-3.98,;-6.18,-3.21,;-7.51,-3.98,)|

BDBM406454

CCCCc1nc(O)c(-c2nnc(CCc3nc4ccccc4o3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.87,-3.61,;-6.53,-4.38,;-5.2,-3.61,;-3.87,-4.38,;-2.53,-3.61,;-2.53,-2.07,;-1.2,-1.3,;-1.2,.24,;.14,-2.07,;1.47,-1.3,;2.88,-1.92,;3.91,-.78,;3.14,.56,;3.53,2.04,;5.02,2.44,;5.42,3.93,;4.45,5.13,;5.29,6.42,;4.89,7.91,;5.98,9,;7.47,8.6,;7.87,7.11,;6.78,6.02,;6.86,4.48,;1.63,.24,;.14,-3.61,;1.47,-4.38,;-1.2,-4.38,;-1.2,-5.92,;.14,-6.69,;1.47,-5.92,;2.8,-6.69,;.14,-8.23,;-1.2,-9,;-2.53,-8.23,;-2.53,-6.69,;-3.87,-5.92,;-5.2,-6.69,)|

BDBM406455

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(OC)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-2.21,;-7.34,-2.99,;-6.01,-2.21,;-4.67,-2.99,;-3.34,-2.21,;-3.34,-.67,;-2.01,.1,;-2.01,1.64,;-.67,-.67,;.66,.1,;2.07,-.53,;3.1,.61,;2.33,1.95,;2.73,3.43,;4.21,3.83,;5.3,2.74,;6.79,3.14,;7.19,4.63,;8.68,5.03,;6.1,5.72,;6.5,7.21,;7.99,7.6,;4.61,5.32,;.82,1.63,;-.67,-2.21,;.66,-2.99,;-2.01,-2.99,;-2.01,-4.53,;-.67,-5.29,;.66,-4.53,;1.99,-5.29,;-.67,-6.83,;-2.01,-7.6,;-3.34,-6.83,;-3.34,-5.29,;-4.67,-4.53,;-6.01,-5.29,)|

BDBM406456

CCCCc1nc(O)c(-c2nnc(Cc3cncs3)o2)c(O)c1-c1c(OC)cccc1OC |(-5.89,-1.9,;-4.55,-2.67,;-3.22,-1.9,;-1.89,-2.67,;-.55,-1.9,;-.55,-.36,;.78,.41,;.78,1.95,;2.12,-.36,;3.45,.41,;4.86,-.22,;5.89,.92,;5.12,2.26,;5.89,3.59,;5.12,4.92,;3.58,4.92,;3.1,6.39,;4.35,7.29,;5.59,6.39,;3.61,1.94,;2.12,-1.9,;3.45,-2.67,;.78,-2.67,;.78,-4.21,;2.12,-4.98,;3.45,-4.21,;4.78,-4.98,;2.12,-6.52,;.78,-7.29,;-.55,-6.52,;-.55,-4.98,;-1.89,-4.21,;-3.22,-4.98,)|

BDBM406457

CCCCc1nc(O)c(-c2nnc(COc3ccc(Cl)c(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-3.3,;-7,-4.07,;-5.66,-3.3,;-4.33,-4.07,;-3,-3.3,;-3,-1.76,;-1.66,-.99,;-1.66,.55,;-.33,-1.76,;1.01,-.99,;2.41,-1.62,;3.44,-.48,;2.67,.86,;3.07,2.35,;4.56,2.74,;4.96,4.23,;3.87,5.32,;4.27,6.81,;5.75,7.21,;6.15,8.69,;6.84,6.12,;8.33,6.52,;6.44,4.63,;1.17,.54,;-.33,-3.3,;1.01,-4.07,;-1.66,-4.07,;-1.66,-5.61,;-.33,-6.38,;1.01,-5.61,;2.34,-6.38,;-.33,-7.92,;-1.66,-8.69,;-3,-7.92,;-3,-6.38,;-4.33,-5.61,;-5.66,-6.38,)|

BDBM406458

CCCCc1nc(O)c(-c2nnc(Cc3cc(C)no3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.97,-1.61,;-6.64,-2.38,;-5.31,-1.61,;-3.97,-2.38,;-2.64,-1.61,;-2.64,-.07,;-1.31,.7,;-1.31,2.24,;.03,-.07,;1.36,.7,;2.77,.08,;3.8,1.22,;3.03,2.56,;3.43,4.04,;4.92,4.44,;5.47,5.88,;7,5.8,;7.97,7,;7.4,4.31,;6.11,3.47,;1.52,2.24,;.03,-1.61,;1.36,-2.38,;-1.31,-2.38,;-1.31,-3.92,;.03,-4.69,;1.36,-3.92,;2.7,-4.69,;.03,-6.23,;-1.31,-7,;-2.64,-6.23,;-2.64,-4.69,;-3.97,-3.92,;-5.31,-4.69,)|

BDBM406459

CCCCc1nc(O)c(-c2nnc(CCc3nc(no3)-c3cnccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.43,-3.58,;-8.09,-4.35,;-6.76,-3.58,;-5.43,-4.35,;-4.09,-3.58,;-4.09,-2.04,;-2.76,-1.27,;-2.76,.27,;-1.43,-2.04,;-.09,-1.27,;1.31,-1.9,;2.34,-.75,;1.57,.58,;1.97,2.07,;3.46,2.47,;3.86,3.95,;5.35,4.35,;5.43,5.89,;3.99,6.44,;3.02,5.25,;6.76,6.66,;8.09,5.89,;9.43,6.66,;9.43,8.2,;8.09,8.97,;6.76,8.2,;.07,.26,;-1.43,-3.58,;-.09,-4.35,;-2.76,-4.35,;-2.76,-5.89,;-1.43,-6.66,;-.09,-5.89,;1.24,-6.66,;-1.43,-8.2,;-2.76,-8.97,;-4.09,-8.2,;-4.09,-6.66,;-5.43,-5.89,;-6.76,-6.66,)|

BDBM406460

CCCCc1nc(O)c(-c2nnc(COc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-3.3,;-6.25,-4.07,;-4.92,-3.3,;-3.59,-4.07,;-2.25,-3.3,;-2.25,-1.76,;-.92,-.99,;-.92,.55,;.42,-1.76,;1.75,-.99,;3.16,-1.62,;4.19,-.48,;3.42,.86,;3.81,2.35,;5.3,2.74,;5.7,4.23,;7.19,4.63,;7.59,6.12,;6.5,7.21,;6.9,8.69,;5.01,6.81,;4.61,5.32,;1.91,.54,;.42,-3.3,;1.75,-4.07,;-.92,-4.07,;-.92,-5.61,;.42,-6.38,;1.75,-5.61,;3.08,-6.38,;.42,-7.92,;-.92,-8.69,;-2.25,-7.92,;-2.25,-6.38,;-3.59,-5.61,;-4.92,-6.38,)|

BDBM406461

CCCCc1nc(O)c(-c2nnc(CC(C)(C)c3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-3.3,;-6.25,-4.07,;-4.92,-3.3,;-3.59,-4.07,;-2.25,-3.3,;-2.25,-1.76,;-.92,-.99,;-.92,.55,;.42,-1.76,;1.75,-.99,;3.16,-1.62,;4.19,-.48,;3.42,.86,;3.81,2.35,;5.3,2.74,;6.64,1.97,;5.7,1.26,;5.7,4.23,;7.19,4.63,;7.59,6.12,;6.5,7.21,;6.9,8.69,;5.01,6.81,;4.61,5.32,;1.91,.54,;.42,-3.3,;1.75,-4.07,;-.92,-4.07,;-.92,-5.61,;.42,-6.38,;1.75,-5.61,;3.08,-6.38,;.42,-7.92,;-.92,-8.69,;-2.25,-7.92,;-2.25,-6.38,;-3.59,-5.61,;-4.92,-6.38,)|

BDBM406462

CCCCc1nc(O)c(-c2nnc(Cc3nc(no3)-c3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.2,-1.67,;-8.87,-2.44,;-7.54,-1.67,;-6.2,-2.44,;-4.87,-1.67,;-4.87,-.13,;-3.53,.64,;-3.53,2.18,;-2.2,-.13,;-.87,.64,;.54,.02,;1.57,1.16,;.8,2.49,;1.2,3.98,;2.69,4.38,;3.28,5.8,;5.74,4.77,;5.15,3.35,;3.62,3.16,;7.23,5.17,;7.63,6.66,;9.11,7.06,;10.2,5.97,;9.8,4.48,;8.32,4.08,;-.71,2.17,;-2.2,-1.67,;-.87,-2.44,;-3.53,-2.44,;-3.53,-3.98,;-2.2,-4.75,;-.87,-3.98,;.47,-4.75,;-2.2,-6.29,;-3.53,-7.06,;-4.87,-6.29,;-4.87,-4.75,;-6.2,-3.98,;-7.54,-4.75,)|

BDBM406463

CCCCc1nc(O)c(-c2nnc(Cc3ccc(OC(F)(F)F)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.62,-2.41,;-8.29,-3.18,;-6.95,-2.41,;-5.62,-3.18,;-4.28,-2.41,;-4.28,-.87,;-2.95,-.1,;-2.95,1.44,;-1.62,-.87,;-.28,-.1,;1.12,-.73,;2.15,.41,;1.38,1.75,;1.78,3.23,;3.27,3.63,;4.36,2.54,;5.85,2.94,;6.25,4.43,;7.73,4.83,;8.13,6.32,;8.53,7.8,;6.64,6.72,;9.62,5.92,;5.16,5.52,;3.67,5.12,;-.12,1.43,;-1.62,-2.41,;-.28,-3.18,;-2.95,-3.18,;-2.95,-4.72,;-1.62,-5.49,;-.28,-4.72,;1.05,-5.49,;-1.62,-7.03,;-2.95,-7.8,;-4.28,-7.03,;-4.28,-5.49,;-5.62,-4.72,;-6.95,-5.49,)|

BDBM406464

CCCCc1nc(O)c(-c2nnc(Cc3cc(F)cc(c3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-2.76,;-7,-3.53,;-5.66,-2.76,;-4.33,-3.53,;-3,-2.76,;-3,-1.22,;-1.66,-.45,;-1.66,1.09,;-.33,-1.22,;1.01,-.45,;2.41,-1.08,;3.44,.07,;2.67,1.4,;3.07,2.89,;4.56,3.29,;5.65,2.2,;7.13,2.6,;8.22,1.51,;7.53,4.09,;6.44,5.17,;4.96,4.78,;6.84,6.66,;7.24,8.15,;8.33,6.26,;5.36,7.06,;1.17,1.08,;-.33,-2.76,;1.01,-3.53,;-1.66,-3.53,;-1.66,-5.07,;-.33,-5.84,;1.01,-5.07,;2.34,-5.84,;-.33,-7.38,;-1.66,-8.15,;-3,-7.38,;-3,-5.84,;-4.33,-5.07,;-5.66,-5.84,)|

BDBM406465

CCCCc1nc(O)c(-c2nnc(CCc3nc4ccccc4n3C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.79,-3.28,;-7.45,-4.05,;-6.12,-3.28,;-4.79,-4.05,;-3.45,-3.28,;-3.45,-1.74,;-2.12,-.97,;-2.12,.57,;-.78,-1.74,;.55,-.97,;1.96,-1.6,;2.99,-.45,;2.22,.88,;2.62,2.37,;4.1,2.77,;4.5,4.26,;3.58,5.49,;5.73,7.08,;6.34,8.49,;7.87,8.67,;8.79,7.43,;8.17,6.02,;6.64,5.84,;6.03,4.43,;6.95,3.19,;.71,.56,;-.78,-3.28,;.55,-4.05,;-2.12,-4.05,;-2.12,-5.59,;-.78,-6.36,;.55,-5.59,;1.88,-6.36,;-.78,-7.9,;-2.12,-8.67,;-3.45,-7.9,;-3.45,-6.36,;-4.79,-5.59,;-6.12,-6.36,)|

BDBM406466

CCCCc1nc(O)c(-c2nnc(Cc3ccnc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.28,-1.27,;-6.94,-2.04,;-5.61,-1.27,;-4.28,-2.04,;-2.94,-1.27,;-2.94,.27,;-1.61,1.04,;-1.61,2.58,;-.28,.27,;1.06,1.04,;2.47,.41,;3.5,1.56,;2.73,2.89,;3.12,4.38,;4.61,4.78,;5.01,6.26,;6.5,6.66,;7.59,5.57,;7.19,4.09,;8.28,3,;5.7,3.69,;1.22,2.57,;-.28,-1.27,;1.06,-2.04,;-1.61,-2.04,;-1.61,-3.58,;-.28,-4.35,;1.06,-3.58,;2.39,-4.35,;-.28,-5.89,;-1.61,-6.66,;-2.94,-5.89,;-2.94,-4.35,;-4.28,-3.58,;-5.61,-4.35,)|

BDBM406467

CCCCc1nc(O)c(-c2nnc(CCc3nc(no3)-c3ccc(OC)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.36,-5.49,;-6.03,-6.26,;-4.7,-5.49,;-3.36,-6.26,;-2.03,-5.49,;-2.03,-3.95,;-.69,-3.18,;-.69,-1.64,;.64,-3.95,;1.97,-3.18,;3.38,-3.81,;4.41,-2.66,;3.64,-1.33,;4.04,.16,;5.53,.56,;5.92,2.04,;4.96,3.24,;5.79,4.53,;7.28,4.13,;7.36,2.6,;5.4,6.02,;6.48,7.11,;6.09,8.6,;4.6,9,;4.2,10.48,;2.71,10.88,;3.51,7.91,;3.91,6.42,;2.13,-1.65,;.64,-5.49,;1.97,-6.26,;-.69,-6.26,;-.69,-7.8,;.64,-8.57,;1.97,-7.8,;3.31,-8.57,;.64,-10.11,;-.69,-10.88,;-2.03,-10.11,;-2.03,-8.57,;-3.36,-7.8,;-4.7,-8.57,)|

BDBM406468

CCCCc1nc(O)c(-c2nnc(o2)C2NCCc3ccccc23)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.62,;-6.6,-2.39,;-5.26,-1.62,;-3.93,-2.39,;-2.6,-1.62,;-2.6,-.08,;-1.26,.69,;-1.26,2.23,;.07,-.08,;1.4,.69,;2.81,.07,;3.84,1.21,;3.07,2.54,;1.56,2.22,;3.47,4.03,;2.38,5.12,;2.78,6.61,;4.27,7.01,;5.36,5.92,;6.84,6.32,;7.93,5.23,;7.53,3.74,;6.05,3.34,;4.96,4.43,;.07,-1.62,;1.4,-2.39,;-1.26,-2.39,;-1.26,-3.93,;.07,-4.7,;1.4,-3.93,;2.74,-4.7,;.07,-6.24,;-1.26,-7.01,;-2.6,-6.24,;-2.6,-4.7,;-3.93,-3.93,;-5.26,-4.7,)|

BDBM406469

CCCCc1nc(O)c(-c2nnc(o2)C(C)(C)c2ccc(Cl)c(Cl)c2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-2.02,;-7.34,-2.79,;-6.01,-2.02,;-4.68,-2.79,;-3.34,-2.02,;-3.34,-.48,;-2.01,.29,;-2.01,1.83,;-.67,-.48,;.66,.29,;2.07,-.33,;3.1,.81,;2.33,2.15,;.82,1.83,;2.73,3.63,;2.33,5.12,;1.24,4.03,;4.21,4.03,;5.3,2.94,;6.79,3.34,;7.19,4.83,;8.68,5.23,;6.1,5.92,;6.5,7.41,;4.61,5.52,;-.67,-2.02,;.66,-2.79,;-2.01,-2.79,;-2.01,-4.33,;-.67,-5.1,;.66,-4.33,;1.99,-5.1,;-.67,-6.64,;-2.01,-7.41,;-3.34,-6.64,;-3.34,-5.1,;-4.68,-4.33,;-6.01,-5.1,)|

BDBM406470

CCCCc1nc(O)c(-c2nnc(Cc3nnn(C)n3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.97,-1.61,;-6.64,-2.38,;-5.31,-1.61,;-3.97,-2.38,;-2.64,-1.61,;-2.64,-.07,;-1.31,.7,;-1.31,2.24,;.03,-.07,;1.36,.7,;2.77,.08,;3.8,1.22,;3.03,2.56,;3.43,4.04,;4.92,4.44,;6.11,3.47,;7.4,4.31,;7,5.8,;7.97,7,;5.47,5.88,;1.52,2.24,;.03,-1.61,;1.36,-2.38,;-1.31,-2.38,;-1.31,-3.92,;.03,-4.69,;1.36,-3.92,;2.7,-4.69,;.03,-6.23,;-1.31,-7,;-2.64,-6.23,;-2.64,-4.69,;-3.97,-3.92,;-5.31,-4.69,)|

BDBM406471

CCCCc1nc(O)c(-c2nnc(o2)C(C)(C)Cc2ccccc2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-2.56,;-6.25,-3.33,;-4.92,-2.56,;-3.59,-3.33,;-2.25,-2.56,;-2.25,-1.02,;-.92,-.25,;-.92,1.29,;.42,-1.02,;1.75,-.25,;3.16,-.88,;4.19,.27,;3.42,1.6,;1.91,1.28,;3.81,3.09,;3.42,4.58,;2.33,3.49,;5.3,3.49,;5.7,4.98,;7.19,5.37,;7.59,6.86,;6.5,7.95,;5.01,7.55,;4.61,6.06,;.42,-2.56,;1.75,-3.33,;-.92,-3.33,;-.92,-4.87,;.42,-5.64,;1.75,-4.87,;3.08,-5.64,;.42,-7.18,;-.92,-7.95,;-2.25,-7.18,;-2.25,-5.64,;-3.59,-4.87,;-4.92,-5.64,)|

BDBM406472

CCCCc1nc(O)c(-c2nnc(COc3ccc(cc3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-7.91,-3.85,;-6.57,-4.62,;-5.24,-3.85,;-3.91,-4.62,;-2.57,-3.85,;-2.57,-2.31,;-1.24,-1.54,;-1.24,0,;.09,-2.31,;1.43,-1.54,;2.83,-2.16,;3.86,-1.02,;3.09,.31,;3.49,1.8,;4.98,2.2,;5.38,3.69,;6.87,4.09,;7.27,5.57,;6.18,6.66,;4.69,6.26,;4.29,4.78,;6.57,8.15,;5.49,9.24,;7.91,8.92,;7.91,7.38,;1.59,-.01,;.09,-3.85,;1.43,-4.62,;-1.24,-4.62,;-1.24,-6.16,;.09,-6.93,;1.43,-6.16,;2.76,-6.93,;.09,-8.47,;-1.24,-9.24,;-2.57,-8.47,;-2.57,-6.93,;-3.91,-6.16,;-5.24,-6.93,)|

BDBM406473

CCCCc1nc(O)c(-c2nnc(Cc3nnc([nH]3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.69,-1.05,;-8.36,-1.82,;-7.02,-1.05,;-5.69,-1.82,;-4.35,-1.05,;-4.35,.49,;-3.02,1.26,;-3.02,2.8,;-1.69,.49,;-.35,1.26,;1.05,.64,;2.08,1.78,;1.31,3.11,;1.71,4.6,;3.2,5,;3.75,6.44,;5.29,6.36,;5.69,4.87,;4.4,4.03,;7.02,4.1,;7.02,2.56,;8.36,1.79,;9.69,2.56,;9.69,4.1,;8.36,4.87,;-.19,2.79,;-1.69,-1.05,;-.35,-1.82,;-3.02,-1.82,;-3.02,-3.36,;-1.69,-4.13,;-.35,-3.36,;.98,-4.13,;-1.69,-5.67,;-3.02,-6.44,;-4.35,-5.67,;-4.35,-4.13,;-5.69,-3.36,;-7.02,-4.13,)|

BDBM406474

CCCCc1nc(O)c(-c2nnc(CC3CCCCC3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;1.56,2.57,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406475

CCCCc1nc(O)c(-c2nnc(CCc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-3.3,;-6.25,-4.07,;-4.92,-3.3,;-3.59,-4.07,;-2.25,-3.3,;-2.25,-1.76,;-.92,-.99,;-.92,.55,;.42,-1.76,;1.75,-.99,;3.16,-1.62,;4.19,-.48,;3.42,.86,;3.81,2.35,;5.3,2.74,;5.7,4.23,;7.19,4.63,;7.59,6.12,;6.5,7.21,;6.9,8.69,;5.01,6.81,;4.61,5.32,;1.91,.54,;.42,-3.3,;1.75,-4.07,;-.92,-4.07,;-.92,-5.61,;.42,-6.38,;1.75,-5.61,;3.08,-6.38,;.42,-7.92,;-.92,-8.69,;-2.25,-7.92,;-2.25,-6.38,;-3.59,-5.61,;-4.92,-6.38,)|

BDBM406476

CCCCc1nc(O)c(-c2nnc(CC3CCOCC3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;1.56,2.57,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406477

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-2.02,;-7.34,-2.79,;-6.01,-2.02,;-4.67,-2.79,;-3.34,-2.02,;-3.34,-.48,;-2.01,.29,;-2.01,1.83,;-.67,-.48,;.66,.29,;2.07,-.33,;3.1,.81,;2.33,2.15,;2.73,3.63,;4.21,4.03,;5.3,2.94,;6.79,3.34,;7.19,4.83,;8.68,5.23,;6.1,5.92,;6.5,7.41,;4.61,5.52,;.82,1.83,;-.67,-2.02,;.66,-2.79,;-2.01,-2.79,;-2.01,-4.33,;-.67,-5.1,;.66,-4.33,;1.99,-5.1,;-.67,-6.64,;-2.01,-7.41,;-3.34,-6.64,;-3.34,-5.1,;-4.67,-4.33,;-6.01,-5.1,)|

BDBM406478

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)c(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;7.91,2.96,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406479

CCCCc1nc(O)c(-c2nnc(CCc3nccs3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.43,-2.32,;-6.09,-3.09,;-4.76,-2.32,;-3.43,-3.09,;-2.09,-2.32,;-2.09,-.78,;-.76,-.01,;-.76,1.53,;.57,-.78,;1.91,-.01,;3.31,-.63,;4.35,.51,;3.58,1.84,;3.97,3.33,;5.46,3.73,;5.86,5.22,;7.35,5.62,;7.43,7.15,;5.99,7.71,;5.02,6.51,;2.07,1.52,;.57,-2.32,;1.91,-3.09,;-.76,-3.09,;-.76,-4.63,;.57,-5.4,;1.91,-4.63,;3.24,-5.4,;.57,-6.94,;-.76,-7.71,;-2.09,-6.94,;-2.09,-5.4,;-3.43,-4.63,;-4.76,-5.4,)|

BDBM406480

CCCCc1nc(O)c(-c2nnc(Cc3cccc(c3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-2.76,;-7,-3.53,;-5.66,-2.76,;-4.33,-3.53,;-3,-2.76,;-3,-1.22,;-1.66,-.45,;-1.66,1.09,;-.33,-1.22,;1.01,-.45,;2.41,-1.08,;3.44,.07,;2.67,1.4,;3.07,2.89,;4.56,3.29,;5.65,2.2,;7.13,2.6,;7.53,4.09,;6.44,5.17,;4.96,4.78,;6.84,6.66,;7.24,8.15,;5.36,7.06,;8.33,6.26,;1.17,1.08,;-.33,-2.76,;1.01,-3.53,;-1.66,-3.53,;-1.66,-5.07,;-.33,-5.84,;1.01,-5.07,;2.34,-5.84,;-.33,-7.38,;-1.66,-8.15,;-3,-7.38,;-3,-5.84,;-4.33,-5.07,;-5.66,-5.84,)|

BDBM406481

CCCCc1nc(O)c(-c2nnc(CCc3ccc(F)c(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-3.3,;-6.25,-4.07,;-4.92,-3.3,;-3.59,-4.07,;-2.25,-3.3,;-2.25,-1.76,;-.92,-.99,;-.92,.55,;.42,-1.76,;1.75,-.99,;3.16,-1.62,;4.19,-.48,;3.42,.86,;3.81,2.35,;5.3,2.74,;5.7,4.23,;7.19,4.63,;7.59,6.12,;6.5,7.21,;6.9,8.69,;5.01,6.81,;3.92,7.9,;4.61,5.32,;1.91,.54,;.42,-3.3,;1.75,-4.07,;-.92,-4.07,;-.92,-5.61,;.42,-6.38,;1.75,-5.61,;3.08,-6.38,;.42,-7.92,;-.92,-8.69,;-2.25,-7.92,;-2.25,-6.38,;-3.59,-5.61,;-4.92,-6.38,)|

BDBM406482

CCCCc1nc(O)c(-c2nnc(CCc3ccc(cc3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-7.91,-3.85,;-6.57,-4.62,;-5.24,-3.85,;-3.91,-4.62,;-2.57,-3.85,;-2.57,-2.31,;-1.24,-1.54,;-1.24,0,;.09,-2.31,;1.43,-1.54,;2.83,-2.16,;3.86,-1.02,;3.09,.31,;3.49,1.8,;4.98,2.2,;5.38,3.69,;6.87,4.09,;7.27,5.57,;6.18,6.66,;4.69,6.26,;4.29,4.78,;6.57,8.15,;5.49,9.24,;7.91,8.92,;7.91,7.38,;1.59,-.01,;.09,-3.85,;1.43,-4.62,;-1.24,-4.62,;-1.24,-6.16,;.09,-6.93,;1.43,-6.16,;2.76,-6.93,;.09,-8.47,;-1.24,-9.24,;-2.57,-8.47,;-2.57,-6.93,;-3.91,-6.16,;-5.24,-6.93,)|

BDBM406483

CCCCc1nc(O)c(-c2nnc(COc3ccc(F)c(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-3.3,;-6.25,-4.07,;-4.92,-3.3,;-3.59,-4.07,;-2.25,-3.3,;-2.25,-1.76,;-.92,-.99,;-.92,.55,;.42,-1.76,;1.75,-.99,;3.16,-1.62,;4.19,-.48,;3.42,.86,;3.81,2.35,;5.3,2.74,;5.7,4.23,;7.19,4.63,;7.59,6.12,;6.5,7.21,;6.9,8.69,;5.01,6.81,;3.92,7.9,;4.61,5.32,;1.91,.54,;.42,-3.3,;1.75,-4.07,;-.92,-4.07,;-.92,-5.61,;.42,-6.38,;1.75,-5.61,;3.08,-6.38,;.42,-7.92,;-.92,-8.69,;-2.25,-7.92,;-2.25,-6.38,;-3.59,-5.61,;-4.92,-6.38,)|

BDBM406484

CCCCc1nc(O)c(-c2nnc(CCc3nc(no3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.43,-3.58,;-8.09,-4.35,;-6.76,-3.58,;-5.43,-4.35,;-4.09,-3.58,;-4.09,-2.04,;-2.76,-1.27,;-2.76,.27,;-1.43,-2.04,;-.09,-1.27,;1.31,-1.9,;2.34,-.75,;1.57,.58,;1.97,2.07,;3.46,2.47,;3.86,3.95,;5.35,4.35,;5.43,5.89,;3.99,6.44,;3.02,5.25,;6.76,6.66,;8.09,5.89,;9.43,6.66,;9.43,8.2,;8.09,8.97,;6.76,8.2,;.07,.26,;-1.43,-3.58,;-.09,-4.35,;-2.76,-4.35,;-2.76,-5.89,;-1.43,-6.66,;-.09,-5.89,;1.24,-6.66,;-1.43,-8.2,;-2.76,-8.97,;-4.09,-8.2,;-4.09,-6.66,;-5.43,-5.89,;-6.76,-6.66,)|

BDBM406485

CCCCc1nc(O)c(-c2nnc(Cc3cnn(c3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.68,-1.02,;-8.34,-1.79,;-7.01,-1.02,;-5.67,-1.79,;-4.34,-1.02,;-4.34,.53,;-3.01,1.3,;-3.01,2.83,;-1.67,.53,;-.34,1.3,;1.07,.67,;2.1,1.81,;1.33,3.15,;1.73,4.63,;3.21,5.03,;3.91,6.41,;5.43,6.16,;5.67,4.64,;4.3,3.94,;7.01,3.87,;7.01,2.33,;8.34,1.56,;9.68,2.33,;9.68,3.87,;8.34,4.64,;-.18,2.83,;-1.67,-1.02,;-.34,-1.79,;-3.01,-1.79,;-3.01,-3.32,;-1.67,-4.1,;-.34,-3.32,;.99,-4.1,;-1.67,-5.64,;-3.01,-6.41,;-4.34,-5.64,;-4.34,-4.1,;-5.67,-3.32,;-7.01,-4.1,)|

BDBM406486

CCCCc1nc(O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406487

CCCCc1nc(O)c(-c2nnc(Cc3ccc(cc3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-9.42,-1.67,;-8.09,-2.44,;-6.75,-1.67,;-5.42,-2.44,;-4.08,-1.67,;-4.08,-.13,;-2.75,.64,;-2.75,2.18,;-1.42,-.13,;-.08,.64,;1.32,.01,;2.35,1.16,;1.58,2.49,;1.98,3.98,;3.47,4.38,;4.56,3.29,;6.05,3.69,;6.44,5.17,;5.36,6.26,;3.87,5.86,;7.93,5.57,;9.42,5.97,;7.53,7.06,;8.33,4.09,;.08,2.17,;-1.42,-1.67,;-.08,-2.44,;-2.75,-2.44,;-2.75,-3.98,;-1.42,-4.75,;-.08,-3.98,;1.25,-4.75,;-1.42,-6.29,;-2.75,-7.06,;-4.08,-6.29,;-4.08,-4.75,;-5.42,-3.98,;-6.75,-4.75,)|

BDBM406488

CCCCc1nc(O)c(-c2nnc(CCc3ncccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.59,-2.56,;-6.25,-3.33,;-4.92,-2.56,;-3.59,-3.33,;-2.25,-2.56,;-2.25,-1.02,;-.92,-.25,;-.92,1.29,;.42,-1.02,;1.75,-.25,;3.16,-.88,;4.19,.27,;3.42,1.6,;3.81,3.09,;5.3,3.49,;5.7,4.98,;7.19,5.37,;7.59,6.86,;6.5,7.95,;5.01,7.55,;4.61,6.06,;1.91,1.28,;.42,-2.56,;1.75,-3.33,;-.92,-3.33,;-.92,-4.87,;.42,-5.64,;1.75,-4.87,;3.08,-5.64,;.42,-7.18,;-.92,-7.95,;-2.25,-7.18,;-2.25,-5.64,;-3.59,-4.87,;-4.92,-5.64,)|

BDBM406489

CCCCc1nc(O)c(-c2nnc(CCc3nc4ccccc4s3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.44,-3.83,;-6.11,-4.6,;-4.77,-3.83,;-3.44,-4.6,;-2.11,-3.83,;-2.11,-2.29,;-.77,-1.52,;-.77,.02,;.56,-2.29,;1.89,-1.52,;3.3,-2.15,;4.33,-1,;3.56,.33,;3.96,1.82,;5.45,2.22,;5.85,3.7,;7.36,3.97,;6.91,6.59,;7.44,8.04,;6.46,9.22,;4.94,8.96,;4.41,7.51,;5.39,6.33,;4.86,4.89,;2.06,.01,;.56,-3.83,;1.89,-4.6,;-.77,-4.6,;-.77,-6.14,;.56,-6.91,;1.89,-6.14,;3.23,-6.91,;.56,-8.45,;-.77,-9.22,;-2.11,-8.45,;-2.11,-6.91,;-3.44,-6.14,;-4.77,-6.91,)|

BDBM406490

CCCCc1nc(O)c(-c2nnc(CCc3nc(no3)-c3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.43,-4.55,;-6.09,-5.32,;-4.76,-4.55,;-3.43,-5.32,;-2.09,-4.55,;-2.09,-3.01,;-.76,-2.24,;-.76,-.7,;.57,-3.01,;1.91,-2.24,;3.31,-2.86,;4.35,-1.72,;3.58,-.39,;3.97,1.1,;5.46,1.5,;5.86,2.99,;5.02,4.28,;5.99,5.48,;7.43,4.92,;7.35,3.39,;5.59,6.96,;4.1,7.36,;3.71,8.85,;4.79,9.94,;6.28,9.54,;6.68,8.05,;2.07,-.71,;.57,-4.55,;1.91,-5.32,;-.76,-5.32,;-.76,-6.86,;.57,-7.63,;1.91,-6.86,;3.24,-7.63,;.57,-9.17,;-.76,-9.94,;-2.09,-9.17,;-2.09,-7.63,;-3.43,-6.86,;-4.76,-7.63,)|

BDBM406491

CCCCc1nc(O)c(-c2nnc(Cc3nc(sc3C)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.65,-1.69,;-8.31,-2.46,;-6.98,-1.69,;-5.65,-2.46,;-4.31,-1.69,;-4.31,-.15,;-2.98,.62,;-2.98,2.16,;-1.64,-.15,;-.31,.62,;1.1,-.01,;2.13,1.14,;1.36,2.47,;1.76,3.96,;3.24,4.36,;4.2,3.15,;5.65,3.7,;5.57,5.23,;4.09,5.64,;3.55,7.08,;6.98,2.93,;6.98,1.39,;8.31,.62,;9.65,1.39,;9.65,2.93,;8.31,3.7,;-.15,2.15,;-1.64,-1.69,;-.31,-2.46,;-2.98,-2.46,;-2.98,-4,;-1.64,-4.77,;-.31,-4,;1.02,-4.77,;-1.64,-6.31,;-2.98,-7.08,;-4.31,-6.31,;-4.31,-4.77,;-5.65,-4,;-6.98,-4.77,)|

BDBM406492

CCCCc1nc(O)c(-c2nnc(CCc3ccc(Cl)c(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-3.3,;-7,-4.07,;-5.66,-3.3,;-4.33,-4.07,;-3,-3.3,;-3,-1.76,;-1.66,-.99,;-1.66,.55,;-.33,-1.76,;1.01,-.99,;2.41,-1.62,;3.44,-.48,;2.67,.86,;3.07,2.35,;4.56,2.74,;4.96,4.23,;3.87,5.32,;4.27,6.81,;5.75,7.21,;6.15,8.69,;6.84,6.12,;8.33,6.52,;6.44,4.63,;1.17,.54,;-.33,-3.3,;1.01,-4.07,;-1.66,-4.07,;-1.66,-5.61,;-.33,-6.38,;1.01,-5.61,;2.34,-6.38,;-.33,-7.92,;-1.66,-8.69,;-3,-7.92,;-3,-6.38,;-4.33,-5.61,;-5.66,-6.38,)|

BDBM406493

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(Cl)cccc1Cl |(-8.42,-1.05,;-7.08,-1.82,;-5.75,-1.05,;-4.41,-1.82,;-3.08,-1.05,;-3.08,.49,;-1.75,1.26,;-1.75,2.8,;-.41,.49,;.92,1.26,;2.33,.64,;3.36,1.78,;2.59,3.11,;2.99,4.6,;4.47,5,;5.03,6.44,;6.56,6.36,;6.96,4.87,;8.33,4.17,;8.42,2.63,;7.12,1.79,;5.75,2.49,;5.67,4.03,;1.08,2.79,;-.41,-1.05,;.92,-1.82,;-1.75,-1.82,;-1.75,-3.36,;-.41,-4.13,;.92,-3.36,;-.41,-5.67,;-1.75,-6.44,;-3.08,-5.67,;-3.08,-4.13,;-4.41,-3.36,)|

BDBM406494

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(Cl)cccc1Cl |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.68,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;4.61,6.26,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.68,-3.58,)|

BDBM406495

CCCCc1nc(O)c(-c2nnc(o2)C(N(C)C)c2ccc(F)cc2)c(O)c1-c1c(OC)cccc1OC |(-6.99,-2.31,;-5.66,-3.08,;-4.32,-2.31,;-2.99,-3.08,;-1.65,-2.31,;-1.65,-.77,;-.32,0,;-.32,1.54,;1.01,-.77,;2.35,0,;3.75,-.62,;4.78,.52,;4.01,1.85,;2.51,1.53,;4.41,3.34,;5.9,3.74,;6.3,5.23,;6.99,2.65,;3.32,4.43,;3.72,5.92,;2.63,7.01,;1.15,6.61,;.06,7.7,;.75,5.12,;1.84,4.03,;1.01,-2.31,;2.35,-3.08,;-.32,-3.08,;-.32,-4.62,;1.01,-5.39,;2.35,-4.62,;3.68,-5.39,;1.01,-6.93,;-.32,-7.7,;-1.65,-6.93,;-1.65,-5.39,;-2.99,-4.62,;-4.32,-5.39,)|

BDBM406496

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.42,-1.05,;-7.08,-1.82,;-5.75,-1.05,;-4.41,-1.82,;-3.08,-1.05,;-3.08,.49,;-1.75,1.26,;-1.75,2.8,;-.41,.49,;.92,1.26,;2.33,.64,;3.36,1.78,;2.59,3.11,;2.99,4.6,;4.47,5,;5.03,6.44,;6.56,6.36,;6.96,4.87,;8.33,4.17,;8.42,2.63,;7.12,1.79,;5.75,2.49,;5.67,4.03,;1.08,2.79,;-.41,-1.05,;.92,-1.82,;-1.75,-1.82,;-1.75,-3.36,;-.41,-4.13,;.92,-3.36,;2.25,-4.13,;-.41,-5.67,;-1.75,-6.44,;-3.08,-5.67,;-3.08,-4.13,;-4.41,-3.36,;-5.75,-4.13,)|

BDBM406497

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.68,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;4.61,6.26,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.68,-3.58,;-6.01,-4.35,)|

BDBM406498

CCCCc1nc(O)c(-c2nnc(Cc3nc(oc3C)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.38,-2.73,;-8.05,-3.5,;-6.72,-2.73,;-5.38,-3.5,;-4.05,-2.73,;-4.05,-1.19,;-2.72,-.42,;-2.72,1.12,;-1.38,-1.19,;-.05,-.42,;1.36,-1.05,;2.39,.1,;1.62,1.43,;2.02,2.92,;3.5,3.32,;4.2,4.69,;5.72,4.46,;5.97,2.94,;4.6,2.23,;4.2,.74,;6.81,5.55,;8.3,5.15,;9.38,6.24,;8.99,7.72,;7.5,8.12,;6.41,7.03,;.11,1.11,;-1.38,-2.73,;-.05,-3.5,;-2.72,-3.5,;-2.72,-5.04,;-1.38,-5.81,;-.05,-5.04,;1.28,-5.81,;-1.38,-7.35,;-2.72,-8.12,;-4.05,-7.35,;-4.05,-5.81,;-5.38,-5.04,;-6.72,-5.81,)|

BDBM406499

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)nc1C1CC1 |(1.02,-4.13,;-.31,-3.36,;-1.64,-4.13,;-1.64,-5.67,;-2.98,-6.44,;-4.31,-5.67,;-4.31,-4.13,;-5.64,-3.36,;-6.98,-4.13,;-2.98,-3.36,;-2.98,-1.82,;-1.64,-1.05,;-.31,-1.82,;-1.64,.49,;-.31,1.26,;1.1,.64,;2.13,1.78,;1.36,3.11,;1.76,4.6,;3.24,5,;3.8,6.44,;5.33,6.36,;5.73,4.87,;7.1,4.17,;7.18,2.63,;5.89,1.79,;4.52,2.49,;4.44,4.03,;-.15,2.79,;-2.98,1.26,;-2.98,2.8,;-4.31,.49,;-4.31,-1.05,;-5.64,-1.82,;-6.41,-.48,;-7.18,-1.82,)|

BDBM406500

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)nc1C1CC1 |(.76,-4.35,;-.57,-3.58,;-1.9,-4.35,;-1.9,-5.89,;-3.24,-6.66,;-4.57,-5.89,;-4.57,-4.35,;-5.91,-3.58,;-7.24,-4.35,;-3.24,-3.58,;-3.24,-2.04,;-1.9,-1.27,;-.57,-2.04,;-1.9,.27,;-.57,1.04,;.84,.41,;1.87,1.56,;1.1,2.89,;1.5,4.38,;2.98,4.78,;4.07,3.69,;5.56,4.09,;5.96,5.57,;7.45,5.97,;4.87,6.66,;3.38,6.26,;-.41,2.57,;-3.24,1.04,;-3.24,2.58,;-4.57,.27,;-4.57,-1.27,;-5.91,-2.04,;-6.68,-.71,;-7.45,-2.04,)|

BDBM406501

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)nc1C1CC1 |(1.12,-4.07,;-.22,-3.3,;-1.55,-4.07,;-1.55,-5.61,;-2.89,-6.38,;-4.22,-5.61,;-4.22,-4.07,;-5.55,-3.3,;-6.89,-4.07,;-2.89,-3.3,;-2.89,-1.76,;-1.55,-.99,;-.22,-1.76,;-1.55,.55,;-.22,1.32,;1.19,.69,;2.22,1.84,;1.45,3.17,;1.85,4.66,;3.33,5.06,;4.12,6.38,;5.62,6.05,;5.77,4.51,;7.09,3.73,;4.35,3.9,;-.06,2.85,;-2.89,1.32,;-2.89,2.86,;-4.22,.55,;-4.22,-.99,;-5.55,-1.76,;-6.32,-.43,;-7.09,-1.76,)|

BDBM406502

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3nc(no3)-c3ccccn3)o2)c(O)nc1C1CC1 |(-.23,-4.08,;-1.56,-3.31,;-2.89,-4.08,;-2.89,-5.62,;-4.23,-6.39,;-5.56,-5.62,;-5.56,-4.08,;-6.9,-3.31,;-8.23,-4.08,;-4.23,-3.31,;-4.23,-1.77,;-2.89,-1,;-1.56,-1.77,;-2.89,.54,;-1.56,1.31,;-.15,.69,;.88,1.83,;.11,3.16,;.51,4.65,;1.99,5.05,;3.03,3.91,;4.43,4.55,;4.26,6.08,;2.75,6.39,;5.77,3.78,;7.1,4.55,;8.44,3.78,;8.44,2.24,;7.1,1.47,;5.77,2.24,;-1.4,2.84,;-4.23,1.31,;-4.23,2.85,;-5.56,.54,;-5.56,-1,;-6.9,-1.77,;-7.67,-.43,;-8.44,-1.77,)|

BDBM406503

CCCCc1nc(O)c(-c2nnc(CC(=O)OCC)o2)c(O)c1-c1c(OC)cccc1OC |(-8.2,-.72,;-6.86,-1.49,;-5.53,-.72,;-4.2,-1.49,;-2.86,-.72,;-2.86,.82,;-1.53,1.59,;-1.53,3.13,;-.19,.82,;1.14,1.59,;2.55,.96,;3.58,2.11,;2.81,3.44,;3.58,4.78,;5.12,4.78,;5.89,6.11,;5.89,3.44,;7.43,3.44,;8.2,4.78,;1.3,3.12,;-.19,-.72,;1.14,-1.49,;-1.53,-1.49,;-1.53,-3.03,;-.19,-3.8,;1.14,-3.03,;2.47,-3.8,;-.19,-5.34,;-1.53,-6.11,;-2.86,-5.34,;-2.86,-3.8,;-4.2,-3.03,;-5.53,-3.8,)|

BDBM406504

CCCCc1nc(O)c(-c2nnc(CN3C(=O)CN(C)C3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-8.15,-1.7,;-6.81,-2.47,;-5.48,-1.7,;-4.15,-2.47,;-2.81,-1.7,;-2.81,-.16,;-1.48,.61,;-1.48,2.15,;-.15,-.16,;1.19,.61,;2.6,-.02,;3.63,1.13,;2.86,2.46,;3.25,3.95,;4.74,4.35,;5.78,3.21,;5.47,1.7,;7.18,3.85,;7.01,5.38,;8.15,6.42,;5.5,5.69,;4.86,7.09,;1.35,2.14,;-.15,-1.7,;1.19,-2.47,;-1.48,-2.47,;-1.48,-4.01,;-.15,-4.78,;1.19,-4.01,;2.52,-4.78,;-.15,-6.32,;-1.48,-7.09,;-2.81,-6.32,;-2.81,-4.78,;-4.15,-4.01,;-5.48,-4.78,)|

BDBM406505

CCCCc1nc(O)c(-c2nnc(Cc3cccc(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-2.02,;-6.6,-2.79,;-5.26,-2.02,;-3.93,-2.79,;-2.6,-2.02,;-2.6,-.48,;-1.26,.29,;-1.26,1.83,;.07,-.48,;1.4,.29,;2.81,-.33,;3.84,.81,;3.07,2.15,;3.47,3.63,;4.96,4.03,;6.05,2.94,;7.53,3.34,;7.93,4.83,;6.84,5.92,;7.24,7.41,;5.36,5.52,;1.56,1.83,;.07,-2.02,;1.4,-2.79,;-1.26,-2.79,;-1.26,-4.33,;.07,-5.1,;1.4,-4.33,;2.74,-5.1,;.07,-6.64,;-1.26,-7.41,;-2.6,-6.64,;-2.6,-5.1,;-3.93,-4.33,;-5.26,-5.1,)|

BDBM406506

CCCCc1nc(O)c(-c2nnc(CN3CCCCC3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.27,;-6.6,-2.04,;-5.26,-1.27,;-3.93,-2.04,;-2.6,-1.27,;-2.6,.27,;-1.26,1.04,;-1.26,2.58,;.07,.27,;1.4,1.04,;2.81,.41,;3.84,1.56,;3.07,2.89,;3.47,4.38,;4.96,4.78,;6.05,3.69,;7.53,4.09,;7.93,5.57,;6.84,6.66,;5.36,6.26,;1.56,2.57,;.07,-1.27,;1.4,-2.04,;-1.26,-2.04,;-1.26,-3.58,;.07,-4.35,;1.4,-3.58,;2.74,-4.35,;.07,-5.89,;-1.26,-6.66,;-2.6,-5.89,;-2.6,-4.35,;-3.93,-3.58,;-5.26,-4.35,)|

BDBM406507

CCCCc1nc(O)c(-c2nnc(Cc3nc(no3)-c3cccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.67,-1,;-8.33,-1.77,;-7,-1,;-5.66,-1.77,;-4.33,-1,;-4.33,.54,;-3,1.31,;-3,2.85,;-1.66,.54,;-.33,1.31,;1.08,.68,;2.11,1.83,;1.34,3.16,;1.74,4.65,;3.22,5.05,;4.26,3.91,;5.66,4.55,;5.49,6.08,;3.98,6.39,;7,3.78,;8.33,4.55,;9.67,3.78,;9.67,2.24,;8.33,1.47,;7,2.24,;-.17,2.84,;-1.66,-1,;-.33,-1.77,;-3,-1.77,;-3,-3.31,;-1.66,-4.08,;-.33,-3.31,;1,-4.08,;-1.66,-5.62,;-3,-6.39,;-4.33,-5.62,;-4.33,-4.08,;-5.66,-3.31,;-7,-4.08,)|

BDBM406508

CCCCc1nc(O)c(-c2nnc(Cc3cnn(C)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-1,;-7,-1.77,;-5.67,-1,;-4.33,-1.77,;-3,-1,;-3,.54,;-1.67,1.31,;-1.67,2.85,;-.33,.54,;1,1.31,;2.41,.69,;3.44,1.83,;2.67,3.16,;3.07,4.65,;4.55,5.05,;5.31,6.39,;6.82,6.08,;7,4.55,;8.33,3.79,;5.59,3.91,;1.16,2.84,;-.33,-1,;1,-1.77,;-1.67,-1.77,;-1.67,-3.31,;-.33,-4.08,;1,-3.31,;2.33,-4.08,;-.33,-5.62,;-1.67,-6.39,;-3,-5.62,;-3,-4.08,;-4.33,-3.31,;-5.67,-4.08,)|

BDBM406509

CCCCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.62,;-7.34,-2.39,;-6.01,-1.62,;-4.67,-2.39,;-3.34,-1.62,;-3.34,-.08,;-2.01,.69,;-2.01,2.23,;-.67,-.08,;.66,.69,;2.07,.07,;3.1,1.21,;2.33,2.54,;2.73,4.03,;4.21,4.43,;5.3,3.34,;6.79,3.74,;7.19,5.23,;8.68,5.63,;6.1,6.32,;4.61,5.92,;3.52,7.01,;.82,2.22,;-.67,-1.62,;.66,-2.39,;-2.01,-2.39,;-2.01,-3.93,;-.67,-4.7,;.66,-3.93,;1.99,-4.7,;-.67,-6.24,;-2.01,-7.01,;-3.34,-6.24,;-3.34,-4.7,;-4.67,-3.93,;-6.01,-4.7,)|

BDBM406510

CCCCc1nc(O)c(-c2nnc(Cc3nc(no3)-c3ccncc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.67,-1,;-8.33,-1.77,;-7,-1,;-5.66,-1.77,;-4.33,-1,;-4.33,.54,;-3,1.31,;-3,2.85,;-1.66,.54,;-.33,1.31,;1.08,.69,;2.11,1.83,;1.34,3.16,;1.74,4.65,;3.22,5.05,;4.26,3.91,;5.66,4.55,;5.49,6.08,;3.98,6.39,;7,3.78,;7,2.24,;8.33,1.47,;9.67,2.24,;9.67,3.78,;8.33,4.55,;-.17,2.84,;-1.66,-1,;-.33,-1.77,;-3,-1.77,;-3,-3.31,;-1.66,-4.08,;-.33,-3.31,;1,-4.08,;-1.66,-5.62,;-3,-6.39,;-4.33,-5.62,;-4.33,-4.08,;-5.66,-3.31,;-7,-4.08,)|

BDBM406511

CCCCc1nc(O)c(-c2nnc(CN3CCCC3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.67,-1.7,;-6.33,-2.47,;-5,-1.7,;-3.66,-2.47,;-2.33,-1.7,;-2.33,-.16,;-1,.61,;-1,2.15,;.34,-.16,;1.67,.61,;3.08,-.02,;4.11,1.13,;3.34,2.46,;3.74,3.95,;5.22,4.35,;6.26,3.21,;7.67,3.85,;7.49,5.38,;5.98,5.69,;5.35,7.09,;1.83,2.14,;.34,-1.7,;1.67,-2.47,;-1,-2.47,;-1,-4.01,;.34,-4.78,;1.67,-4.01,;3,-4.78,;.34,-6.32,;-1,-7.09,;-2.33,-6.32,;-2.33,-4.78,;-3.66,-4.01,;-5,-4.78,)|

BDBM406512

CCOCc1nc(O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.33,-1,;-7,-1.77,;-5.67,-1,;-4.33,-1.77,;-3,-1,;-3,.54,;-1.67,1.31,;-1.67,2.85,;-.33,.54,;1,1.31,;2.41,.69,;3.44,1.83,;2.67,3.16,;3.07,4.65,;4.55,5.05,;5.31,6.39,;6.82,6.08,;7,4.55,;8.33,3.79,;5.59,3.91,;1.16,2.84,;-.33,-1,;1,-1.77,;-1.67,-1.77,;-1.67,-3.31,;-.33,-4.08,;1,-3.31,;2.33,-4.08,;-.33,-5.62,;-1.67,-6.39,;-3,-5.62,;-3,-4.08,;-4.33,-3.31,;-5.67,-4.08,)|

BDBM406513

CCOCc1nc(O)c(-c2nnc(Cc3noc(n3)-c3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.67,-1,;-8.33,-1.77,;-7,-1,;-5.66,-1.77,;-4.33,-1,;-4.33,.54,;-3,1.31,;-3,2.85,;-1.66,.54,;-.33,1.31,;1.08,.68,;2.11,1.83,;1.34,3.16,;1.74,4.65,;3.22,5.05,;3.98,6.39,;5.49,6.08,;5.66,4.55,;4.26,3.91,;7,3.78,;8.33,4.55,;9.67,3.78,;9.67,2.24,;8.33,1.47,;7,2.24,;-.17,2.84,;-1.66,-1,;-.33,-1.77,;-3,-1.77,;-3,-3.31,;-1.66,-4.08,;-.33,-3.31,;1,-4.08,;-1.66,-5.62,;-3,-6.39,;-4.33,-5.62,;-4.33,-4.08,;-5.66,-3.31,;-7,-4.08,)|

BDBM406514

CCCCc1nc(O)c(-c2nnc(Cc3nc(Cc4ccccc4)no3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.33,-1.23,;-9,-2,;-7.67,-1.23,;-6.33,-2,;-5,-1.23,;-5,.31,;-3.66,1.08,;-3.66,2.62,;-2.33,.31,;-1,1.08,;.41,.45,;1.44,1.59,;.67,2.93,;1.07,4.42,;2.56,4.81,;3.6,3.68,;5,4.31,;6.33,3.54,;7.67,4.31,;9,3.54,;10.33,4.31,;10.33,5.85,;9,6.62,;7.67,5.85,;4.83,5.84,;3.32,6.15,;-.84,2.61,;-2.33,-1.23,;-1,-2,;-3.66,-2,;-3.66,-3.54,;-2.33,-4.31,;-1,-3.54,;.34,-4.31,;-2.33,-5.85,;-3.66,-6.62,;-5,-5.85,;-5,-4.31,;-6.33,-3.54,;-7.67,-4.31,)|

BDBM406515

CCCCc1nc(O)c(-c2nnc(Cc3nc(no3)C3CC3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.1,-1,;-7.77,-1.77,;-6.43,-1,;-5.1,-1.77,;-3.77,-1,;-3.77,.54,;-2.43,1.31,;-2.43,2.85,;-1.1,.54,;.23,1.31,;1.64,.68,;2.67,1.83,;1.9,3.16,;2.3,4.65,;3.79,5.05,;4.83,3.91,;6.23,4.55,;6.06,6.08,;4.55,6.39,;7.56,3.78,;8.33,2.45,;9.1,3.78,;.39,2.84,;-1.1,-1,;.23,-1.77,;-2.43,-1.77,;-2.43,-3.31,;-1.1,-4.08,;.23,-3.31,;1.57,-4.08,;-1.1,-5.62,;-2.43,-6.39,;-3.77,-5.62,;-3.77,-4.08,;-5.1,-3.31,;-6.43,-4.08,)|

BDBM406516

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)nc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406517

CCCCc1nc(O)c(-c2nnc(Cc3nc(no3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.67,-1,;-8.33,-1.77,;-7,-1,;-5.66,-1.77,;-4.33,-1,;-4.33,.54,;-3,1.31,;-3,2.85,;-1.66,.54,;-.33,1.31,;1.08,.69,;2.11,1.83,;1.34,3.16,;1.74,4.65,;3.22,5.05,;4.26,3.91,;5.66,4.55,;5.49,6.08,;3.98,6.39,;7,3.78,;7,2.24,;8.33,1.47,;9.67,2.24,;9.67,3.78,;8.33,4.55,;-.17,2.84,;-1.66,-1,;-.33,-1.77,;-3,-1.77,;-3,-3.31,;-1.66,-4.08,;-.33,-3.31,;1,-4.08,;-1.66,-5.62,;-3,-6.39,;-4.33,-5.62,;-4.33,-4.08,;-5.66,-3.31,;-7,-4.08,)|

BDBM406518

CCCCc1nc(O)c(-c2nnc(CN3C(=O)CCC3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.67,-1.67,;-6.33,-2.44,;-5,-1.67,;-3.66,-2.44,;-2.33,-1.67,;-2.33,-.13,;-1,.64,;-1,2.18,;.34,-.13,;1.67,.64,;3.08,.02,;4.11,1.16,;3.34,2.5,;3.74,3.98,;5.22,4.38,;5.98,5.72,;5.21,7.06,;7.49,5.41,;7.67,3.88,;6.26,3.25,;5.95,1.74,;1.83,2.18,;.34,-1.67,;1.67,-2.44,;-1,-2.44,;-1,-3.98,;.34,-4.75,;1.67,-3.98,;3,-4.75,;.34,-6.29,;-1,-7.06,;-2.33,-6.29,;-2.33,-4.75,;-3.66,-3.98,;-5,-4.75,)|

BDBM406519

CCCCc1nc(O)c(-c2nnc(CN3C(=O)CNC3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.67,-1.7,;-6.33,-2.47,;-5,-1.7,;-3.66,-2.47,;-2.33,-1.7,;-2.33,-.16,;-1,.61,;-1,2.15,;.34,-.16,;1.67,.61,;3.08,-.02,;4.11,1.13,;3.34,2.46,;3.74,3.95,;5.22,4.35,;6.26,3.21,;5.95,1.7,;7.67,3.85,;7.49,5.38,;5.98,5.69,;5.35,7.09,;1.83,2.14,;.34,-1.7,;1.67,-2.47,;-1,-2.47,;-1,-4.01,;.34,-4.78,;1.67,-4.01,;3,-4.78,;.34,-6.32,;-1,-7.09,;-2.33,-6.32,;-2.33,-4.78,;-3.66,-4.01,;-5,-4.78,)|

BDBM406520

CCCCc1nc(O)c(-c2nnc(Cn3ccccc3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.62,;-6.6,-2.39,;-5.26,-1.62,;-3.93,-2.39,;-2.6,-1.62,;-2.6,-.08,;-1.26,.69,;-1.26,2.23,;.07,-.08,;1.4,.69,;2.81,.07,;3.84,1.21,;3.07,2.54,;3.47,4.03,;4.96,4.43,;6.05,3.34,;7.53,3.74,;7.93,5.23,;6.84,6.32,;5.36,5.92,;4.27,7.01,;1.56,2.22,;.07,-1.62,;1.4,-2.39,;-1.26,-2.39,;-1.26,-3.93,;.07,-4.7,;1.4,-3.93,;2.74,-4.7,;.07,-6.24,;-1.26,-7.01,;-2.6,-6.24,;-2.6,-4.7,;-3.93,-3.93,;-5.26,-4.7,)|

BDBM406521

CCCCc1nc(O)c(-c2nnc(Cn3ccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.67,-1,;-6.33,-1.77,;-5,-1,;-3.66,-1.77,;-2.33,-1,;-2.33,.54,;-1,1.31,;-1,2.85,;.34,.54,;1.67,1.31,;3.08,.69,;4.11,1.83,;3.34,3.16,;3.74,4.65,;5.22,5.05,;6.26,3.91,;7.67,4.55,;7.49,6.08,;5.98,6.39,;1.83,2.84,;.34,-1,;1.67,-1.77,;-1,-1.77,;-1,-3.31,;.34,-4.08,;1.67,-3.31,;3,-4.08,;.34,-5.62,;-1,-6.39,;-2.33,-5.62,;-2.33,-4.08,;-3.66,-3.31,;-5,-4.08,)|

BDBM406522

CCCCc1nc(O)c(-c2nnc(CN3CCOC3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.67,-1.7,;-6.33,-2.47,;-5,-1.7,;-3.66,-2.47,;-2.33,-1.7,;-2.33,-.16,;-1,.61,;-1,2.15,;.34,-.16,;1.67,.61,;3.08,-.02,;4.11,1.13,;3.34,2.46,;3.74,3.95,;5.22,4.35,;6.26,3.21,;7.67,3.85,;7.49,5.38,;5.98,5.69,;5.35,7.09,;1.83,2.14,;.34,-1.7,;1.67,-2.47,;-1,-2.47,;-1,-4.01,;.34,-4.78,;1.67,-4.01,;3,-4.78,;.34,-6.32,;-1,-7.09,;-2.33,-6.32,;-2.33,-4.78,;-3.66,-4.01,;-5,-4.78,)|

BDBM406523

CCCCc1nc(O)c(-c2nnc(CN3CCOCC3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.62,;-6.6,-2.39,;-5.26,-1.62,;-3.93,-2.39,;-2.6,-1.62,;-2.6,-.08,;-1.26,.69,;-1.26,2.23,;.07,-.08,;1.4,.69,;2.81,.07,;3.84,1.21,;3.07,2.54,;3.47,4.03,;4.96,4.43,;6.05,3.34,;7.53,3.74,;7.93,5.23,;6.84,6.32,;5.36,5.92,;4.27,7.01,;1.56,2.22,;.07,-1.62,;1.4,-2.39,;-1.26,-2.39,;-1.26,-3.93,;.07,-4.7,;1.4,-3.93,;2.74,-4.7,;.07,-6.24,;-1.26,-7.01,;-2.6,-6.24,;-2.6,-4.7,;-3.93,-3.93,;-5.26,-4.7,)|

BDBM406524

CCCCc1nc(O)c(-c2nnc(CC(=O)OC(C)(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-2.3,;-6.99,-2.7,;-5.9,-1.61,;-4.41,-2.01,;-3.32,-.92,;-3.72,.57,;-2.63,1.65,;-3.03,3.14,;-1.14,1.26,;-.06,2.35,;-.06,3.89,;1.41,4.36,;2.31,3.12,;3.85,3.12,;4.62,4.45,;3.85,5.78,;6.16,4.45,;6.93,3.12,;8.47,3.12,;7.7,4.45,;6.16,1.78,;1.41,1.87,;-.75,-.23,;.74,-.63,;-1.83,-1.32,;-1.44,-2.81,;-2.52,-3.9,;-4.01,-3.5,;-5.1,-4.59,;-2.13,-5.38,;-.64,-5.78,;.45,-4.69,;.05,-3.21,;1.14,-2.12,;2.63,-2.52,)|

BDBM406525

CCOCc1nc(O)c(-c2nnc(Cn3ccccc3=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.93,-1.62,;-6.6,-2.39,;-5.26,-1.62,;-3.93,-2.39,;-2.6,-1.62,;-2.6,-.08,;-1.26,.69,;-1.26,2.23,;.07,-.08,;1.4,.69,;2.81,.07,;3.84,1.21,;3.07,2.54,;3.47,4.03,;4.96,4.43,;6.05,3.34,;7.53,3.74,;7.93,5.23,;6.84,6.32,;5.36,5.92,;4.27,7.01,;1.56,2.22,;.07,-1.62,;1.4,-2.39,;-1.26,-2.39,;-1.26,-3.93,;.07,-4.7,;1.4,-3.93,;2.74,-4.7,;.07,-6.24,;-1.26,-7.01,;-2.6,-6.24,;-2.6,-4.7,;-3.93,-3.93,;-5.26,-4.7,)|

BDBM406526

CCCCc1nc(O)c(-c2nnc(CNC(=O)OC(C)(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-6.55,-4.3,;-5.06,-4.7,;-3.97,-3.61,;-2.49,-4.01,;-1.4,-2.92,;-1.8,-1.43,;-.71,-.35,;-1.11,1.14,;.78,-.74,;1.87,.34,;1.87,1.88,;3.33,2.36,;4.24,1.11,;5.78,1.11,;6.55,2.45,;5.78,3.78,;4.24,3.78,;6.55,5.12,;5.78,6.45,;6.55,7.78,;4.24,6.45,;5.01,7.78,;3.33,-.13,;1.18,-2.23,;2.67,-2.63,;.09,-3.32,;.49,-4.81,;-.6,-5.9,;-2.09,-5.5,;-3.18,-6.59,;-.2,-7.38,;1.29,-7.78,;2.38,-6.69,;1.98,-5.21,;3.07,-4.12,;4.55,-4.52,)|

BDBM406527

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)OC(C)(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-9.61,.61,;-8.27,-.16,;-6.94,.61,;-5.6,-.16,;-4.27,.61,;-4.27,2.15,;-2.94,2.92,;-2.94,4.46,;-1.6,2.15,;-.27,2.92,;-.11,4.46,;1.4,4.78,;2.17,3.44,;3.66,3.04,;4.05,1.56,;2.97,.47,;5.54,1.16,;5.94,-.33,;6.63,2.25,;8.12,1.85,;9.21,2.94,;8.52,.36,;9.61,1.45,;1.14,2.3,;-1.6,.61,;-.27,-.16,;-2.94,-.16,;-2.94,-1.7,;-1.6,-2.47,;-.27,-1.7,;1.06,-2.47,;-1.6,-4.01,;-2.94,-4.78,;-4.27,-4.01,;-4.27,-2.47,;-5.6,-1.7,;-6.94,-2.47,)|

BDBM406528

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)c(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.68,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;7.88,3,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.68,-3.58,;-6.01,-4.35,)|

BDBM406529

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.62,;-7.34,-2.39,;-6.01,-1.62,;-4.67,-2.39,;-3.34,-1.62,;-3.34,-.08,;-2.01,.69,;-2.01,2.23,;-.67,-.08,;.66,.69,;2.07,.07,;3.1,1.21,;2.33,2.54,;2.73,4.03,;4.21,4.43,;5.3,3.34,;6.79,3.74,;7.19,5.23,;8.68,5.63,;6.1,6.32,;4.61,5.92,;3.52,7.01,;.82,2.22,;-.67,-1.62,;.66,-2.39,;-2.01,-2.39,;-2.01,-3.93,;-.67,-4.7,;.66,-3.93,;1.99,-4.7,;-.67,-6.24,;-2.01,-7.01,;-3.34,-6.24,;-3.34,-4.7,;-4.67,-3.93,;-6.01,-4.7,)|

BDBM406530

CCOCc1nc(O)c(-c2nnc(Cc3ccc(F)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406531

CCOCc1nc(O)c(-c2nnc(Cn3ccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.67,-1,;-6.33,-1.77,;-5,-1,;-3.66,-1.77,;-2.33,-1,;-2.33,.54,;-1,1.31,;-1,2.85,;.34,.54,;1.67,1.31,;3.08,.69,;4.11,1.83,;3.34,3.16,;3.74,4.65,;5.22,5.05,;5.98,6.39,;7.49,6.08,;7.67,4.55,;6.26,3.91,;1.83,2.84,;.34,-1,;1.67,-1.77,;-1,-1.77,;-1,-3.31,;.34,-4.08,;1.67,-3.31,;3,-4.08,;.34,-5.62,;-1,-6.39,;-2.33,-5.62,;-2.33,-4.08,;-3.66,-3.31,;-5,-4.08,)|

BDBM406532

CCOCc1nc(O)c(-c2nnc(Cc3ccc(C)c(F)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;7.88,3,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406533

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406534

CCOCc1nc(O)c(-c2nnc(Cn3ccc(n3)-c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.67,-1,;-8.33,-1.77,;-7,-1,;-5.66,-1.77,;-4.33,-1,;-4.33,.54,;-3,1.31,;-3,2.85,;-1.66,.54,;-.33,1.31,;1.08,.68,;2.11,1.83,;1.34,3.16,;1.74,4.65,;3.22,5.05,;3.98,6.39,;5.49,6.08,;5.66,4.55,;4.26,3.91,;7,3.78,;7,2.24,;8.33,1.47,;9.67,2.24,;9.67,3.78,;8.33,4.55,;-.17,2.84,;-1.66,-1,;-.33,-1.77,;-3,-1.77,;-3,-3.31,;-1.66,-4.08,;-.33,-3.31,;1,-4.08,;-1.66,-5.62,;-3,-6.39,;-4.33,-5.62,;-4.33,-4.08,;-5.66,-3.31,;-7,-4.08,)|

BDBM406535

CCOCc1nc(O)c(-c2nnc(Cn3ccc(n3)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-9,-1,;-7.67,-1.77,;-6.33,-1,;-5,-1.77,;-3.66,-1,;-3.66,.54,;-2.33,1.31,;-2.33,2.85,;-1,.54,;.34,1.31,;1.74,.68,;2.77,1.83,;2,3.16,;2.4,4.65,;3.89,5.05,;4.65,6.39,;6.16,6.08,;6.33,4.55,;4.93,3.91,;7.67,3.78,;9,3.01,;8.44,5.11,;6.9,2.45,;.5,2.84,;-1,-1,;.34,-1.77,;-2.33,-1.77,;-2.33,-3.31,;-1,-4.08,;.34,-3.31,;1.67,-4.08,;-1,-5.62,;-2.33,-6.39,;-3.66,-5.62,;-3.66,-4.08,;-5,-3.31,;-6.33,-4.08,)|

BDBM406536

CCOCc1nc(O)c(-c2nnc(Cc3cnn(C)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.15,-1.36,;-6.81,-2.13,;-5.48,-1.36,;-4.15,-2.13,;-2.81,-1.36,;-2.81,.18,;-1.48,.95,;-1.48,2.49,;-.15,.18,;1.19,.95,;2.6,.32,;3.63,1.46,;2.86,2.8,;3.25,4.29,;4.74,4.68,;5.78,3.55,;7.18,4.18,;7.01,5.71,;8.15,6.75,;5.5,6.02,;1.35,2.48,;-.15,-1.36,;1.19,-2.13,;-1.48,-2.13,;-1.48,-3.67,;-.15,-4.44,;1.19,-3.67,;2.52,-4.44,;-.15,-5.98,;-1.48,-6.75,;-2.81,-5.98,;-2.81,-4.44,;-4.15,-3.67,;-5.48,-4.44,)|

BDBM406537

CCOCc1nc(O)c(-c2nnc(Cc3ccc(F)nc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;4.61,6.26,;6.1,6.66,;7.19,5.57,;8.68,5.97,;6.79,4.09,;5.3,3.69,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406538

CCOCc1nc(O)c(-c2nnc(Cc3n[nH]c4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.29,-1,;-6.96,-1.77,;-5.62,-1,;-4.29,-1.77,;-2.96,-1,;-2.96,.54,;-1.62,1.31,;-1.62,2.85,;-.29,.54,;1.04,1.31,;2.45,.69,;3.48,1.83,;2.71,3.16,;3.11,4.65,;4.6,5.05,;5.36,6.39,;6.87,6.08,;7.04,4.55,;8.29,3.65,;8.14,2.12,;6.74,1.48,;5.49,2.38,;5.64,3.91,;1.21,2.84,;-.29,-1,;1.04,-1.77,;-1.62,-1.77,;-1.62,-3.31,;-.29,-4.08,;1.04,-3.31,;2.38,-4.08,;-.29,-5.62,;-1.62,-6.39,;-2.96,-5.62,;-2.96,-4.08,;-4.29,-3.31,;-5.62,-4.08,)|

BDBM406539

CCOCc1nc(O)c(-c2nnc(Cn3nnc4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.29,-1,;-6.96,-1.77,;-5.62,-1,;-4.29,-1.77,;-2.96,-1,;-2.96,.54,;-1.62,1.31,;-1.62,2.85,;-.29,.54,;1.04,1.31,;2.45,.69,;3.48,1.83,;2.71,3.16,;3.11,4.65,;4.6,5.05,;5.36,6.39,;6.87,6.08,;7.04,4.55,;8.29,3.65,;8.14,2.12,;6.74,1.48,;5.49,2.38,;5.64,3.91,;1.21,2.84,;-.29,-1,;1.04,-1.77,;-1.62,-1.77,;-1.62,-3.31,;-.29,-4.08,;1.04,-3.31,;2.38,-4.08,;-.29,-5.62,;-1.62,-6.39,;-2.96,-5.62,;-2.96,-4.08,;-4.29,-3.31,;-5.62,-4.08,)|

BDBM406540

CCOCc1nc(O)c(-c2nnc(Cn3ncc4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.29,-1,;-6.96,-1.77,;-5.62,-1,;-4.29,-1.77,;-2.96,-1,;-2.96,.54,;-1.62,1.31,;-1.62,2.85,;-.29,.54,;1.04,1.31,;2.45,.69,;3.48,1.83,;2.71,3.16,;3.11,4.65,;4.6,5.05,;5.36,6.39,;6.87,6.08,;7.04,4.55,;8.29,3.65,;8.14,2.12,;6.74,1.48,;5.49,2.38,;5.64,3.91,;1.21,2.84,;-.29,-1,;1.04,-1.77,;-1.62,-1.77,;-1.62,-3.31,;-.29,-4.08,;1.04,-3.31,;2.38,-4.08,;-.29,-5.62,;-1.62,-6.39,;-2.96,-5.62,;-2.96,-4.08,;-4.29,-3.31,;-5.62,-4.08,)|

BDBM406541

CCOCc1nc(O)c(-c2nnc(Cc3ccc(F)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.27,;-7.34,-2.04,;-6.01,-1.27,;-4.67,-2.04,;-3.34,-1.27,;-3.34,.27,;-2.01,1.04,;-2.01,2.58,;-.67,.27,;.66,1.04,;2.07,.41,;3.1,1.56,;2.33,2.89,;2.73,4.38,;4.21,4.78,;5.3,3.69,;6.79,4.09,;7.19,5.57,;8.68,5.97,;6.1,6.66,;4.61,6.26,;.82,2.57,;-.67,-1.27,;.66,-2.04,;-2.01,-2.04,;-2.01,-3.58,;-.67,-4.35,;.66,-3.58,;1.99,-4.35,;-.67,-5.89,;-2.01,-6.66,;-3.34,-5.89,;-3.34,-4.35,;-4.67,-3.58,;-6.01,-4.35,)|

BDBM406542

CCOCc1nc(O)c(-c2nnc(Cn3ccc4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.29,-1,;-6.96,-1.77,;-5.62,-1,;-4.29,-1.77,;-2.96,-1,;-2.96,.54,;-1.62,1.31,;-1.62,2.85,;-.29,.54,;1.04,1.31,;2.45,.69,;3.48,1.83,;2.71,3.16,;3.11,4.65,;4.6,5.05,;5.36,6.39,;6.87,6.08,;7.04,4.55,;8.29,3.65,;8.14,2.12,;6.74,1.48,;5.49,2.38,;5.64,3.91,;1.21,2.84,;-.29,-1,;1.04,-1.77,;-1.62,-1.77,;-1.62,-3.31,;-.29,-4.08,;1.04,-3.31,;2.38,-4.08,;-.29,-5.62,;-1.62,-6.39,;-2.96,-5.62,;-2.96,-4.08,;-4.29,-3.31,;-5.62,-4.08,)|

BDBM406543

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1ccccc1

BDBM406544

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(OC)c1

BDBM406545

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(CC)c1

BDBM406546

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(OC(F)(F)F)c1

BDBM406547

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(OCc2ccccc2)c1

BDBM406548

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(CO)c1

BDBM406549

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1C1=CCCCC1 |t:29|

BDBM406550

CCCCc1[nH]c(=O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1cccc(OC)c1

BDBM406551

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(c1)C(C)C

BDBM406552

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(COC)c1

BDBM406553

CCCCc1nc(O)c(-c2nnc(Cc3ccc(F)c(F)c3)o2)c(O)c1-c1cccc(c1)C(=O)NC(C)C

BDBM406554

CCCCc1[nH]c(=O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1cccc(CC)c1

BDBM406555

CCCCc1[nH]c(=O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1cccc(c1)C(=O)NC(C)C

BDBM406556

CCCCc1[nH]c(=O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1cccc(c1)C(C)C

BDBM406557

CCCCc1[nH]c(=O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1cccc(c1)C1CC1

BDBM406558

CCCCc1[nH]c(=O)c(-c2nnc(Cc3csc(C)n3)o2)c(O)c1-c1cccc(c1)N1CCCC1

BDBM406559

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)c3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.63,-3.64,;-8.14,-4.03,;-7.05,-2.95,;-5.57,-3.34,;-4.48,-2.26,;-4.88,-.77,;-3.79,.32,;-4.19,1.81,;-2.3,-.08,;-1.21,1.01,;-1.21,2.55,;.25,3.03,;1.16,1.78,;2.7,1.78,;3.47,3.12,;2.7,4.45,;5.01,3.12,;5.78,1.78,;5.78,4.45,;5.01,5.78,;5.78,7.12,;7.32,7.12,;8.09,5.78,;9.63,5.78,;7.32,4.45,;.25,.54,;-1.9,-1.56,;-.41,-1.96,;-2.99,-2.65,;-2.59,-4.14,;-3.68,-5.23,;-5.17,-4.83,;-6.26,-5.92,;-3.28,-6.72,;-1.79,-7.12,;-.7,-6.03,;-1.1,-4.54,;-.01,-3.45,;1.47,-3.85,)|

BDBM406560

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)c3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;3.47,4.45,;5.78,3.12,;6.55,1.78,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;6.55,7.12,;5.78,5.78,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406561

CCCCc1nc(O)c(-c2nnc(CNC(=O)COC)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.97,;-6.22,-3.37,;-5.13,-2.28,;-3.64,-2.68,;-2.55,-1.59,;-2.95,-.1,;-1.86,.99,;-2.26,2.48,;-.37,.59,;.71,1.68,;.71,3.22,;2.18,3.69,;3.08,2.45,;4.62,2.45,;5.39,3.78,;6.93,3.78,;7.7,2.45,;7.7,5.12,;6.93,6.45,;5.39,6.45,;2.18,1.2,;.02,-.9,;1.51,-1.3,;-1.06,-1.99,;-.67,-3.47,;-1.75,-4.56,;-3.24,-4.16,;-4.33,-5.25,;-1.36,-6.05,;.13,-6.45,;1.22,-5.36,;.82,-3.87,;1.91,-2.78,;3.4,-3.18,)|

BDBM406562

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)c3ccncc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;3.47,4.45,;5.78,3.12,;6.55,1.78,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;6.55,7.12,;5.78,5.78,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406563

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3cccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;5.78,3.12,;6.55,1.78,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;6.55,7.12,;5.78,5.78,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406564

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)c3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;3.47,4.45,;5.78,3.12,;6.55,1.78,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;6.55,7.12,;5.78,5.78,;4.24,5.78,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406565

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.63,-3.64,;-8.14,-4.03,;-7.05,-2.95,;-5.57,-3.34,;-4.48,-2.26,;-4.88,-.77,;-3.79,.32,;-4.18,1.81,;-2.3,-.08,;-1.21,1.01,;-1.21,2.55,;.25,3.03,;1.16,1.78,;2.7,1.78,;3.47,3.12,;5.01,3.12,;5.78,1.78,;5.78,4.45,;5.01,5.78,;5.78,7.12,;7.32,7.12,;8.09,5.78,;9.63,5.78,;7.32,4.45,;.25,.54,;-1.9,-1.56,;-.41,-1.96,;-2.99,-2.65,;-2.59,-4.14,;-3.68,-5.23,;-5.17,-4.83,;-6.26,-5.92,;-3.28,-6.72,;-1.79,-7.12,;-.7,-6.03,;-1.1,-4.54,;-.01,-3.45,;1.47,-3.85,)|

BDBM406566

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-4.3,;-7.37,-4.7,;-6.28,-3.61,;-4.8,-4.01,;-3.71,-2.92,;-4.11,-1.43,;-3.02,-.35,;-3.42,1.14,;-1.53,-.74,;-.44,.34,;-.44,1.88,;1.02,2.36,;1.93,1.11,;3.47,1.11,;4.24,2.45,;5.78,2.45,;6.55,1.11,;6.55,3.78,;8.09,3.78,;8.86,5.12,;8.09,6.45,;8.86,7.78,;6.55,6.45,;5.78,5.12,;1.02,-.13,;-1.13,-2.23,;.36,-2.63,;-2.22,-3.32,;-1.82,-4.81,;-2.91,-5.9,;-4.4,-5.5,;-5.49,-6.59,;-2.51,-7.38,;-1.02,-7.78,;.07,-6.69,;-.33,-5.21,;.76,-4.12,;2.24,-4.52,)|

BDBM406567

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccncc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;5.78,3.12,;6.55,1.78,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;6.55,7.12,;5.78,5.78,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406568

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)c3cccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;3.47,4.45,;5.78,3.12,;6.55,1.78,;6.55,4.45,;5.78,5.78,;6.55,7.12,;8.09,7.12,;8.86,5.78,;8.09,4.45,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406569

CCCCc1nc(O)c(-c2nnc(CNC(=O)Cc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-4.3,;-6.22,-4.7,;-5.13,-3.61,;-3.64,-4.01,;-2.55,-2.92,;-2.95,-1.43,;-1.86,-.35,;-2.26,1.14,;-.37,-.74,;.71,.34,;.71,1.88,;2.18,2.36,;3.08,1.11,;4.62,1.11,;5.39,2.45,;6.93,2.45,;7.7,1.11,;7.7,3.78,;6.93,5.12,;7.7,6.45,;6.93,7.78,;5.39,7.78,;4.62,6.45,;5.39,5.12,;2.18,-.13,;.02,-2.23,;1.51,-2.63,;-1.06,-3.32,;-.67,-4.81,;-1.75,-5.9,;-3.24,-5.5,;-4.33,-6.59,;-1.36,-7.38,;.13,-7.78,;1.22,-6.69,;.82,-5.21,;1.91,-4.12,;3.4,-4.52,)|

BDBM406570

CCCCc1nc(O)c(-c2nnc(CNC(=O)C(C)(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-2.97,;-6.99,-3.37,;-5.9,-2.28,;-4.41,-2.68,;-3.32,-1.59,;-3.72,-.1,;-2.63,.99,;-3.03,2.48,;-1.14,.59,;-.06,1.68,;-.06,3.22,;1.41,3.69,;2.31,2.45,;3.85,2.45,;4.62,3.78,;6.16,3.78,;6.93,2.45,;6.93,5.12,;8.47,5.12,;6.16,6.45,;7.7,6.45,;1.41,1.2,;-.75,-.9,;.74,-1.3,;-1.83,-1.99,;-1.44,-3.47,;-2.52,-4.56,;-4.01,-4.16,;-5.1,-5.25,;-2.13,-6.05,;-.64,-6.45,;.45,-5.36,;.05,-3.87,;1.14,-2.78,;2.63,-3.18,)|

BDBM406571

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;5.78,3.12,;6.55,1.78,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;6.55,7.12,;5.78,5.78,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406572

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)C(C)(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-2.97,;-6.99,-3.37,;-5.9,-2.28,;-4.41,-2.68,;-3.32,-1.59,;-3.72,-.1,;-2.63,.99,;-3.03,2.48,;-1.14,.59,;-.06,1.68,;-.06,3.22,;1.41,3.69,;2.31,2.45,;3.85,2.45,;4.62,3.78,;3.85,5.12,;6.16,3.78,;6.93,2.45,;6.93,5.12,;8.47,5.12,;6.16,6.45,;7.7,6.45,;1.41,1.2,;-.75,-.9,;.74,-1.3,;-1.83,-1.99,;-1.44,-3.47,;-2.52,-4.56,;-4.01,-4.16,;-5.1,-5.25,;-2.13,-6.05,;-.64,-6.45,;.45,-5.36,;.05,-3.87,;1.14,-2.78,;2.63,-3.18,)|

BDBM406573

CCCCc1nc(O)c(-c2nnc(CN)o2)c(O)c1-c1c(OC)cccc1OC |(-6.55,-1.64,;-5.06,-2.03,;-3.97,-.95,;-2.49,-1.34,;-1.4,-.25,;-1.8,1.23,;-.71,2.32,;-1.11,3.81,;.78,1.92,;1.87,3.01,;1.87,4.55,;3.33,5.03,;4.24,3.78,;5.78,3.78,;6.55,5.12,;3.33,2.54,;1.18,.44,;2.67,.04,;.09,-.65,;.49,-2.14,;-.6,-3.23,;-2.09,-2.83,;-3.18,-3.92,;-.2,-4.72,;1.29,-5.12,;2.38,-4.03,;1.98,-2.54,;3.07,-1.45,;4.55,-1.85,)|

BDBM406574

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.75,-.7,;-8.42,-1.47,;-7.08,-.7,;-5.75,-1.47,;-4.42,-.7,;-4.42,.84,;-3.08,1.61,;-3.08,3.15,;-1.75,.84,;-.42,1.61,;-.25,3.14,;1.25,3.46,;2.02,2.13,;3.51,1.73,;4.6,2.82,;6.09,2.42,;6.48,.93,;7.17,3.51,;8.66,3.11,;9.75,4.2,;9.35,5.69,;7.87,6.09,;6.78,5,;.99,.99,;-1.75,-.7,;-.42,-1.47,;-3.08,-1.47,;-3.08,-3.01,;-4.42,-3.78,;-5.75,-3.01,;-7.08,-3.78,;-4.42,-5.32,;-3.08,-6.09,;-1.75,-5.32,;-1.75,-3.78,;-.42,-3.01,;.92,-3.78,)|

BDBM406575

CCCCc1nc(O)c(-c2nnc(CN(C)C(=O)c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.75,-.7,;-8.42,-1.47,;-7.08,-.7,;-5.75,-1.47,;-4.42,-.7,;-4.42,.84,;-3.08,1.61,;-3.08,3.15,;-1.75,.84,;-.42,1.61,;-.25,3.14,;1.25,3.46,;2.02,2.13,;3.51,1.73,;4.6,2.82,;4.2,4.31,;6.09,2.42,;6.48,.93,;7.17,3.51,;8.66,3.11,;9.75,4.2,;9.35,5.69,;7.87,6.09,;6.78,5,;.99,.99,;-1.75,-.7,;-.42,-1.47,;-3.08,-1.47,;-3.08,-3.01,;-4.42,-3.78,;-5.75,-3.01,;-7.08,-3.78,;-4.42,-5.32,;-3.08,-6.09,;-1.75,-5.32,;-1.75,-3.78,;-.42,-3.01,;.92,-3.78,)|

BDBM406576

CCOCc1nc(O)c(-c2nnc(CNC(=O)c3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.88,-2.22,;-7.54,-2.99,;-6.21,-2.22,;-4.87,-2.99,;-3.54,-2.22,;-3.54,-.67,;-2.21,.1,;-2.21,1.64,;-.87,-.67,;.46,.1,;1.87,-.53,;2.9,.61,;2.13,1.95,;2.53,3.43,;4.01,3.83,;4.41,5.32,;3.32,6.41,;5.9,5.72,;6.99,4.63,;8.48,5.03,;8.88,6.52,;7.79,7.61,;6.3,7.21,;.62,1.63,;-.87,-2.22,;.46,-2.99,;-2.21,-2.99,;-2.21,-4.53,;-.87,-5.3,;.46,-4.53,;1.79,-5.3,;-.87,-6.84,;-2.21,-7.61,;-3.54,-6.84,;-3.54,-5.3,;-4.87,-4.53,;-6.21,-5.3,)|

BDBM406577

CCCCc1nc(O)c(-c2nnc(CNC(=O)CC(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.68,-1.62,;-7.34,-2.39,;-6.01,-1.62,;-4.67,-2.39,;-3.34,-1.62,;-3.34,-.08,;-2.01,.69,;-2.01,2.23,;-.67,-.08,;.66,.69,;2.07,.07,;3.1,1.21,;2.33,2.54,;2.73,4.03,;4.21,4.43,;4.61,5.92,;3.52,7.01,;6.1,6.32,;7.19,5.23,;8.68,5.63,;6.79,3.74,;.82,2.22,;-.67,-1.62,;.66,-2.39,;-2.01,-2.39,;-2.01,-3.93,;-3.34,-4.7,;-4.67,-3.93,;-6.01,-4.7,;-3.34,-6.24,;-2.01,-7.01,;-.67,-6.24,;-.67,-4.7,;.66,-3.93,;1.99,-4.7,)|

BDBM406578

CCCCc1nc(O)c(-c2nnc(CNC(C)=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.39,-1.62,;-6.05,-2.39,;-4.72,-1.62,;-3.39,-2.39,;-2.05,-1.62,;-2.05,-.08,;-.72,.69,;-.72,2.23,;.61,-.08,;1.95,.69,;3.35,.07,;4.39,1.21,;3.62,2.54,;4.01,4.03,;5.5,4.43,;5.9,5.92,;7.39,6.32,;4.81,7.01,;2.11,2.22,;.61,-1.62,;1.95,-2.39,;-.72,-2.39,;-.72,-3.93,;-2.05,-4.7,;-3.39,-3.93,;-4.72,-4.7,;-2.05,-6.24,;-.72,-7.01,;.61,-6.24,;.61,-4.7,;1.95,-3.93,;3.28,-4.7,)|

BDBM406579

CCCCc1nc(O)c(-c2nnc(CNC(=O)C(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.13,-2.02,;-6.8,-2.79,;-5.46,-2.02,;-4.13,-2.79,;-2.8,-2.02,;-2.8,-.48,;-1.46,.29,;-1.46,1.83,;-.13,-.48,;1.2,.29,;2.61,-.33,;3.64,.81,;2.87,2.15,;3.27,3.63,;4.76,4.03,;5.16,5.52,;4.07,6.61,;6.64,5.92,;7.73,4.83,;7.04,7.41,;8.13,6.32,;1.37,1.83,;-.13,-2.02,;1.2,-2.79,;-1.46,-2.79,;-1.46,-4.33,;-2.8,-5.1,;-4.13,-4.33,;-5.46,-5.1,;-2.8,-6.64,;-1.46,-7.41,;-.13,-6.64,;-.13,-5.1,;1.2,-4.33,;2.54,-5.1,)|

BDBM406580

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.57,-1.07,;-8.23,-1.84,;-6.9,-1.07,;-5.56,-1.84,;-4.23,-1.07,;-4.23,.47,;-2.9,1.24,;-2.9,2.78,;-1.56,.47,;-.23,1.24,;1.18,.61,;2.21,1.76,;1.44,3.09,;1.84,4.58,;3.32,4.98,;3.72,6.46,;4.41,3.89,;5.9,4.28,;6.99,3.2,;6.59,1.71,;7.68,.62,;9.17,1.02,;9.57,2.51,;8.48,3.59,;-.07,2.77,;-1.56,-1.07,;-.23,-1.84,;-2.9,-1.84,;-2.9,-3.38,;-4.23,-4.15,;-5.56,-3.38,;-6.9,-4.15,;-4.23,-5.69,;-2.9,-6.46,;-1.56,-5.69,;-1.56,-4.15,;-.23,-3.38,;1.1,-4.15,)|

BDBM406581

CCCCc1nc(O)c(-c2nnc(CC(=O)NC)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,5.78,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406582

CCCCc1nc(O)c(-c2nnc(CC(N)=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.32,-2.3,;-5.83,-2.7,;-4.74,-1.61,;-3.26,-2.01,;-2.17,-.92,;-2.57,.57,;-1.48,1.65,;-1.88,3.14,;.01,1.26,;1.1,2.35,;1.1,3.89,;2.56,4.36,;3.47,3.12,;5.01,3.12,;5.78,4.45,;7.32,4.45,;5.01,5.78,;2.56,1.87,;.41,-.23,;1.9,-.63,;-.68,-1.32,;-.28,-2.81,;-1.37,-3.9,;-2.86,-3.5,;-3.95,-4.59,;-.97,-5.38,;.52,-5.78,;1.61,-4.69,;1.21,-3.21,;2.3,-2.12,;3.78,-2.52,)|

BDBM406583

CCCCc1nc(O)c(-c2nnc(CC(=O)NC(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-2.3,;-6.99,-2.7,;-5.9,-1.61,;-4.41,-2.01,;-3.32,-.92,;-3.72,.57,;-2.63,1.65,;-3.03,3.14,;-1.14,1.26,;-.06,2.35,;-.06,3.89,;1.41,4.36,;2.31,3.12,;3.85,3.12,;4.62,4.45,;3.85,5.78,;6.16,4.45,;6.93,3.12,;6.16,1.78,;8.47,3.12,;1.41,1.87,;-.75,-.23,;.74,-.63,;-1.83,-1.32,;-1.44,-2.81,;-2.52,-3.9,;-4.01,-3.5,;-5.1,-4.59,;-2.13,-5.38,;-.64,-5.78,;.45,-4.69,;.05,-3.21,;1.14,-2.12,;2.63,-2.52,)|

BDBM406584

CCCCc1nc(O)c(-c2nnc(CC(=O)N(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;7.7,5.78,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406585

CCCCc1nc(O)c(-c2nnc(CC(=O)Nc3ccc(OC)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.3,;-7.37,-2.7,;-6.28,-1.61,;-4.8,-2.01,;-3.71,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.53,1.26,;-.44,2.35,;-.44,3.89,;1.02,4.36,;1.93,3.12,;3.47,3.12,;4.24,4.45,;3.47,5.78,;5.78,4.45,;6.55,3.12,;5.78,1.78,;6.55,.45,;8.09,.45,;8.86,-.89,;8.09,-2.22,;8.86,1.78,;8.09,3.12,;1.02,1.87,;-1.13,-.23,;.36,-.63,;-2.22,-1.32,;-1.82,-2.81,;-2.91,-3.9,;-4.4,-3.5,;-5.49,-4.59,;-2.51,-5.38,;-1.02,-5.78,;.07,-4.69,;-.33,-3.21,;.76,-2.12,;2.24,-2.52,)|

BDBM406586

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CCNC(=O)C3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.87,-2.3,;-7.38,-2.7,;-6.29,-1.61,;-4.8,-2.01,;-3.72,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.54,1.26,;-.45,2.35,;-.45,3.89,;1.02,4.36,;1.92,3.12,;3.46,3.12,;4.23,4.45,;3.46,5.78,;5.77,4.45,;6.56,5.78,;8.1,5.78,;8.87,4.44,;8.1,3.11,;8.87,1.78,;6.56,3.11,;1.02,1.87,;-1.14,-.23,;.35,-.63,;-2.23,-1.32,;-1.83,-2.81,;-2.92,-3.9,;-4.41,-3.5,;-5.49,-4.59,;-2.52,-5.38,;-1.03,-5.78,;.06,-4.69,;-.34,-3.21,;.75,-2.12,;2.23,-2.52,)|

BDBM406587

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CCN(C)CC3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.63,-2.3,;-8.14,-2.7,;-7.05,-1.61,;-5.57,-2.01,;-4.48,-.92,;-4.88,.57,;-3.79,1.65,;-4.19,3.14,;-2.3,1.26,;-1.21,2.35,;-1.21,3.89,;.25,4.36,;1.16,3.12,;2.7,3.12,;3.47,4.45,;2.7,5.78,;5.01,4.45,;5.78,3.12,;7.32,3.12,;8.09,4.45,;9.63,4.45,;7.32,5.78,;5.78,5.78,;.25,1.87,;-1.9,-.23,;-.41,-.63,;-2.99,-1.32,;-2.59,-2.81,;-3.68,-3.9,;-5.17,-3.5,;-6.26,-4.59,;-3.28,-5.38,;-1.79,-5.78,;-.7,-4.69,;-1.1,-3.21,;-.01,-2.12,;1.47,-2.52,)|

BDBM406588

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.01,-2.3,;-8.53,-2.7,;-7.44,-1.61,;-5.95,-2.01,;-4.86,-.92,;-5.26,.57,;-4.17,1.65,;-4.57,3.14,;-2.68,1.26,;-1.6,2.35,;-1.6,3.89,;-.13,4.36,;.77,3.12,;2.31,3.12,;3.08,4.45,;2.31,5.78,;4.62,4.45,;5.39,3.12,;6.93,3.12,;7.7,1.78,;9.24,1.78,;10.01,3.12,;9.24,4.45,;7.7,4.45,;-.13,1.87,;-2.29,-.23,;-.8,-.63,;-3.37,-1.32,;-2.98,-2.81,;-4.06,-3.9,;-5.55,-3.5,;-6.64,-4.59,;-3.67,-5.38,;-2.18,-5.78,;-1.09,-4.69,;-1.49,-3.21,;-.4,-2.12,;1.09,-2.52,)|

BDBM406589

CCCCc1nc(O)c(-c2nnc(CC(=O)NCC)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-2.3,;-6.99,-2.7,;-5.9,-1.61,;-4.41,-2.01,;-3.32,-.92,;-3.72,.57,;-2.63,1.65,;-3.03,3.14,;-1.14,1.26,;-.06,2.35,;-.06,3.89,;1.41,4.36,;2.31,3.12,;3.85,3.12,;4.62,4.45,;3.85,5.78,;6.16,4.45,;6.93,5.78,;8.47,5.78,;1.41,1.87,;-.75,-.23,;.74,-.63,;-1.83,-1.32,;-1.44,-2.81,;-2.52,-3.9,;-4.01,-3.5,;-5.1,-4.59,;-2.13,-5.38,;-.64,-5.78,;.45,-4.69,;.05,-3.21,;1.14,-2.12,;2.63,-2.52,)|

BDBM406590

CCCCc1nc(O)c(-c2nnc(CC(=O)NC3CC3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.37,-3.07,;-6.88,-3.47,;-5.8,-2.38,;-4.31,-2.78,;-3.22,-1.69,;-3.62,-.2,;-2.53,.88,;-2.93,2.37,;-1.04,.49,;.05,1.58,;.05,3.12,;1.51,3.59,;2.42,2.35,;3.96,2.35,;4.73,3.68,;3.96,5.01,;6.27,3.68,;7.04,5.01,;8.37,5.78,;7.04,6.55,;1.51,1.1,;-.64,-1,;.85,-1.4,;-1.73,-2.09,;-1.33,-3.58,;-2.42,-4.67,;-3.91,-4.27,;-5,-5.36,;-2.02,-6.15,;-.54,-6.55,;.55,-5.46,;.15,-3.98,;1.24,-2.89,;2.73,-3.29,)|

BDBM406591

CCCCc1nc(O)c(-c2nnc(CC(=O)NCCC)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.97,;-7.37,-3.37,;-6.28,-2.28,;-4.8,-2.68,;-3.71,-1.59,;-4.11,-.1,;-3.02,.99,;-3.42,2.48,;-1.53,.59,;-.44,1.68,;-.44,3.22,;1.02,3.69,;1.93,2.45,;3.47,2.45,;4.24,3.78,;3.47,5.12,;5.78,3.78,;6.55,5.12,;8.09,5.12,;8.86,6.45,;1.02,1.2,;-1.13,-.9,;.36,-1.3,;-2.22,-1.99,;-1.82,-3.47,;-2.91,-4.56,;-4.4,-4.17,;-5.49,-5.25,;-2.51,-6.05,;-1.02,-6.45,;.07,-5.36,;-.33,-3.87,;.76,-2.78,;2.24,-3.18,)|

BDBM406592

CCCCc1nc(O)c(-c2nnc(CC(=O)NCCF)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.97,;-7.37,-3.37,;-6.28,-2.28,;-4.8,-2.68,;-3.71,-1.59,;-4.11,-.1,;-3.02,.99,;-3.42,2.48,;-1.53,.59,;-.44,1.68,;-.44,3.22,;1.02,3.69,;1.93,2.45,;3.47,2.45,;4.24,3.78,;3.47,5.12,;5.78,3.78,;6.55,5.12,;8.09,5.12,;8.86,6.45,;1.02,1.2,;-1.13,-.9,;.36,-1.3,;-2.22,-1.99,;-1.82,-3.47,;-2.91,-4.56,;-4.4,-4.17,;-5.49,-5.25,;-2.51,-6.05,;-1.02,-6.45,;.07,-5.36,;-.33,-3.87,;.76,-2.78,;2.24,-3.18,)|

BDBM406593

CCCCc1nc(O)c(-c2nnc(CC(=O)NCC(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.97,;-7.37,-3.37,;-6.28,-2.28,;-4.8,-2.68,;-3.71,-1.59,;-4.11,-.1,;-3.02,.99,;-3.42,2.48,;-1.53,.59,;-.44,1.68,;-.44,3.22,;1.02,3.69,;1.93,2.45,;3.47,2.45,;4.24,3.78,;3.47,5.12,;5.78,3.78,;6.55,5.12,;8.09,5.12,;8.86,6.45,;8.86,3.78,;1.02,1.2,;-1.13,-.9,;.36,-1.3,;-2.22,-1.99,;-1.82,-3.47,;-2.91,-4.56,;-4.4,-4.17,;-5.49,-5.25,;-2.51,-6.05,;-1.02,-6.45,;.07,-5.36,;-.33,-3.87,;.76,-2.78,;2.24,-3.18,)|

BDBM406594

CCCCc1nc(O)c(-c2nnc(CC(=O)NCC(F)(F)F)o2)c(O)c1-c1c(OC)cccc1OC |(-9.24,-2.97,;-7.76,-3.37,;-6.67,-2.28,;-5.18,-2.68,;-4.09,-1.59,;-4.49,-.1,;-3.4,.99,;-3.8,2.48,;-1.91,.59,;-.82,1.68,;-.82,3.22,;.64,3.69,;1.54,2.45,;3.08,2.45,;3.85,3.78,;3.08,5.12,;5.4,3.78,;6.17,5.12,;7.71,5.12,;8.48,6.45,;9.24,5.12,;8.48,3.78,;.64,1.2,;-1.52,-.9,;-.03,-1.3,;-2.6,-1.99,;-2.21,-3.47,;-3.29,-4.56,;-4.78,-4.16,;-5.87,-5.25,;-2.9,-6.05,;-1.41,-6.45,;-.32,-5.36,;-.72,-3.87,;.37,-2.78,;1.86,-3.18,)|

BDBM406595

CCCCc1nc(O)c(-c2nnc(CC(=O)NCCOC)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-3.64,;-7.37,-4.03,;-6.28,-2.95,;-4.8,-3.34,;-3.71,-2.26,;-4.11,-.77,;-3.02,.32,;-3.42,1.81,;-1.53,-.08,;-.44,1.01,;-.44,2.55,;1.02,3.03,;1.93,1.78,;3.47,1.78,;4.24,3.12,;3.47,4.45,;5.78,3.12,;6.55,4.45,;8.09,4.45,;8.86,5.78,;8.09,7.12,;1.02,.54,;-1.13,-1.56,;.36,-1.96,;-2.22,-2.65,;-1.82,-4.14,;-2.91,-5.23,;-4.4,-4.83,;-5.49,-5.92,;-2.51,-6.72,;-1.02,-7.12,;.07,-6.03,;-.33,-4.54,;.76,-3.45,;2.24,-3.85,)|

BDBM406596

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CCCC3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.5,-2.3,;-7.02,-2.7,;-5.93,-1.61,;-4.44,-2.01,;-3.35,-.92,;-3.75,.57,;-2.66,1.65,;-3.06,3.14,;-1.17,1.26,;-.08,2.35,;-.08,3.89,;1.38,4.36,;2.28,3.12,;3.82,3.12,;4.59,4.45,;3.82,5.78,;6.13,4.45,;7.04,3.2,;8.5,3.68,;8.5,5.22,;7.04,5.69,;1.38,1.87,;-.78,-.23,;.71,-.63,;-1.86,-1.32,;-1.47,-2.81,;-2.55,-3.9,;-4.04,-3.5,;-5.13,-4.59,;-2.16,-5.38,;-.67,-5.78,;.42,-4.69,;.02,-3.21,;1.11,-2.12,;2.6,-2.52,)|

BDBM406597

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CCCCC3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.87,-2.3,;-7.38,-2.7,;-6.29,-1.61,;-4.8,-2.01,;-3.72,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.54,1.26,;-.45,2.35,;-.45,3.89,;1.02,4.36,;1.92,3.12,;3.46,3.12,;4.23,4.45,;3.46,5.78,;5.77,4.45,;6.54,5.78,;8.08,5.78,;8.87,4.45,;8.1,3.12,;6.56,3.12,;1.02,1.87,;-1.14,-.23,;.35,-.63,;-2.23,-1.32,;-1.83,-2.81,;-2.92,-3.9,;-4.41,-3.5,;-5.49,-4.59,;-2.52,-5.38,;-1.03,-5.78,;.06,-4.69,;-.34,-3.21,;.75,-2.12,;2.23,-2.52,)|

BDBM406598

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CCOCC3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.87,-2.3,;-7.38,-2.7,;-6.29,-1.61,;-4.8,-2.01,;-3.72,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.54,1.26,;-.45,2.35,;-.45,3.89,;1.02,4.36,;1.92,3.12,;3.46,3.12,;4.23,4.45,;3.46,5.78,;5.77,4.45,;6.54,5.78,;8.08,5.78,;8.87,4.45,;8.1,3.12,;6.56,3.12,;1.02,1.87,;-1.14,-.23,;.35,-.63,;-2.23,-1.32,;-1.83,-2.81,;-2.92,-3.9,;-4.41,-3.5,;-5.49,-4.59,;-2.52,-5.38,;-1.03,-5.78,;.06,-4.69,;-.34,-3.21,;.75,-2.12,;2.23,-2.52,)|

BDBM406599

CCCCNC(=O)Cc1nnc(o1)-c1c(O)nc(CCCC)c(c1O)-c1c(OC)cccc1OC |(9.63,6.45,;8.09,6.45,;7.32,5.12,;5.78,5.12,;5.01,3.78,;3.47,3.78,;2.7,5.12,;2.7,2.45,;1.16,2.45,;.25,3.69,;-1.21,3.22,;-1.21,1.68,;.25,1.2,;-2.3,.59,;-3.79,.99,;-4.19,2.48,;-4.88,-.1,;-4.48,-1.59,;-5.57,-2.68,;-7.05,-2.28,;-8.14,-3.37,;-9.63,-2.97,;-2.99,-1.99,;-1.9,-.9,;-.41,-1.3,;-2.59,-3.47,;-3.68,-4.56,;-5.17,-4.16,;-6.26,-5.25,;-3.28,-6.05,;-1.79,-6.45,;-.7,-5.36,;-1.1,-3.87,;-.01,-2.78,;1.47,-3.18,)|

BDBM406600

CCCCCNC(=O)Cc1nnc(o1)-c1c(O)nc(CCCC)c(c1O)-c1c(OC)cccc1OC |(10.01,7.12,;9.24,5.78,;7.7,5.78,;6.93,4.45,;5.39,4.45,;4.62,3.12,;3.08,3.12,;2.31,4.45,;2.31,1.78,;.77,1.78,;-.13,3.03,;-1.6,2.55,;-1.6,1.01,;-.13,.54,;-2.68,-.08,;-4.17,.32,;-4.57,1.81,;-5.26,-.77,;-4.86,-2.26,;-5.95,-3.34,;-7.44,-2.95,;-8.53,-4.03,;-10.01,-3.64,;-3.37,-2.65,;-2.29,-1.56,;-.8,-1.96,;-2.98,-4.14,;-4.06,-5.23,;-5.55,-4.83,;-6.64,-5.92,;-3.67,-6.72,;-2.18,-7.12,;-1.09,-6.03,;-1.49,-4.54,;-.4,-3.45,;1.09,-3.85,)|

BDBM406601

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CC(F)C3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.18,-2.3,;-7.69,-2.7,;-6.6,-1.61,;-5.11,-2.01,;-4.03,-.92,;-4.42,.57,;-3.34,1.65,;-3.73,3.14,;-1.85,1.26,;-.76,2.35,;-.76,3.89,;.71,4.36,;1.61,3.12,;3.15,3.12,;3.92,4.45,;3.15,5.78,;5.46,4.45,;6.55,3.36,;7.64,4.45,;9.18,4.45,;6.55,5.54,;.71,1.87,;-1.45,-.23,;.04,-.63,;-2.54,-1.32,;-2.14,-2.81,;-3.23,-3.9,;-4.72,-3.5,;-5.81,-4.59,;-2.83,-5.38,;-1.34,-5.78,;-.25,-4.69,;-.65,-3.21,;.44,-2.12,;1.92,-2.52,)|

BDBM406602

CCCCc1nc(O)c(-c2nnc(CC(=O)N3CC(F)(F)C3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.18,-2.3,;-7.69,-2.7,;-6.6,-1.61,;-5.11,-2.01,;-4.03,-.92,;-4.42,.57,;-3.34,1.65,;-3.73,3.14,;-1.85,1.26,;-.76,2.35,;-.76,3.89,;.71,4.36,;1.61,3.12,;3.15,3.12,;3.92,4.45,;3.15,5.78,;5.46,4.45,;6.55,3.36,;7.64,4.45,;9.18,4.45,;8.41,5.78,;6.55,5.54,;.71,1.87,;-1.45,-.23,;.04,-.63,;-2.54,-1.32,;-2.14,-2.81,;-3.23,-3.9,;-4.72,-3.5,;-5.81,-4.59,;-2.83,-5.38,;-1.34,-5.78,;-.25,-4.69,;-.65,-3.21,;.44,-2.12,;1.92,-2.52,)|

BDBM406603

CCCCc1nc(O)c(-c2nnc(CC(=O)Nc3nccs3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.98,-1.07,;-7.64,-1.84,;-6.31,-1.07,;-4.98,-1.84,;-3.64,-1.07,;-3.64,.47,;-2.31,1.24,;-2.31,2.78,;-.97,.47,;.36,1.24,;1.77,.61,;2.8,1.76,;2.03,3.09,;2.42,4.58,;3.91,4.98,;4.31,6.46,;5,3.89,;6.49,4.28,;7.04,5.72,;8.58,5.64,;8.98,4.15,;7.69,3.32,;.52,2.77,;-.97,-1.07,;.36,-1.84,;-2.31,-1.84,;-2.31,-3.38,;-3.64,-4.15,;-4.98,-3.38,;-6.31,-4.15,;-3.64,-5.69,;-2.31,-6.46,;-.97,-5.69,;-.97,-4.15,;.36,-3.38,;1.69,-4.15,)|

BDBM406604

CCCCc1nc(O)c(-c2nc(Cc3ccc(Cl)cc3)no2)c(O)c1-c1c(OC)cccc1OC |(-7.77,.61,;-6.44,-.16,;-5.11,.61,;-3.77,-.16,;-2.44,.61,;-2.44,2.15,;-1.1,2.92,;-1.1,4.46,;.23,2.15,;1.56,2.92,;2.97,2.3,;4,3.44,;5.49,3.04,;5.89,1.56,;4.8,.47,;5.2,-1.02,;6.68,-1.42,;7.08,-2.91,;7.77,-.33,;7.37,1.16,;3.23,4.78,;1.72,4.46,;.23,.61,;1.56,-.16,;-1.1,-.16,;-1.1,-1.7,;-2.44,-2.47,;-3.77,-1.7,;-5.11,-2.47,;-2.44,-4.01,;-1.1,-4.78,;.23,-4.01,;.23,-2.47,;1.56,-1.7,;2.9,-2.47,)|

BDBM406605

CCCCc1nc(O)c(-c2nnc(Cc3nnc(o3)-c3ccncc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.71,-3.61,;-8.22,-4.01,;-7.13,-2.92,;-5.64,-3.32,;-4.55,-2.23,;-4.95,-.74,;-3.86,.35,;-4.26,1.83,;-2.38,-.05,;-1.29,1.04,;-1.29,2.58,;.18,3.05,;1.08,1.81,;2.62,1.81,;3.39,3.14,;2.77,4.55,;3.91,5.58,;5.24,4.81,;4.92,3.3,;6.73,5.21,;7.82,4.12,;9.31,4.52,;9.71,6,;8.62,7.09,;7.13,6.69,;.18,.56,;-1.98,-1.54,;-.49,-1.94,;-3.07,-2.63,;-2.67,-4.12,;-3.76,-5.21,;-5.24,-4.81,;-6.33,-5.9,;-3.36,-6.69,;-1.87,-7.09,;-.78,-6,;-1.18,-4.52,;-.09,-3.43,;1.4,-3.83,)|

BDBM406606

CCCCc1nc(O)c(-c2nnc(Cc3nnc(o3)-c3ccccn3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.71,-3.61,;-8.22,-4.01,;-7.13,-2.92,;-5.64,-3.32,;-4.55,-2.23,;-4.95,-.74,;-3.86,.35,;-4.26,1.83,;-2.38,-.05,;-1.29,1.04,;-1.29,2.58,;.18,3.05,;1.08,1.81,;2.62,1.81,;3.39,3.14,;2.77,4.55,;3.91,5.58,;5.24,4.81,;4.92,3.3,;6.73,5.21,;7.82,4.12,;9.31,4.52,;9.71,6,;8.62,7.09,;7.13,6.69,;.18,.56,;-1.98,-1.54,;-.49,-1.94,;-3.07,-2.63,;-2.67,-4.12,;-3.76,-5.21,;-5.24,-4.81,;-6.33,-5.9,;-3.36,-6.69,;-1.87,-7.09,;-.78,-6,;-1.18,-4.52,;-.09,-3.43,;1.4,-3.83,)|

BDBM406607

CCCCc1nc(O)c(-c2nnc(Cc3nnc(o3)-c3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(-9.71,-3.96,;-8.22,-4.36,;-7.13,-3.27,;-5.64,-3.67,;-4.55,-2.58,;-4.95,-1.09,;-3.86,0,;-4.26,1.49,;-2.38,-.4,;-1.29,.69,;-1.29,2.23,;.18,2.71,;1.08,1.46,;2.62,1.46,;3.39,2.79,;2.77,4.2,;3.91,5.23,;5.24,4.46,;4.92,2.96,;6.73,4.86,;7.82,3.77,;9.31,4.17,;9.71,5.66,;8.62,6.75,;7.13,6.35,;6.04,7.44,;.18,.22,;-1.98,-1.89,;-.49,-2.28,;-3.07,-2.97,;-2.67,-4.46,;-3.76,-5.55,;-5.24,-5.15,;-6.33,-6.24,;-3.36,-7.04,;-1.87,-7.44,;-.78,-6.35,;-1.18,-4.86,;-.09,-3.77,;1.4,-4.17,)|

BDBM406608

CCCCc1nc(O)c(-c2nnc(Cc3nnc(Cc4ccccc4)o3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.05,-2.85,;-8.56,-3.25,;-7.48,-2.16,;-5.99,-2.56,;-4.9,-1.47,;-5.3,.01,;-4.21,1.1,;-4.61,2.59,;-2.72,.7,;-1.63,1.79,;-1.63,3.33,;-.17,3.81,;.74,2.56,;2.28,2.56,;3.05,3.9,;2.42,5.3,;3.57,6.33,;4.9,5.56,;6.39,5.96,;7.48,4.87,;7.08,3.39,;8.17,2.3,;9.65,2.7,;10.05,4.18,;8.96,5.27,;4.58,4.06,;-.17,1.32,;-2.32,-.78,;-.84,-1.18,;-3.41,-1.87,;-3.01,-3.36,;-4.1,-4.45,;-5.59,-4.05,;-6.68,-5.14,;-3.7,-5.94,;-2.22,-6.33,;-1.13,-5.25,;-1.53,-3.76,;-.44,-2.67,;1.05,-3.07,)|

BDBM406609

CCCCc1nc(O)c(-c2nnc(Cc3nnc(o3)-c3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.71,-4.36,;-8.22,-4.75,;-7.13,-3.66,;-5.64,-4.06,;-4.55,-2.97,;-4.95,-1.49,;-3.86,-.4,;-4.26,1.09,;-2.38,-.8,;-1.29,.29,;-1.29,1.83,;.18,2.31,;1.08,1.06,;2.62,1.06,;3.39,2.4,;2.77,3.8,;3.91,4.83,;5.24,4.06,;4.92,2.56,;6.73,4.46,;7.82,3.37,;9.31,3.77,;9.71,5.26,;8.62,6.35,;9.02,7.84,;7.13,5.95,;.18,-.18,;-1.98,-2.28,;-.49,-2.68,;-3.07,-3.37,;-2.67,-4.86,;-3.76,-5.95,;-5.24,-5.55,;-6.33,-6.64,;-3.36,-7.44,;-1.87,-7.84,;-.78,-6.75,;-1.18,-5.26,;-.09,-4.17,;1.4,-4.57,)|

BDBM406610

CCCCc1nc(O)c(-c2nnc(Cc3nnc(o3)-c3cccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.71,-3.61,;-8.22,-4.01,;-7.13,-2.92,;-5.64,-3.32,;-4.55,-2.23,;-4.95,-.74,;-3.86,.35,;-4.26,1.83,;-2.38,-.05,;-1.29,1.04,;-1.29,2.58,;.18,3.05,;1.08,1.81,;2.62,1.81,;3.39,3.14,;2.77,4.55,;3.91,5.58,;5.24,4.81,;4.92,3.3,;6.73,5.21,;7.13,6.69,;8.62,7.09,;9.71,6,;9.31,4.52,;7.82,4.12,;.18,.56,;-1.98,-1.54,;-.49,-1.94,;-3.07,-2.63,;-2.67,-4.12,;-3.76,-5.21,;-5.24,-4.81,;-6.33,-5.9,;-3.36,-6.69,;-1.87,-7.09,;-.78,-6,;-1.18,-4.52,;-.09,-3.43,;1.4,-3.83,)|

BDBM406611

CCOCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(OC)cc(F)cc1OC |(-8.32,-.25,;-6.99,-1.02,;-5.65,-.25,;-4.32,-1.02,;-2.99,-.25,;-2.99,1.29,;-1.65,2.06,;-1.65,3.6,;-.32,1.29,;1.01,2.06,;2.42,1.44,;3.45,2.58,;2.68,3.92,;3.08,5.4,;4.57,5.8,;5.27,7.18,;6.79,6.93,;7.03,5.41,;8.32,4.57,;8.24,3.04,;6.87,2.34,;5.58,3.18,;5.66,4.71,;1.18,3.6,;-.32,-.25,;1.01,-1.02,;-1.65,-1.02,;-1.65,-2.56,;-2.99,-3.33,;-4.32,-2.56,;-5.65,-3.33,;-2.99,-4.87,;-1.65,-5.64,;-1.65,-7.18,;-.32,-4.87,;-.32,-3.33,;1.01,-2.56,;2.35,-3.33,)|

BDBM406612

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cc(F)cc1OC |(-8.68,-.5,;-7.34,-1.27,;-6.01,-.5,;-4.67,-1.27,;-3.34,-.5,;-3.34,1.04,;-2.01,1.81,;-2.01,3.35,;-.67,1.04,;.66,1.81,;2.07,1.18,;3.1,2.33,;2.33,3.66,;2.73,5.15,;4.21,5.55,;5.3,4.46,;6.79,4.86,;7.19,6.34,;8.68,6.74,;6.1,7.43,;4.61,7.03,;.82,3.34,;-.67,-.5,;.66,-1.27,;-2.01,-1.27,;-2.01,-2.81,;-3.34,-3.58,;-4.67,-2.81,;-6.01,-3.58,;-3.34,-5.12,;-2.01,-5.89,;-2.01,-7.43,;-.67,-5.12,;-.67,-3.58,;.66,-2.81,;1.99,-3.58,)|

BDBM406613

CCOCc1nc(O)c(-c2nnc(CN3CCCC3=O)o2)c(O)c1-c1c(OC)cc(F)cc1OC |(-7.68,-.25,;-6.34,-1.02,;-5.01,-.25,;-3.67,-1.02,;-2.34,-.25,;-2.34,1.29,;-1.01,2.06,;-1.01,3.6,;.33,1.29,;1.66,2.06,;3.07,1.44,;4.1,2.58,;3.33,3.92,;3.73,5.4,;5.21,5.8,;5.91,7.18,;7.43,6.93,;7.68,5.41,;6.3,4.71,;6.06,3.19,;1.82,3.6,;.33,-.25,;1.66,-1.02,;-1.01,-1.02,;-1.01,-2.56,;-2.34,-3.33,;-3.67,-2.56,;-5.01,-3.33,;-2.34,-4.87,;-1.01,-5.64,;-1.01,-7.18,;.33,-4.87,;.33,-3.33,;1.66,-2.56,;2.99,-3.33,)|

BDBM406614

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)nc3)o2)c(O)c1-c1c(OC)cc(F)cc1OC |(-8.68,-.5,;-7.34,-1.27,;-6.01,-.5,;-4.67,-1.27,;-3.34,-.5,;-3.34,1.04,;-2.01,1.81,;-2.01,3.35,;-.67,1.04,;.66,1.81,;2.07,1.18,;3.1,2.33,;2.33,3.66,;2.73,5.15,;4.21,5.55,;4.61,7.03,;6.1,7.43,;7.19,6.34,;8.68,6.74,;6.79,4.86,;5.3,4.46,;.82,3.34,;-.67,-.5,;.66,-1.27,;-2.01,-1.27,;-2.01,-2.81,;-3.34,-3.58,;-4.67,-2.81,;-6.01,-3.58,;-3.34,-5.12,;-2.01,-5.89,;-2.01,-7.43,;-.67,-5.12,;-.67,-3.58,;.66,-2.81,;1.99,-3.58,)|

BDBM406615

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(OC)ccc(F)c1OC |(-8.32,-1.02,;-6.99,-1.79,;-5.65,-1.02,;-4.32,-1.79,;-2.99,-1.02,;-2.99,.52,;-1.65,1.29,;-1.65,2.83,;-.32,.52,;1.01,1.29,;2.42,.67,;3.45,1.81,;2.68,3.15,;3.08,4.63,;4.57,5.03,;5.27,6.41,;6.79,6.16,;7.03,4.64,;8.32,3.8,;8.24,2.27,;6.87,1.57,;5.58,2.41,;5.66,3.94,;1.18,2.83,;-.32,-1.02,;1.01,-1.79,;-1.65,-1.79,;-1.65,-3.33,;-2.99,-4.1,;-4.32,-3.33,;-5.65,-4.1,;-2.99,-5.64,;-1.65,-6.41,;-.32,-5.64,;1.01,-6.41,;-.32,-4.1,;1.01,-3.33,;2.35,-4.1,)|

BDBM406617

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(C)cc(C)cc1C |(-8.32,-.25,;-6.99,-1.02,;-5.65,-.25,;-4.32,-1.02,;-2.99,-.25,;-2.99,1.29,;-1.65,2.06,;-1.65,3.6,;-.32,1.29,;1.01,2.06,;2.42,1.44,;3.45,2.58,;2.68,3.92,;3.08,5.4,;4.57,5.8,;5.27,7.18,;6.79,6.93,;7.03,5.41,;8.32,4.57,;8.24,3.04,;6.87,2.34,;5.58,3.18,;5.66,4.71,;1.18,3.6,;-.32,-.25,;1.01,-1.02,;-1.65,-1.02,;-1.65,-2.56,;-.32,-3.33,;1.01,-2.56,;-.32,-4.87,;-1.65,-5.64,;-1.65,-7.18,;-2.99,-4.87,;-2.99,-3.33,;-4.32,-2.56,)|

BDBM406618

CCCCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(CC)cccc1CC |(-8.32,-1.02,;-6.99,-1.79,;-5.65,-1.02,;-4.32,-1.79,;-2.99,-1.02,;-2.99,.52,;-1.65,1.29,;-1.65,2.83,;-.32,.52,;1.01,1.29,;2.42,.67,;3.45,1.81,;2.68,3.15,;3.08,4.63,;4.57,5.03,;5.27,6.41,;6.79,6.16,;7.03,4.64,;8.32,3.8,;8.24,2.27,;6.87,1.57,;5.58,2.41,;5.66,3.94,;1.18,2.83,;-.32,-1.02,;1.01,-1.79,;-1.65,-1.79,;-1.65,-3.33,;-2.99,-4.1,;-4.32,-3.33,;-5.65,-4.1,;-2.99,-5.64,;-1.65,-6.41,;-.32,-5.64,;-.32,-4.1,;1.01,-3.33,;2.35,-4.1,)|

BDBM406619

CCOCc1nc(O)c(-c2nnc(Cc3noc4cccnc34)o2)c(O)c1-c1c(OC)cccc1OC |(-8.32,-1.02,;-6.99,-1.79,;-5.65,-1.02,;-4.32,-1.79,;-2.99,-1.02,;-2.99,.52,;-1.65,1.29,;-1.65,2.83,;-.32,.52,;1.01,1.29,;2.42,.67,;3.45,1.81,;2.68,3.15,;3.08,4.63,;4.57,5.03,;5.27,6.41,;6.79,6.16,;7.03,4.64,;8.32,3.8,;8.24,2.27,;6.87,1.57,;5.58,2.41,;5.66,3.94,;1.18,2.83,;-.32,-1.02,;1.01,-1.79,;-1.65,-1.79,;-1.65,-3.33,;-2.99,-4.1,;-4.32,-3.33,;-5.65,-4.1,;-2.99,-5.64,;-1.65,-6.41,;-.32,-5.64,;-.32,-4.1,;1.01,-3.33,;2.35,-4.1,)|

BDBM406620

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cn3)s2)c(O)c1-c1c(OC)cccc1OC |(-8.88,-.95,;-7.54,-1.72,;-6.21,-.95,;-4.88,-1.72,;-3.54,-.95,;-3.54,.59,;-2.21,1.36,;-2.21,2.9,;-.88,.59,;.46,1.36,;1.86,.73,;2.9,1.87,;2.13,3.21,;2.75,4.61,;4.28,4.78,;5.19,3.53,;6.72,3.69,;7.35,5.1,;8.88,5.26,;6.44,6.34,;4.91,6.18,;.62,2.89,;-.88,-.95,;.46,-1.72,;-2.21,-1.72,;-2.21,-3.26,;-3.54,-4.03,;-4.88,-3.26,;-6.21,-4.03,;-3.54,-5.57,;-2.21,-6.34,;-.88,-5.57,;-.88,-4.03,;.46,-3.26,;1.79,-4.03,)|

BDBM406621

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cn3)s2)c(O)nc1C1CCCC1 |(-6.97,-4.03,;-5.63,-3.26,;-4.3,-4.03,;-4.3,-5.57,;-2.97,-6.34,;-1.63,-5.57,;-1.63,-4.03,;-.3,-3.26,;1.04,-4.03,;-2.97,-3.26,;-2.97,-1.72,;-1.63,-.95,;-.3,-1.72,;-1.63,.59,;-.3,1.36,;1.11,.73,;2.14,1.87,;1.37,3.21,;2,4.61,;3.53,4.78,;4.43,3.53,;5.96,3.69,;6.59,5.1,;8.12,5.26,;5.68,6.34,;4.15,6.18,;-.14,2.89,;-2.97,1.36,;-2.97,2.9,;-4.3,.59,;-4.3,-.95,;-5.63,-1.72,;-6.03,-.24,;-7.57,-.16,;-8.12,-1.59,;-6.92,-2.56,)|

BDBM406622

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)s2)c(O)c1-c1c(OC)cccc1OC |(-8.88,-.95,;-7.54,-1.72,;-6.21,-.95,;-4.88,-1.72,;-3.54,-.95,;-3.54,.59,;-2.21,1.36,;-2.21,2.9,;-.88,.59,;.46,1.36,;1.86,.73,;2.9,1.87,;2.13,3.21,;2.75,4.61,;4.28,4.78,;5.19,3.53,;6.72,3.69,;7.35,5.1,;8.88,5.26,;6.44,6.34,;4.91,6.18,;.62,2.89,;-.88,-.95,;.46,-1.72,;-2.21,-1.72,;-2.21,-3.26,;-3.54,-4.03,;-4.88,-3.26,;-6.21,-4.03,;-3.54,-5.57,;-2.21,-6.34,;-.88,-5.57,;-.88,-4.03,;.46,-3.26,;1.79,-4.03,)|

BDBM406623

CCOCc1nc(O)c(-c2nnc(CNC(=O)c3ccccn3)s2)c(O)c1-c1c(OC)cccc1OC |(-9.33,-.41,;-8,-1.18,;-6.66,-.41,;-5.33,-1.18,;-4,-.41,;-4,1.13,;-2.66,1.9,;-2.66,3.44,;-1.33,1.13,;.01,1.9,;1.41,1.27,;2.44,2.42,;1.67,3.75,;2.3,5.16,;3.83,5.32,;4.74,4.07,;4.11,2.67,;6.27,4.23,;7.17,2.99,;8.7,3.15,;9.33,4.56,;8.43,5.8,;6.89,5.64,;.17,3.43,;-1.33,-.41,;.01,-1.18,;-2.66,-1.18,;-2.66,-2.72,;-4,-3.49,;-5.33,-2.72,;-6.66,-3.49,;-4,-5.03,;-2.66,-5.8,;-1.33,-5.03,;-1.33,-3.49,;.01,-2.72,;1.34,-3.49,)|

BDBM406624

CCCCc1nc(O)c(-c2nnc(Cc3ncc(Cl)cc3F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.88,-1.5,;-7.54,-2.27,;-6.21,-1.5,;-4.88,-2.27,;-3.54,-1.5,;-3.54,.04,;-2.21,.81,;-2.21,2.35,;-.88,.04,;.46,.81,;1.86,.19,;2.9,1.33,;2.13,2.67,;2.75,4.07,;4.28,4.23,;5.19,2.99,;6.72,3.15,;7.35,4.56,;8.88,4.72,;6.44,5.8,;4.91,5.64,;4,6.89,;.62,2.35,;-.88,-1.5,;.46,-2.27,;-2.21,-2.27,;-2.21,-3.81,;-3.54,-4.58,;-4.88,-3.81,;-6.21,-4.58,;-3.54,-6.12,;-2.21,-6.89,;-.88,-6.12,;-.88,-4.58,;.46,-3.81,;1.79,-4.58,)|

BDBM406625

CCOCc1nc(O)c(-c2nnc(Cc3ncc(Cl)cc3F)o2)c(O)c1-c1c(OC)cccc1OC |(-8.88,-1.5,;-7.54,-2.27,;-6.21,-1.5,;-4.88,-2.27,;-3.54,-1.5,;-3.54,.04,;-2.21,.81,;-2.21,2.35,;-.88,.04,;.46,.81,;1.86,.19,;2.9,1.33,;2.13,2.67,;2.75,4.07,;4.28,4.23,;5.19,2.99,;6.72,3.15,;7.35,4.56,;8.88,4.72,;6.44,5.8,;4.91,5.64,;4,6.89,;.62,2.35,;-.88,-1.5,;.46,-2.27,;-2.21,-2.27,;-2.21,-3.81,;-3.54,-4.58,;-4.88,-3.81,;-6.21,-4.58,;-3.54,-6.12,;-2.21,-6.89,;-.88,-6.12,;-.88,-4.58,;.46,-3.81,;1.79,-4.58,)|

BDBM406626

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)nc1C1CCCC1 |(-6.97,-4.03,;-5.63,-3.26,;-4.3,-4.03,;-4.3,-5.57,;-2.97,-6.34,;-1.63,-5.57,;-1.63,-4.03,;-.3,-3.26,;1.04,-4.03,;-2.97,-3.26,;-2.97,-1.72,;-1.63,-.95,;-.3,-1.72,;-1.63,.59,;-.3,1.36,;1.11,.73,;2.14,1.87,;1.37,3.21,;2,4.61,;3.53,4.78,;4.15,6.18,;5.68,6.34,;6.59,5.1,;8.12,5.26,;5.96,3.69,;4.43,3.53,;-.14,2.89,;-2.97,1.36,;-2.97,2.9,;-4.3,.59,;-4.3,-.95,;-5.63,-1.72,;-6.03,-.24,;-7.57,-.16,;-8.12,-1.59,;-6.92,-2.56,)|

BDBM406627

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)nc1C1CCCC1 |(-6.97,-4.03,;-5.63,-3.26,;-4.3,-4.03,;-4.3,-5.57,;-2.97,-6.34,;-1.63,-5.57,;-1.63,-4.03,;-.3,-3.26,;1.04,-4.03,;-2.97,-3.26,;-2.97,-1.72,;-1.63,-.95,;-.3,-1.72,;-1.63,.59,;-.3,1.36,;1.11,.73,;2.14,1.87,;1.37,3.21,;2,4.61,;3.53,4.78,;4.43,3.53,;5.96,3.69,;6.59,5.1,;8.12,5.26,;5.68,6.34,;4.15,6.18,;-.14,2.89,;-2.97,1.36,;-2.97,2.9,;-4.3,.59,;-4.3,-.95,;-5.63,-1.72,;-6.03,-.24,;-7.57,-.16,;-8.12,-1.59,;-6.92,-2.56,)|

BDBM406628

COCCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.21,-.95,;-8.88,-1.72,;-7.54,-.95,;-6.21,-1.72,;-4.88,-.95,;-3.54,-1.72,;-2.21,-.95,;-2.21,.59,;-.88,1.36,;-.88,2.9,;.46,.59,;1.79,1.36,;3.2,.73,;4.23,1.87,;3.46,3.21,;4.09,4.62,;5.62,4.78,;6.24,6.18,;7.78,6.34,;8.68,5.1,;10.21,5.26,;8.05,3.69,;6.52,3.53,;1.95,2.89,;.46,-.95,;1.79,-1.72,;-.88,-1.72,;-.88,-3.26,;-2.21,-4.03,;-3.54,-3.26,;-4.88,-4.03,;-2.21,-5.57,;-.88,-6.34,;.46,-5.57,;.46,-4.03,;1.79,-3.26,;3.13,-4.03,)|

BDBM406629

COCCOCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1c(OC)cccc1OC |(-9.76,-.84,;-8.42,-1.61,;-7.09,-.84,;-5.75,-1.61,;-4.42,-.84,;-3.09,-1.61,;-1.75,-.84,;-1.75,.7,;-.42,1.47,;-.42,3.01,;.91,.7,;2.25,1.47,;3.65,.85,;4.68,1.99,;3.91,3.33,;4.54,4.73,;6.07,4.89,;6.84,6.23,;8.35,5.91,;8.51,4.37,;9.76,3.47,;9.59,1.94,;8.19,1.31,;6.94,2.22,;7.1,3.75,;2.41,3,;.91,-.84,;2.25,-1.61,;-.42,-1.61,;-.42,-3.15,;-1.75,-3.92,;-3.09,-3.15,;-4.42,-3.92,;-1.75,-5.46,;-.42,-6.23,;.91,-5.46,;.91,-3.92,;2.25,-3.15,;3.58,-3.92,)|

BDBM406630

COCCOCc1nc(O)c(-c2nnc(CNc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.58,-.17,;-8.25,-.94,;-6.92,-.17,;-5.58,-.94,;-4.25,-.17,;-2.92,-.94,;-1.58,-.17,;-1.58,1.37,;-.25,2.14,;-.25,3.68,;1.08,1.37,;2.42,2.14,;3.82,1.51,;4.86,2.66,;4.09,3.99,;4.71,5.4,;6.24,5.56,;7.15,4.31,;6.52,2.91,;7.43,1.66,;8.96,1.82,;9.58,3.23,;8.68,4.47,;2.58,3.67,;1.08,-.17,;2.42,-.94,;-.25,-.94,;-.25,-2.48,;-1.58,-3.25,;-2.92,-2.48,;-4.25,-3.25,;-1.58,-4.79,;-.25,-5.56,;1.08,-4.79,;1.08,-3.25,;2.42,-2.48,;3.75,-3.25,)|

BDBM406631

COCCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.21,-.95,;-8.88,-1.72,;-7.54,-.95,;-6.21,-1.72,;-4.88,-.95,;-3.54,-1.72,;-2.21,-.95,;-2.21,.59,;-.88,1.36,;-.88,2.9,;.46,.59,;1.79,1.36,;3.2,.73,;4.23,1.87,;3.46,3.21,;4.09,4.62,;5.62,4.78,;6.52,3.53,;8.05,3.69,;8.68,5.1,;10.21,5.26,;7.78,6.34,;6.24,6.18,;1.95,2.89,;.46,-.95,;1.79,-1.72,;-.88,-1.72,;-.88,-3.26,;-2.21,-4.03,;-3.54,-3.26,;-4.88,-4.03,;-2.21,-5.57,;-.88,-6.34,;.46,-5.57,;.46,-4.03,;1.79,-3.26,;3.13,-4.03,)|

BDBM406632

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccccc3)o2)c(O)c1-c1cc(OC)ccc1OC |(-9.12,1.38,;-7.79,.61,;-6.46,1.38,;-5.12,.61,;-3.79,1.38,;-3.79,2.92,;-2.46,3.69,;-2.46,5.23,;-1.12,2.92,;.21,3.69,;.37,5.23,;1.88,5.55,;2.65,4.21,;4.18,4.05,;4.81,2.64,;6.34,2.48,;7.24,3.73,;6.97,1.08,;6.06,-.17,;6.69,-1.58,;8.22,-1.74,;9.12,-.49,;8.5,.92,;1.62,3.07,;-1.12,1.38,;.21,.61,;-2.46,.61,;-2.46,-.93,;-3.79,-1.7,;-3.79,-3.24,;-5.12,-4.01,;-5.12,-5.55,;-2.46,-4.01,;-1.12,-3.24,;-1.12,-1.7,;.21,-.93,;1.55,-1.7,)|

BDBM406633

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccccc3)o2)c(O)c1-c1cc(ccc1OC)C(C)C |(-9.12,1.38,;-7.79,.61,;-6.46,1.38,;-5.12,.61,;-3.79,1.38,;-3.79,2.92,;-2.46,3.69,;-2.46,5.23,;-1.12,2.92,;.21,3.69,;.37,5.23,;1.88,5.55,;2.65,4.21,;4.18,4.05,;4.81,2.64,;6.34,2.48,;7.24,3.73,;6.97,1.08,;6.06,-.17,;6.69,-1.58,;8.22,-1.74,;9.12,-.49,;8.5,.92,;1.62,3.07,;-1.12,1.38,;.21,.61,;-2.46,.61,;-2.46,-.93,;-1.12,-1.7,;-1.12,-3.24,;-2.46,-4.01,;-3.79,-3.24,;-3.79,-1.7,;-5.12,-.93,;-6.46,-1.7,;.21,-4.01,;1.55,-3.24,;.21,-5.55,)|

BDBM406634

CCOCc1nc(O)c(-c2nnc(Cc3noc4ccccc34)o2)c(O)c1-c1ccccc1OC |(-8.42,-.84,;-7.09,-1.61,;-5.75,-.84,;-4.42,-1.61,;-3.09,-.84,;-3.09,.7,;-1.75,1.47,;-1.75,3.01,;-.42,.7,;.91,1.47,;2.32,.85,;3.35,1.99,;2.58,3.33,;3.21,4.73,;4.74,4.89,;5.51,6.23,;7.02,5.91,;7.18,4.37,;8.42,3.47,;8.26,1.94,;6.85,1.31,;5.61,2.22,;5.77,3.75,;1.07,3,;-.42,-.84,;.91,-1.61,;-1.75,-1.61,;-1.75,-3.15,;-.42,-3.92,;-.42,-5.46,;-1.75,-6.23,;-3.09,-5.46,;-3.09,-3.92,;-4.42,-3.15,;-5.75,-3.92,)|

BDBM406635

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1ccccc1OC |(-8.88,-.95,;-7.54,-1.72,;-6.21,-.95,;-4.88,-1.72,;-3.54,-.95,;-3.54,.59,;-2.21,1.36,;-2.21,2.9,;-.88,.59,;.46,1.36,;1.86,.73,;2.9,1.87,;2.13,3.21,;2.75,4.61,;4.28,4.78,;5.19,3.53,;6.72,3.69,;7.35,5.1,;8.88,5.26,;6.44,6.34,;4.91,6.18,;.62,2.89,;-.88,-.95,;.46,-1.72,;-2.21,-1.72,;-2.21,-3.26,;-.88,-4.03,;-.88,-5.57,;-2.21,-6.34,;-3.54,-5.57,;-3.54,-4.03,;-4.88,-3.26,;-6.21,-4.03,)|

BDBM406636

CCCCc1nc(O)c(-c2nnc(CNC(=O)c3ccccc3)o2)c(O)c1-c1cccc(OC)c1OC |(-9.12,1.38,;-7.79,.61,;-6.46,1.38,;-5.12,.61,;-3.79,1.38,;-3.79,2.92,;-2.46,3.69,;-2.46,5.23,;-1.12,2.92,;.21,3.69,;.37,5.23,;1.88,5.55,;2.65,4.21,;4.18,4.05,;4.81,2.64,;6.34,2.48,;7.24,3.73,;6.97,1.08,;6.06,-.17,;6.69,-1.58,;8.22,-1.74,;9.12,-.49,;8.5,.92,;1.62,3.07,;-1.12,1.38,;.21,.61,;-2.46,.61,;-2.46,-.93,;-1.12,-1.7,;-1.12,-3.24,;-2.46,-4.01,;-3.79,-3.24,;-5.12,-4.01,;-5.12,-5.55,;-3.79,-1.7,;-5.12,-.93,;-6.46,-1.7,)|

BDBM406637

CCOCc1nc(O)c(-c2nnc(CNC(=O)c3ccccc3)o2)c(O)c1-c1ccccc1OC |(-9.19,-1.74,;-7.86,-2.51,;-6.52,-1.74,;-5.19,-2.51,;-3.86,-1.74,;-3.86,-.2,;-2.52,.57,;-2.52,2.11,;-1.19,-.2,;.14,.57,;1.55,-.05,;2.58,1.09,;1.81,2.42,;2.44,3.83,;3.97,3.99,;4.6,5.4,;3.69,6.64,;6.13,5.56,;7.03,4.31,;8.56,4.47,;9.19,5.88,;8.29,7.13,;6.75,6.97,;.31,2.1,;-1.19,-1.74,;.14,-2.51,;-2.52,-2.51,;-2.52,-4.05,;-1.19,-4.82,;-1.19,-6.36,;-2.52,-7.13,;-3.86,-6.36,;-3.86,-4.82,;-5.19,-4.05,;-6.52,-4.82,)|

BDBM406638

CCCCc1nc(O)c(-c2nnc(CC(=O)Nc3cccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.3,;-7.37,-2.7,;-6.28,-1.61,;-4.8,-2.01,;-3.71,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.53,1.26,;-.44,2.35,;-.44,3.89,;1.02,4.36,;1.93,3.12,;3.47,3.12,;4.24,4.45,;3.47,5.78,;5.78,4.45,;6.55,3.12,;5.78,1.78,;6.55,.45,;8.09,.45,;8.86,1.78,;8.09,3.12,;1.02,1.87,;-1.13,-.23,;.36,-.63,;-2.22,-1.32,;-1.82,-2.81,;-2.91,-3.9,;-4.4,-3.5,;-5.49,-4.59,;-2.51,-5.38,;-1.02,-5.78,;.07,-4.69,;-.33,-3.21,;.76,-2.12,;2.24,-2.52,)|

BDBM406639

CCOCc1nc(O)c(-c2nnc(CC(=O)Nc3nccs3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.02,-.87,;-7.68,-1.64,;-6.35,-.87,;-5.02,-1.64,;-3.68,-.87,;-3.68,.67,;-2.35,1.44,;-2.35,2.98,;-1.02,.67,;.32,1.44,;1.72,.81,;2.76,1.95,;1.99,3.29,;2.61,4.7,;4.14,4.86,;4.77,6.26,;5.05,3.61,;6.58,3.77,;7.35,5.1,;8.86,4.78,;9.02,3.25,;7.61,2.63,;.48,2.97,;-1.02,-.87,;.32,-1.64,;-2.35,-1.64,;-2.35,-3.18,;-3.68,-3.95,;-5.02,-3.18,;-6.35,-3.95,;-3.68,-5.49,;-2.35,-6.26,;-1.02,-5.49,;-1.02,-3.95,;.32,-3.18,;1.65,-3.95,)|

BDBM406640

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3nc4ccccc4s3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;5.39,1.78,;5.39,-.89,;4.62,-2.22,;5.39,-3.55,;6.93,-3.55,;7.7,-2.22,;6.93,-.89,;7.7,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406641

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3cccnc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;5.39,1.78,;4.62,.45,;5.39,-.89,;6.93,-.89,;7.7,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406642

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ncco3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;7.56,.37,;6.42,-.66,;5.08,.11,;5.4,1.62,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406643

CCCCc1nc(O)c(-c2nnc(CC(=O)NCCc3ccc(cc3)S(N)(=O)=O)o2)c(O)c1-c1c(OC)cccc1OC |(-9.53,-2.3,;-8.04,-2.7,;-6.95,-1.61,;-5.46,-2.01,;-4.37,-.92,;-4.77,.57,;-3.68,1.65,;-4.08,3.14,;-2.2,1.26,;-1.11,2.35,;-1.11,3.89,;.36,4.36,;1.26,3.12,;2.8,3.12,;3.57,4.45,;2.8,5.78,;5.11,4.45,;5.88,3.12,;5.11,1.78,;5.88,.45,;5.11,-.89,;5.88,-2.22,;7.42,-2.22,;8.19,-.89,;7.42,.45,;8.19,-3.55,;7.1,-4.64,;9.53,-2.78,;9.28,-4.64,;.36,1.87,;-1.8,-.23,;-.31,-.63,;-2.89,-1.32,;-2.49,-2.81,;-3.58,-3.9,;-5.06,-3.5,;-6.15,-4.59,;-3.18,-5.38,;-1.69,-5.78,;-.6,-4.69,;-1,-3.21,;.09,-2.12,;1.58,-2.52,)|

BDBM406644

CCCCc1nc(O)c(-c2nnc(CC(=O)NCCc3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.3,;-7.37,-2.7,;-6.28,-1.61,;-4.8,-2.01,;-3.71,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.53,1.26,;-.44,2.35,;-.44,3.89,;1.02,4.36,;1.93,3.12,;3.47,3.12,;4.24,4.45,;3.47,5.78,;5.78,4.45,;6.55,3.12,;5.78,1.78,;6.55,.45,;8.09,.45,;8.86,-.89,;8.09,-2.22,;6.55,-2.22,;5.78,-.89,;4.24,-.89,;1.02,1.87,;-1.13,-.23,;.36,-.63,;-2.22,-1.32,;-1.82,-2.81,;-2.91,-3.9,;-4.4,-3.5,;-5.49,-4.59,;-2.51,-5.38,;-1.02,-5.78,;.07,-4.69,;-.33,-3.21,;.76,-2.12,;2.24,-2.52,)|

BDBM406645

CCCCc1nc(O)c(-c2nnc(CC(=O)NCCc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-8.86,-2.3,;-7.37,-2.7,;-6.28,-1.61,;-4.8,-2.01,;-3.71,-.92,;-4.11,.57,;-3.02,1.65,;-3.42,3.14,;-1.53,1.26,;-.44,2.35,;-.44,3.89,;1.02,4.36,;1.93,3.12,;3.47,3.12,;4.24,4.45,;3.47,5.78,;5.78,4.45,;6.55,3.12,;5.78,1.78,;6.55,.45,;5.78,-.89,;6.55,-2.22,;8.09,-2.22,;8.86,-3.55,;8.86,-.89,;8.09,.45,;1.02,1.87,;-1.13,-.23,;.36,-.63,;-2.22,-1.32,;-1.82,-2.81,;-2.91,-3.9,;-4.4,-3.5,;-5.49,-4.59,;-2.51,-5.38,;-1.02,-5.78,;.07,-4.69,;-.33,-3.21,;.76,-2.12,;2.24,-2.52,)|

BDBM406646

CCCCc1nc(O)c(-c2nnc(CC(=O)N(C)Cc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,5.78,;7.7,3.12,;6.93,1.78,;5.39,1.78,;4.62,.45,;5.39,-.89,;6.93,-.89,;7.7,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406647

CCCCc1nc(O)c(-c2nnc(CC(=O)N(C)CCc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(-10.01,-2.3,;-8.53,-2.7,;-7.44,-1.61,;-5.95,-2.01,;-4.86,-.92,;-5.26,.57,;-4.17,1.65,;-4.57,3.14,;-2.68,1.26,;-1.6,2.35,;-1.6,3.89,;-.13,4.36,;.77,3.12,;2.31,3.12,;3.08,4.45,;2.31,5.78,;4.62,4.45,;5.39,5.78,;5.39,3.12,;6.93,3.12,;7.7,1.78,;6.93,.45,;7.7,-.89,;9.24,-.89,;10.01,.45,;9.24,1.78,;-.13,1.87,;-2.29,-.23,;-.8,-.63,;-3.37,-1.32,;-2.98,-2.81,;-4.06,-3.9,;-5.55,-3.5,;-6.64,-4.59,;-3.67,-5.38,;-2.18,-5.78,;-1.09,-4.69,;-1.49,-3.21,;-.4,-2.12,;1.09,-2.52,)|

BDBM406648

CCCCc1nc(O)c(-c2nnc(CC(=O)NCC#C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;6.16,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406649

CCCCc1nc(O)c(-c2nnc(CC(=O)Nc3cc(C)n[nH]3)o2)c(O)c1-c1c(OC)cccc1OC |(-9.33,-2.3,;-7.85,-2.7,;-6.76,-1.61,;-5.27,-2.01,;-4.18,-.92,;-4.58,.57,;-3.49,1.65,;-3.89,3.14,;-2,1.26,;-.91,2.35,;-.91,3.89,;.55,4.36,;1.46,3.12,;3,3.12,;3.77,4.45,;3,5.78,;5.31,4.45,;6.08,3.12,;7.61,2.95,;7.93,1.45,;9.33,.82,;6.59,.68,;5.45,1.71,;.55,1.87,;-1.6,-.23,;-.12,-.63,;-2.69,-1.32,;-2.3,-2.81,;-3.38,-3.9,;-4.87,-3.5,;-5.96,-4.59,;-2.99,-5.38,;-1.5,-5.78,;-.41,-4.69,;-.81,-3.21,;.28,-2.12,;1.77,-2.52,)|

BDBM406650

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccccc3C)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-4.3,;-6.99,-4.7,;-5.9,-3.61,;-4.41,-4.01,;-3.32,-2.92,;-3.72,-1.43,;-2.63,-.35,;-3.03,1.14,;-1.14,-.74,;-.06,.34,;-.06,1.88,;1.41,2.36,;2.31,1.11,;3.85,1.11,;4.62,2.45,;3.85,3.78,;6.16,2.45,;6.93,3.78,;6.16,5.12,;4.62,5.12,;3.85,6.45,;4.62,7.78,;6.16,7.78,;6.93,6.45,;8.47,6.45,;1.41,-.13,;-.75,-2.23,;.74,-2.63,;-1.83,-3.32,;-1.44,-4.81,;-2.52,-5.9,;-4.01,-5.5,;-5.1,-6.59,;-2.13,-7.38,;-.64,-7.78,;.45,-6.69,;.05,-5.21,;1.14,-4.12,;2.63,-4.52,)|

BDBM406651

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(-8.47,-4.3,;-6.99,-4.7,;-5.9,-3.61,;-4.41,-4.01,;-3.32,-2.92,;-3.72,-1.43,;-2.63,-.35,;-3.03,1.14,;-1.14,-.74,;-.06,.34,;-.06,1.88,;1.41,2.36,;2.31,1.11,;3.85,1.11,;4.62,2.45,;3.85,3.78,;6.16,2.45,;6.93,3.78,;6.16,5.12,;4.62,5.12,;3.85,6.45,;4.62,7.78,;6.16,7.78,;6.93,6.45,;8.47,6.45,;1.41,-.13,;-.75,-2.23,;.74,-2.63,;-1.83,-3.32,;-1.44,-4.81,;-2.52,-5.9,;-4.01,-5.5,;-5.1,-6.59,;-2.13,-7.38,;-.64,-7.78,;.45,-6.69,;.05,-5.21,;1.14,-4.12,;2.63,-4.52,)|

BDBM406652

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;5.39,1.78,;4.62,.45,;5.39,-.89,;4.62,-2.22,;6.93,-.89,;7.7,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406654

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccncc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;5.39,1.78,;4.62,.45,;5.39,-.89,;6.93,-.89,;7.7,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406655

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccc(OC)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;5.39,1.78,;4.62,.45,;5.39,-.89,;4.62,-2.22,;5.39,-3.55,;6.93,-.89,;7.7,.45,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406656

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccc(cc3)N(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.99,-2.3,;-6.51,-2.7,;-5.42,-1.61,;-3.93,-2.01,;-2.84,-.92,;-3.24,.57,;-2.15,1.65,;-2.55,3.14,;-.66,1.26,;.43,2.35,;.43,3.89,;1.89,4.36,;2.8,3.12,;4.7,3.12,;5.47,4.45,;4.7,5.78,;7.22,4.45,;7.99,3.12,;7.22,1.78,;5.68,1.78,;4.91,.45,;5.68,-.89,;7.22,-.89,;7.99,.45,;4.91,-2.22,;5.68,-3.55,;3.37,-2.22,;1.89,1.87,;-.26,-.23,;1.22,-.63,;-1.35,-1.32,;-.95,-2.81,;-2.04,-3.9,;-3.53,-3.5,;-4.62,-4.59,;-1.64,-5.38,;-.16,-5.78,;.93,-4.69,;.53,-3.21,;1.62,-2.12,;3.11,-2.52,)|

BDBM406657

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3nnc(C)o3)o2)c(O)c1-c1c(OC)cccc1OC |(-7.7,-2.3,;-6.22,-2.7,;-5.13,-1.61,;-3.64,-2.01,;-2.55,-.92,;-2.95,.57,;-1.86,1.65,;-2.26,3.14,;-.37,1.26,;.71,2.35,;.71,3.89,;2.18,4.36,;3.08,3.12,;4.62,3.12,;5.39,4.45,;4.62,5.78,;6.93,4.45,;7.7,3.12,;6.93,1.78,;5.4,1.62,;5.08,.11,;6.42,-.66,;6.58,-2.19,;7.56,.37,;2.18,1.87,;.02,-.23,;1.51,-.63,;-1.06,-1.32,;-.67,-2.81,;-1.75,-3.9,;-3.24,-3.5,;-4.33,-4.59,;-1.36,-5.38,;.13,-5.78,;1.22,-4.69,;.82,-3.21,;1.91,-2.12,;3.4,-2.52,)|

BDBM406658

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3cc(no3)C(C)C)o2)c(O)c1-c1c(OC)cccc1OC |(-7.8,-2.3,;-6.31,-2.7,;-5.22,-1.61,;-3.73,-2.01,;-2.64,-.92,;-3.04,.57,;-1.95,1.65,;-2.35,3.14,;-.46,1.26,;.62,2.35,;.62,3.89,;2.09,4.36,;2.99,3.12,;4.61,3.12,;5.38,4.45,;4.61,5.78,;7.03,4.45,;7.8,3.12,;7.03,1.78,;5.49,1.62,;5.17,.11,;6.51,-.66,;7.65,.37,;3.77,-.51,;3.61,-2.04,;2.52,.39,;2.09,1.87,;-.07,-.23,;1.42,-.63,;-1.15,-1.32,;-.76,-2.81,;-1.85,-3.9,;-3.33,-3.5,;-4.42,-4.59,;-1.45,-5.38,;.04,-5.78,;1.13,-4.69,;.73,-3.21,;1.82,-2.12,;3.31,-2.52,)|

BDBM406659

CCCCc1nc(O)c(-c2nnc(CC(=O)NCc3ccc(cc3)S(N)(=O)=O)o2)c(O)c1-c1c(OC)cccc1OC |(-7.89,-2.3,;-6.4,-2.7,;-5.31,-1.61,;-3.82,-2.01,;-2.73,-.92,;-3.13,.57,;-2.04,1.65,;-2.44,3.14,;-.55,1.26,;.53,2.35,;.53,3.89,;2,4.36,;2.9,3.12,;4.75,3.12,;5.52,4.45,;4.75,5.78,;7.12,4.45,;7.89,3.12,;7.12,1.78,;5.58,1.78,;4.81,.45,;5.58,-.89,;7.12,-.89,;7.89,.45,;4.81,-2.22,;5.89,-3.31,;3.47,-1.45,;4.04,-3.55,;2,1.87,;-.16,-.23,;1.33,-.63,;-1.24,-1.32,;-.85,-2.81,;-1.94,-3.9,;-3.42,-3.5,;-4.51,-4.59,;-1.54,-5.38,;-.05,-5.78,;1.04,-4.69,;.64,-3.21,;1.73,-2.12,;3.22,-2.52,)|

BDBM406660

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(O)cccc1OC |(-8.88,-.95,;-7.54,-1.72,;-6.21,-.95,;-4.88,-1.72,;-3.54,-.95,;-3.54,.59,;-2.21,1.36,;-2.21,2.9,;-.88,.59,;.46,1.36,;1.86,.73,;2.9,1.87,;2.13,3.21,;2.75,4.61,;4.28,4.78,;4.91,6.18,;6.44,6.34,;7.35,5.1,;8.88,5.26,;6.72,3.69,;5.19,3.53,;.62,2.89,;-.88,-.95,;.46,-1.72,;-2.21,-1.72,;-2.21,-3.26,;-.88,-4.03,;.46,-3.26,;-.88,-5.57,;-2.21,-6.34,;-3.54,-5.57,;-3.54,-4.03,;-4.88,-3.26,;-6.21,-4.03,)|

BDBM406662

CCOCc1nc(O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(O)cccc1O |(-8.88,-.95,;-7.54,-1.72,;-6.21,-.95,;-4.88,-1.72,;-3.54,-.95,;-3.54,.59,;-2.21,1.36,;-2.21,2.9,;-.88,.59,;.46,1.36,;1.86,.73,;2.9,1.87,;2.13,3.21,;2.75,4.61,;4.28,4.78,;4.91,6.18,;6.44,6.34,;7.35,5.1,;8.88,5.26,;6.72,3.69,;5.19,3.53,;.62,2.89,;-.88,-.95,;.46,-1.72,;-2.21,-1.72,;-2.21,-3.26,;-3.54,-4.03,;-4.88,-3.26,;-3.54,-5.57,;-2.21,-6.34,;-.88,-5.57,;-.88,-4.03,;.46,-3.26,)|

BDBM422110

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccccc1 |(-6.67,.77,;-5.33,,;-4,.77,;-2.67,,;-1.33,.77,;-1.33,2.31,;,3.08,;,4.62,;1.33,2.31,;1.33,.77,;2.67,,;;,-1.54,;-1.33,-2.31,;-2.67,-1.54,;-4,-2.31,;-1.33,-3.85,;,-4.62,;1.33,-3.85,;1.33,-2.31,;2.67,-1.54,;4,-2.31,;2.67,3.08,;1.9,4.41,;3.44,4.41,;4,2.31,;4,.77,;5.33,,;6.67,.77,;6.67,2.31,;5.33,3.08,)|

BDBM422111

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(Cl)cc1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422112

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(F)cc1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422113

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)Cc1ccccc1 |(-7.34,.38,;-6,-.38,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-.67,4.23,;.67,1.93,;.67,.38,;2,-.38,;-.67,-.38,;-.67,-1.93,;-2,-2.69,;-3.33,-1.93,;-4.67,-2.69,;-2,-4.23,;-.67,-5,;.67,-4.23,;.67,-2.69,;2,-1.93,;3.33,-2.69,;2,2.69,;1.23,4.03,;2.77,4.03,;3.33,1.93,;4.67,2.69,;6,1.93,;7.34,2.69,;7.34,4.23,;6,5,;4.67,4.23,)|

BDBM422114

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cn1)C(F)(F)F |(-8,.77,;-6.67,,;-5.33,.77,;-4,,;-2.67,.77,;-2.67,2.31,;-1.33,3.08,;-1.33,4.62,;,2.31,;,.77,;1.33,,;-1.33,,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-5.33,-2.31,;-2.67,-3.85,;-1.33,-4.62,;,-3.85,;,-2.31,;1.33,-1.54,;2.67,-2.31,;1.33,3.08,;.56,4.41,;2.1,4.41,;2.67,2.31,;2.67,.77,;4,,;5.33,.77,;5.33,2.31,;4,3.08,;6.67,,;6.67,1.54,;6.67,-1.54,;8,.77,)|

BDBM422115

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;8.67,-1.54,;8.67,,;7.34,.77,)|

BDBM422116

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cn(C)nc1C(F)(F)F |(-9.01,.77,;-7.68,,;-6.34,.77,;-5.01,,;-3.68,.77,;-3.68,2.31,;-2.34,3.08,;-2.34,4.62,;-1.01,2.31,;-1.01,.77,;.32,,;-2.34,,;-2.34,-1.54,;-3.68,-2.31,;-5.01,-1.54,;-6.34,-2.31,;-3.68,-3.85,;-2.34,-4.62,;-1.01,-3.85,;-1.01,-2.31,;.32,-1.54,;1.66,-2.31,;.32,3.08,;-.44,4.41,;1.1,4.41,;1.66,2.31,;1.66,.77,;2.99,,;4.33,.77,;4.33,2.31,;2.99,3.08,;5.66,,;5.66,-1.54,;7.12,-2.02,;7.89,-3.35,;8.03,-.77,;7.12,.48,;7.52,1.96,;7.92,3.45,;9.01,2.36,;6.43,3.05,)|

BDBM422117

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cnn(c1)C(C)C |(-9.01,.77,;-7.68,,;-6.34,.77,;-5.01,,;-3.68,.77,;-3.68,2.31,;-2.34,3.08,;-2.34,4.62,;-1.01,2.31,;-1.01,.77,;.32,,;-2.34,,;-2.34,-1.54,;-3.68,-2.31,;-5.01,-1.54,;-6.34,-2.31,;-3.68,-3.85,;-2.34,-4.62,;-1.01,-3.85,;-1.01,-2.31,;.32,-1.54,;1.66,-2.31,;.32,3.08,;-.44,4.41,;1.09,4.41,;1.66,2.31,;1.66,.77,;2.99,,;4.33,.77,;4.33,2.31,;2.99,3.08,;5.66,,;7.12,.48,;8.03,-.77,;7.12,-2.02,;5.66,-1.54,;7.52,-3.5,;6.43,-4.59,;9.01,-3.9,)|

BDBM422118

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |(-6,-2.31,;-4.67,-1.54,;-3.33,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;-2,-1.54,;-2,,;-.67,.77,;.67,,;-.67,2.31,;-2,3.08,;-2,4.62,;-3.33,2.31,;-3.33,.77,;-4.67,,;-6,.77,;-7.34,,;-8.67,.77,;-7.34,-1.54,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;8.67,-1.54,;8.67,,;7.34,.77,)|

BDBM422119

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1 |(-6.67,-2.31,;-5.33,-1.54,;-4,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;;-1.33,2.31,;-2.67,3.08,;-2.67,4.62,;-4,2.31,;-4,.77,;-5.33,,;-6.67,.77,;-8,,;-9.34,.77,;-8,-1.54,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422120

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |(-6.67,-2.31,;-5.33,-1.54,;-4,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;;-1.33,2.31,;-2.67,3.08,;-2.67,4.62,;-4,2.31,;-4,.77,;-5.33,,;-6.67,.77,;-8,,;-9.34,.77,;-8,-1.54,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422121

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)cc1 |(-6.67,-2.31,;-5.33,-1.54,;-4,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;;-1.33,2.31,;-2.67,3.08,;-2.67,4.62,;-4,2.31,;-4,.77,;-5.33,,;-6.67,.77,;-8,,;-9.34,.77,;-8,-1.54,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422122

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422123

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(nc1)C#N |(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;7.34,,;6,.77,;8.67,-2.31,;10,-3.08,)|

BDBM422124

COc1cccc(OC)c1-n1c(CCC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccc(nc1)C#N |(-7.34,-2.31,;-6,-1.54,;-4.67,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-3.33,-1.54,;-3.33,,;-4.67,.77,;-6,,;-7.34,.77,;-8.67,,;-10,.77,;-8.67,-1.54,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;7.34,,;6,.77,;8.67,-2.31,;10,-3.08,)|

BDBM422125

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1cccc(c1)-c1ccc(F)cc1 |(-6.67,-2.7,;-5.33,-1.92,;-4,-2.7,;-4,-4.24,;-2.67,-5.01,;-1.33,-4.24,;-1.33,-2.7,;,-1.92,;1.33,-2.7,;-2.67,-1.92,;-2.67,-.39,;-1.33,.39,;,-.39,;-1.33,1.92,;-2.67,2.7,;-2.67,4.24,;-4,1.92,;-4,.39,;-5.33,-.39,;-6.67,.39,;-8,-.39,;-9.34,.39,;-8,-1.92,;,2.7,;-.77,4.03,;.77,4.03,;1.33,1.92,;1.33,.39,;2.67,-.39,;4,.39,;4,1.92,;2.67,2.7,;5.33,2.7,;5.33,4.24,;6.67,5.01,;8,4.24,;9.34,5.01,;8,2.7,;6.67,1.92,)|

BDBM422126

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1cccc(c1)-c1ccccc1 |(-6,-2.69,;-4.67,-1.92,;-3.33,-2.69,;-3.33,-4.23,;-2,-5,;-.67,-4.23,;-.67,-2.69,;.67,-1.92,;2,-2.69,;-2,-1.92,;-2,-.39,;-.67,.39,;.67,-.39,;-.67,1.92,;-2,2.69,;-2,4.23,;-3.33,1.92,;-3.33,.39,;-4.67,-.39,;-6,.39,;-7.34,-.39,;-8.67,.39,;-7.34,-1.92,;.67,2.69,;-.1,4.03,;1.44,4.03,;2,1.92,;2,.39,;3.33,-.39,;4.67,.39,;4.67,1.92,;3.33,2.69,;6,2.69,;6,4.23,;7.34,5,;8.67,4.23,;8.67,2.69,;7.34,1.92,)|

BDBM422127

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1cccc(c1)-c1cn(C)nc1C(F)(F)F |(-6.34,-3.21,;-5.01,-2.44,;-3.68,-3.21,;-3.68,-4.75,;-2.34,-5.52,;-1.01,-4.75,;-1.01,-3.21,;.32,-2.44,;1.66,-3.21,;-2.34,-2.44,;-2.34,-.9,;-1.01,-.13,;.32,-.9,;-1.01,1.41,;-2.34,2.18,;-2.34,3.72,;-3.68,1.41,;-3.68,-.13,;-5.01,-.9,;-6.34,-.13,;-7.68,-.9,;-9.01,-.13,;-7.68,-2.44,;.32,2.18,;-.44,3.51,;1.1,3.51,;1.66,1.41,;1.66,-.13,;2.99,-.9,;4.33,-.13,;4.33,1.41,;2.99,2.18,;5.66,2.18,;5.66,3.72,;7.12,4.19,;7.89,5.52,;8.03,2.95,;7.12,1.7,;7.52,.21,;9.01,-.19,;8.61,1.3,;6.43,-.88,)|

BDBM422128

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccccc1-c1ccc(F)cc1 |(-4,-4.62,;-2.67,-3.85,;-1.33,-4.62,;-1.33,-6.16,;,-6.93,;1.33,-6.16,;1.33,-4.62,;2.67,-3.85,;4,-4.62,;,-3.85,;,-2.31,;1.33,-1.54,;2.67,-2.31,;1.33,,;,.77,;,2.31,;-1.33,,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-5.33,-2.31,;-6.67,-1.54,;-5.33,-3.85,;2.67,.77,;1.9,2.1,;3.44,2.1,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;6.67,,;5.33,.77,;5.33,2.31,;6.67,3.08,;6.67,4.62,;5.33,5.39,;5.33,6.93,;4,4.62,;4,3.08,)|

BDBM422129

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccccc1-c1ccccc1 |(-4,-3.85,;-2.67,-3.08,;-1.33,-3.85,;-1.33,-5.39,;,-6.16,;1.33,-5.39,;1.33,-3.85,;2.67,-3.08,;4,-3.85,;,-3.08,;,-1.54,;1.33,-.77,;2.67,-1.54,;1.33,.77,;,1.54,;,3.08,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-4,-.77,;-5.33,-1.54,;-6.67,-.77,;-5.33,-3.08,;2.67,1.54,;1.9,2.87,;3.44,2.87,;4,.77,;4,-.77,;5.33,-1.54,;6.67,-.77,;6.67,.77,;5.33,1.54,;5.33,3.08,;6.67,3.85,;6.67,5.39,;5.33,6.16,;4,5.39,;4,3.85,)|

BDBM422130

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1cccc(c1)-c1ccc(F)nc1 |(-6.67,-2.7,;-5.33,-1.92,;-4,-2.7,;-4,-4.24,;-2.67,-5.01,;-1.33,-4.24,;-1.33,-2.7,;,-1.92,;1.33,-2.7,;-2.67,-1.92,;-2.67,-.39,;-1.33,.39,;,-.39,;-1.33,1.92,;-2.67,2.7,;-2.67,4.24,;-4,1.92,;-4,.39,;-5.33,-.39,;-6.67,.39,;-8,-.39,;-9.34,.39,;-8,-1.92,;,2.7,;-.77,4.03,;.77,4.03,;1.33,1.92,;1.33,.39,;2.67,-.39,;4,.39,;4,1.92,;2.67,2.7,;5.33,2.7,;5.33,4.24,;6.67,5.01,;8,4.24,;9.34,5.01,;8,2.7,;6.67,1.92,)|

BDBM422131

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccccc1-c1ccc(F)nc1 |(-4,-4.62,;-2.67,-3.85,;-1.33,-4.62,;-1.33,-6.16,;,-6.93,;1.33,-6.16,;1.33,-4.62,;2.67,-3.85,;4,-4.62,;,-3.85,;,-2.31,;1.33,-1.54,;2.67,-2.31,;1.33,,;,.77,;,2.31,;-1.33,,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-5.33,-2.31,;-6.67,-1.54,;-5.33,-3.85,;2.67,.77,;1.9,2.1,;3.44,2.1,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;6.67,,;5.33,.77,;5.33,2.31,;4,3.08,;4,4.62,;5.33,5.39,;5.33,6.93,;6.67,4.62,;6.67,3.08,)|

BDBM422132

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccccc1-c1cn(C)nc1C(F)(F)F |(-5.25,-4.16,;-3.91,-3.39,;-2.58,-4.16,;-2.58,-5.7,;-1.24,-6.47,;.09,-5.7,;.09,-4.16,;1.42,-3.39,;2.76,-4.16,;-1.24,-3.39,;-1.24,-1.85,;.09,-1.08,;1.42,-1.85,;.09,.46,;-1.24,1.23,;-1.24,2.77,;-2.58,.46,;-2.58,-1.08,;-3.91,-1.85,;-5.25,-1.08,;-6.58,-1.85,;-7.91,-1.08,;-6.58,-3.39,;1.42,1.23,;.65,2.56,;2.19,2.56,;2.76,.46,;2.76,-1.08,;4.09,-1.85,;5.42,-1.08,;5.42,.46,;4.09,1.23,;4.09,2.77,;2.84,3.67,;3.32,5.14,;2.55,6.47,;4.86,5.14,;5.34,3.67,;6.82,3.27,;6.43,4.76,;7.91,4.36,;7.22,1.79,)|

BDBM422133

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;6.67,.77,;8,,;8,-1.54,;9.34,-2.31,;6.67,-2.31,;5.33,-1.54,;4,-2.31,)|

BDBM422135

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccnc(C)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;8,,;9.34,.77,;6.67,.77,)|

BDBM422136

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(nc1)N1CCOCC1 |(-10.67,.77,;-9.34,,;-8,.77,;-6.67,,;-5.33,.77,;-5.33,2.31,;-4,3.08,;-4,4.62,;-2.67,2.31,;-2.67,.77,;-1.33,,;-4,,;-4,-1.54,;-5.33,-2.31,;-6.67,-1.54,;-8,-2.31,;-5.33,-3.85,;-4,-4.62,;-2.67,-3.85,;-2.67,-2.31,;-1.33,-1.54,;,-2.31,;-1.33,3.08,;-2.1,4.41,;-.56,4.41,;,2.31,;,.77,;1.33,,;2.67,.77,;2.67,2.31,;1.33,3.08,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;6.67,,;5.33,.77,;8,-2.31,;8,-3.85,;9.34,-4.62,;10.67,-3.85,;10.67,-2.31,;9.34,-1.54,)|

BDBM422137

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccccc1OC1CC1 |(-8.67,1.05,;-7.34,.28,;-6,1.05,;-4.67,.28,;-3.33,1.05,;-3.33,2.59,;-2,3.36,;-2,4.9,;-.67,2.59,;-.67,1.05,;.67,.28,;-2,.28,;-2,-1.26,;-3.33,-2.03,;-4.67,-1.26,;-6,-2.03,;-3.33,-3.57,;-2,-4.34,;-.67,-3.57,;-.67,-2.03,;.67,-1.26,;2,-2.03,;.67,3.36,;-.1,4.7,;1.44,4.7,;2,2.59,;2,1.05,;3.33,.28,;4.67,1.05,;4.67,2.59,;3.33,3.36,;6,.28,;7.34,1.05,;8.67,.28,;8.67,-1.26,;7.34,-2.03,;6,-1.26,;4.67,-2.03,;4.67,-3.57,;3.9,-4.9,;5.44,-4.9,)|

BDBM422138

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccnc1OC |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,;4.67,-3.85,)|

BDBM422139

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(cc1)C(C)(C)O |(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;7.34,,;6,.77,;8.67,-2.31,;10,-1.54,;10,-3.08,;8.67,-3.85,)|

BDBM422140

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |(-6.67,-2.31,;-5.33,-1.54,;-4,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;;-1.33,2.31,;-2.67,3.08,;-2.67,4.62,;-4,2.31,;-4,.77,;-5.33,,;-6.67,.77,;-8,,;-9.34,.77,;-8,-1.54,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422141

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccccc1 |(-6,-2.31,;-4.67,-1.54,;-3.33,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;-2,-1.54,;-2,,;-.67,.77,;.67,,;-.67,2.31,;-2,3.08,;-2,4.62,;-3.33,2.31,;-3.33,.77,;-4.67,,;-6,.77,;-7.34,,;-8.67,.77,;-7.34,-1.54,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;8.67,-1.54,;8.67,,;7.34,.77,)|

BDBM422142

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccncc1F |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,)|

BDBM422143

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cc(F)ccc1F |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;6.67,.77,;8,,;9.34,.77,;8,-1.54,;6.67,-2.31,;5.33,-1.54,;4,-2.31,)|

BDBM422144

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)c(F)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;9.34,.77,;6.67,.77,)|

BDBM422145

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cnc(F)c(Cl)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;9.34,.77,;6.67,.77,)|

BDBM422147

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(CN(C)C)cc1 |(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;8.67,-2.31,;8.67,-3.85,;7.34,-4.62,;10,-4.62,;7.34,,;6,.77,)|

BDBM422148

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1CC1 |(-11.44,.64,;-10.11,-.13,;-8.77,.64,;-7.44,-.13,;-6.11,.64,;-6.11,2.18,;-4.77,2.95,;-4.77,4.49,;-3.44,2.18,;-3.44,.64,;-2.1,-.13,;-4.77,-.13,;-4.77,-1.67,;-6.11,-2.44,;-7.44,-1.67,;-8.77,-2.44,;-6.11,-3.98,;-4.77,-4.75,;-3.44,-3.98,;-3.44,-2.44,;-2.1,-1.67,;-.77,-2.44,;-2.1,2.95,;-3.14,4.75,;-1.07,4.75,;-.77,2.18,;-.77,.64,;.56,-.13,;1.9,.64,;1.9,2.18,;.56,2.95,;3.23,-.13,;3.23,-1.67,;4.56,-2.44,;5.9,-1.67,;5.9,-.13,;4.56,.64,;7.23,-2.44,;7.23,-3.98,;8.57,-1.67,;9.9,-2.44,;10.67,-3.77,;11.44,-2.44,)|

BDBM422149

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,)|

BDBM422150

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(nc1)C1CC1 |(-10.11,.77,;-8.77,,;-7.44,.77,;-6.1,,;-4.77,.77,;-4.77,2.31,;-3.44,3.08,;-3.44,4.62,;-2.1,2.31,;-2.1,.77,;-.77,,;-3.44,,;-3.44,-1.54,;-4.77,-2.31,;-6.1,-1.54,;-7.44,-2.31,;-4.77,-3.85,;-3.44,-4.62,;-2.1,-3.85,;-2.1,-2.31,;-.77,-1.54,;.56,-2.31,;-.77,3.08,;-1.54,4.41,;,4.41,;.56,2.31,;.56,.77,;1.9,,;3.23,.77,;3.23,2.31,;1.9,3.08,;4.56,,;4.56,-1.54,;5.9,-2.31,;7.23,-1.54,;7.23,,;5.9,.77,;8.57,-2.31,;9.34,-3.64,;10.11,-2.31,)|

BDBM422151

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccc(F)n1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;8,,;9.34,.77,;6.67,.77,)|

BDBM422152

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccnc(OC)c1 |(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;7.34,,;8.67,.77,;10,,;6,.77,)|

BDBM422153

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(cc1)C(N)=O |(-10,.7,;-8.67,-.07,;-7.34,.7,;-6,-.07,;-4.67,.7,;-4.67,2.24,;-3.33,3.01,;-3.33,4.55,;-2,2.24,;-2,.7,;-.67,-.07,;-3.33,-.07,;-3.33,-1.61,;-4.67,-2.38,;-6,-1.61,;-7.34,-2.38,;-4.67,-3.92,;-3.33,-4.69,;-2,-3.92,;-2,-2.38,;-.67,-1.61,;.67,-2.38,;-.67,3.01,;-1.6,4.62,;.3,4.69,;.67,2.24,;.67,.7,;2,-.07,;3.33,.7,;3.33,2.24,;2,3.01,;4.67,-.07,;4.67,-1.61,;6,-2.38,;7.34,-1.61,;7.34,-.07,;6,.7,;8.67,-2.38,;10,-1.61,;8.67,-3.92,)|

BDBM422154

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccc(OCOC)c1 |(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;7.34,,;8.67,.77,;8.67,2.31,;10,3.08,;10,4.62,;6,.77,)|

BDBM422155

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccccc1C#N |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,;3.33,-3.08,)|

BDBM422156

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)C#N |(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,-2.31,;7.34,-1.54,;7.34,,;6,.77,;8.67,.77,;10,1.54,)|

BDBM422157

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)OC)cc1 |(-10,1.54,;-8.67,.77,;-7.34,1.54,;-6,.77,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-3.33,5.39,;-2,3.08,;-2,1.54,;-.67,.77,;-3.33,.77,;-3.33,-.77,;-4.67,-1.54,;-6,-.77,;-7.34,-1.54,;-4.67,-3.08,;-3.33,-3.85,;-2,-3.08,;-2,-1.54,;-.67,-.77,;.67,-1.54,;-.67,3.85,;-1.44,5.18,;.1,5.18,;.67,3.08,;.67,1.54,;2,.77,;3.33,1.54,;3.33,3.08,;2,3.85,;4.67,.77,;4.67,-.77,;6,-1.54,;7.34,-.77,;8.67,-1.54,;8.67,-3.08,;7.34,-3.85,;10,-3.85,;10,-5.39,;7.34,.77,;6,1.54,)|

BDBM422158

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccccc1COC |(-5.44,-3.08,;-4.1,-3.85,;-2.77,-3.08,;-1.44,-3.85,;-.1,-3.08,;-.1,-1.54,;1.23,-.77,;1.23,.77,;2.56,-1.54,;2.56,-3.08,;3.9,-3.85,;1.23,-3.85,;1.23,-5.39,;-.1,-6.16,;-1.44,-5.39,;-2.77,-6.16,;-.1,-7.7,;1.23,-8.47,;2.56,-7.7,;2.56,-6.16,;3.9,-5.39,;5.23,-6.16,;3.9,-.77,;5.44,-.77,;4.67,-2.1,;3.9,.77,;2.56,1.54,;2.56,3.08,;3.9,3.85,;5.23,3.08,;5.23,1.54,;3.9,5.39,;5.23,6.16,;5.23,7.7,;3.9,8.47,;2.56,7.7,;2.56,6.16,;1.23,5.39,;1.23,3.85,;-.1,3.08,)|

BDBM422159

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;8,,;9.34,.77,;6.67,.77,)|

BDBM422160

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccnc(NC(=O)C2CC2)c1 |(-10.77,.77,;-9.44,,;-8.11,.77,;-6.77,,;-5.44,.77,;-5.44,2.31,;-4.1,3.08,;-4.1,4.62,;-2.77,2.31,;-2.77,.77,;-1.44,,;-4.1,,;-4.1,-1.54,;-5.44,-2.31,;-6.77,-1.54,;-8.11,-2.31,;-5.44,-3.85,;-4.1,-4.62,;-2.77,-3.85,;-2.77,-2.31,;-1.44,-1.54,;-.1,-2.31,;-1.44,3.08,;-2.21,4.41,;-.67,4.41,;-.1,2.31,;-.1,.77,;1.23,,;2.56,.77,;2.56,2.31,;1.23,3.08,;3.9,,;3.9,-1.54,;5.23,-2.31,;6.57,-1.54,;6.57,,;7.9,.77,;7.9,2.31,;6.57,3.08,;9.23,3.08,;10.77,3.08,;10,4.41,;5.23,.77,)|

BDBM422161

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccc2cnccc12 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;8,,;9.34,.77,;9.34,2.31,;8,3.08,;6.67,2.31,;6.67,.77,)|

BDBM422162

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc2n(C)ccc2c1 |(-9.98,.77,;-8.65,,;-7.32,.77,;-5.98,,;-4.65,.77,;-4.65,2.31,;-3.32,3.08,;-3.32,4.62,;-1.98,2.31,;-1.98,.77,;-.65,,;-3.32,,;-3.32,-1.54,;-4.65,-2.31,;-5.98,-1.54,;-7.32,-2.31,;-4.65,-3.85,;-3.32,-4.62,;-1.98,-3.85,;-1.98,-2.31,;-.65,-1.54,;.68,-2.31,;-.65,3.08,;-1.42,4.41,;.12,4.41,;.68,2.31,;.68,.77,;2.02,,;3.35,.77,;3.35,2.31,;2.02,3.08,;4.69,,;6.02,.77,;7.35,,;7.35,-1.54,;8.5,-2.57,;9.98,-2.17,;7.87,-3.98,;6.34,-3.82,;6.02,-2.31,;4.69,-1.54,)|

BDBM422163

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc2ncccc2c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;6.67,.77,;8,,;8,-1.54,;9.34,-2.31,;9.34,-3.85,;8,-4.62,;6.67,-3.85,;6.67,-2.31,;5.33,-1.54,)|

BDBM422164

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(OC(F)(F)F)cc1 |(-10.67,.77,;-9.34,,;-8,.77,;-6.67,,;-5.33,.77,;-5.33,2.31,;-4,3.08,;-4,4.62,;-2.67,2.31,;-2.67,.77,;-1.33,,;-4,,;-4,-1.54,;-5.33,-2.31,;-6.67,-1.54,;-8,-2.31,;-5.33,-3.85,;-4,-4.62,;-2.67,-3.85,;-2.67,-2.31,;-1.33,-1.54,;,-2.31,;-1.33,3.08,;-2.1,4.41,;-.56,4.41,;,2.31,;,.77,;1.33,,;2.67,.77,;2.67,2.31,;1.33,3.08,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;8,-2.31,;9.34,-1.54,;10.67,-2.31,;8.57,-.21,;10.11,-.21,;6.67,,;5.33,.77,)|

BDBM422165

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cc(Cl)cc(Cl)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;6.67,.77,;8,,;9.34,.77,;8,-1.54,;6.67,-2.31,;6.67,-3.85,;5.33,-1.54,)|

BDBM422166

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccccc1F |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,)|

BDBM422167

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)c(F)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;9.34,.77,;6.67,.77,)|

BDBM422168

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(C)c(C)c1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;9.34,.77,;6.67,.77,)|

BDBM422169

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,)|

BDBM422170

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(Cl)nc1C |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;6.67,.77,;8,,;8,-1.54,;9.34,-2.31,;6.67,-2.31,;5.33,-1.54,;4,-2.31,)|

BDBM422171

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(C)cc1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422172

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(C)cc1 |(-5.34,-2.31,;-4,-1.54,;-2.67,-2.31,;-2.67,-3.85,;-1.34,-4.62,;-0,-3.85,;-0,-2.31,;1.33,-1.54,;2.66,-2.31,;-1.34,-1.54,;-1.34,,;-0,.77,;1.33,,;-0,2.31,;-1.34,3.08,;-1.34,4.62,;-2.67,2.31,;-2.67,.77,;-4,,;-4.96,1.2,;-6.22,.38,;-6.67,-.71,;-5.19,-.98,;1.33,3.08,;.56,4.41,;2.1,4.41,;2.66,2.31,;2.66,.77,;4,,;5.33,.77,;6.67,,;5.33,2.31,;4,3.08,)|

BDBM422173

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(cc1)-c1ccnc(NC(=O)C2CC2)c1 |(-9.44,-2.31,;-8.11,-1.54,;-6.77,-2.31,;-6.77,-3.85,;-5.44,-4.62,;-4.11,-3.85,;-4.11,-2.31,;-2.77,-1.54,;-1.44,-2.31,;-5.44,-1.54,;-5.44,-0,;-4.11,.77,;-2.77,-0,;-4.11,2.31,;-5.44,3.08,;-5.44,4.62,;-6.77,2.31,;-6.77,.77,;-8.11,-0,;-9.07,1.19,;-10.32,.38,;-10.77,-.71,;-9.29,-.99,;-2.77,3.08,;-3.67,4.62,;-1.92,4.56,;-1.44,2.31,;-1.44,.77,;-.11,-0,;1.23,.77,;1.23,2.31,;-.11,3.08,;2.56,-0,;2.56,-1.54,;3.89,-2.31,;5.23,-1.54,;5.23,-0,;6.56,.77,;7.9,-0,;7.9,-1.54,;9.23,.77,;10.77,.77,;10,2.1,;3.89,.77,)|

BDBM422174

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccnc(NC(=O)C2CC2)c1 |(-11.44,.69,;-10.1,-.08,;-8.77,.69,;-7.44,-.08,;-6.1,.69,;-6.1,2.23,;-4.77,3,;-4.77,4.54,;-3.44,2.23,;-3.44,.69,;-2.1,-.08,;-4.77,-.08,;-4.77,-1.62,;-6.1,-2.39,;-7.44,-1.62,;-8.77,-2.39,;-6.1,-3.93,;-4.77,-4.7,;-3.44,-3.93,;-3.44,-2.39,;-2.1,-1.62,;-.77,-2.39,;-2.1,3,;-3.08,4.68,;-1.12,4.7,;-.77,2.23,;-.77,.69,;.56,-.08,;1.9,.69,;1.9,2.23,;.56,3,;3.23,-.08,;3.23,-1.62,;4.56,-2.39,;5.9,-1.62,;5.9,-.08,;7.23,.69,;8.57,-.08,;8.57,-1.62,;9.9,.69,;11.44,.69,;10.67,2.02,;4.56,.69,)|

BDBM422176

CCOCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(C)cc1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422177

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)cc1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;5.33,3.08,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422178

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(c(F)c1)-c1ccnc(F)c1C |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;6,3.08,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;7.34,-3.85,;6,-1.54,;4.67,-2.31,)|

BDBM422179

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;5.33,3.08,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422180

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1ccccc1=O |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,)|

BDBM422181

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-n1ccccc1=O |(-6,-2.31,;-4.67,-1.54,;-3.33,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;-2,-1.54,;-2,,;-.67,.77,;.67,,;-.67,2.31,;-2,3.08,;-2,4.62,;-3.33,2.31,;-3.33,.77,;-4.67,,;-6,.77,;-7.34,,;-8.67,.77,;-7.34,-1.54,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;7.34,.77,;8.67,,;8.67,-1.54,;7.34,-2.31,;6,-1.54,;4.67,-2.31,)|

BDBM422182

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1ccc(C)cc1=O |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;6.67,.77,;8,,;8,-1.54,;9.34,-2.31,;6.67,-2.31,;5.33,-1.54,;4,-2.31,)|

BDBM422183

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1cc(F)ccc1=O |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;7.34,-3.85,;8.67,-1.54,;8.67,,;7.34,.77,;7.34,2.31,)|

BDBM422184

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1cc(C)ccc1=O |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;7.34,-3.85,;8.67,-1.54,;8.67,,;7.34,.77,;7.34,2.31,)|

BDBM422185

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cc1)-n1cc(Cl)ccc1=O |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;7.34,-3.85,;8.67,-1.54,;8.67,,;7.34,.77,;7.34,2.31,)|

BDBM422186

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cc1)-n1cc(C)ccc1=O |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,-2.31,;7.34,-3.85,;8.67,-1.54,;8.67,,;7.34,.77,;7.34,2.31,)|

BDBM422187

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ncn(C)n1 |(-8.52,.77,;-7.19,,;-5.85,.77,;-4.52,,;-3.19,.77,;-3.19,2.31,;-1.85,3.08,;-1.85,4.62,;-.52,2.31,;-.52,.77,;.82,,;-1.85,,;-1.85,-1.54,;-3.19,-2.31,;-4.52,-1.54,;-5.85,-2.31,;-3.19,-3.85,;-1.85,-4.62,;-.52,-3.85,;-.52,-2.31,;.82,-1.54,;2.15,-2.31,;.82,3.08,;.05,4.41,;1.59,4.41,;2.15,2.31,;2.15,.77,;3.48,,;4.82,.77,;4.82,2.31,;3.48,3.08,;6.15,,;7.61,.48,;8.52,-.77,;7.61,-2.02,;8.38,-3.35,;6.15,-1.54,)|

BDBM422188

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccs1 |(-8.52,.77,;-7.19,,;-5.85,.77,;-4.52,,;-3.19,.77,;-3.19,2.31,;-1.85,3.08,;-1.85,4.62,;-.52,2.31,;-.52,.77,;.82,,;-1.85,,;-1.85,-1.54,;-3.19,-2.31,;-4.52,-1.54,;-5.85,-2.31,;-3.19,-3.85,;-1.85,-4.62,;-.52,-3.85,;-.52,-2.31,;.82,-1.54,;2.15,-2.31,;.82,3.08,;.05,4.41,;1.59,4.41,;2.15,2.31,;2.15,.77,;3.48,,;4.82,.77,;4.82,2.31,;3.48,3.08,;6.15,,;6.15,-1.54,;7.61,-2.02,;8.52,-.77,;7.61,.48,)|

BDBM422189

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1c(C)nnn1C |(-8.52,.77,;-7.19,,;-5.85,.77,;-4.52,,;-3.19,.77,;-3.19,2.31,;-1.85,3.08,;-1.85,4.62,;-.52,2.31,;-.52,.77,;.82,,;-1.85,,;-1.85,-1.54,;-3.19,-2.31,;-4.52,-1.54,;-5.85,-2.31,;-3.19,-3.85,;-1.85,-4.62,;-.52,-3.85,;-.52,-2.31,;.82,-1.54,;2.15,-2.31,;.82,3.08,;.05,4.41,;1.59,4.41,;2.15,2.31,;2.15,.77,;3.48,,;4.82,.77,;4.82,2.31,;3.48,3.08,;6.15,,;6.15,-1.54,;4.82,-2.31,;7.61,-2.02,;8.52,-.77,;7.61,.48,;8.38,1.81,)|

BDBM422190

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1nc(co1)C(=O)OCC |(-10.38,.79,;-9.04,.02,;-7.71,.79,;-6.38,.02,;-5.04,.79,;-5.04,2.33,;-3.71,3.1,;-3.71,4.64,;-2.38,2.33,;-2.38,.79,;-1.04,.02,;-3.71,.02,;-3.71,-1.52,;-5.04,-2.29,;-6.38,-1.52,;-7.71,-2.29,;-5.04,-3.83,;-3.71,-4.6,;-2.38,-3.83,;-2.38,-2.29,;-1.04,-1.52,;.29,-2.29,;-1.04,3.1,;-1.94,4.65,;-.14,4.66,;.29,2.33,;.29,.79,;1.63,.02,;2.96,.79,;2.96,2.33,;1.63,3.1,;4.29,.02,;4.29,-1.52,;5.76,-1.99,;6.66,-.75,;5.76,.5,;6.53,-3.33,;5.76,-4.66,;8.07,-3.33,;8.84,-1.99,;10.38,-1.99,)|

BDBM422191

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1nc(C(=O)OC)c(C)s1 |(-9.61,.8,;-8.27,.03,;-6.94,.8,;-5.61,.03,;-4.27,.8,;-4.27,2.34,;-2.94,3.11,;-2.94,4.65,;-1.61,2.34,;-1.61,.8,;-.27,.03,;-2.94,.03,;-2.94,-1.51,;-4.27,-2.28,;-5.61,-1.51,;-6.94,-2.28,;-4.27,-3.82,;-2.94,-4.59,;-1.61,-3.82,;-1.61,-2.28,;-.27,-1.51,;1.06,-2.28,;-.27,3.11,;-1.04,4.45,;.5,4.45,;1.06,2.34,;1.06,.8,;2.4,.03,;3.73,.8,;3.73,2.34,;2.4,3.11,;5.06,.03,;5.06,-1.51,;6.53,-1.98,;7.3,-3.32,;6.53,-4.65,;8.84,-3.32,;9.61,-1.98,;7.43,-.74,;8.77,.03,;6.53,.51,)|

BDBM422192

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(cc1)C1CC1 |(-6.11,-2.31,;-4.77,-1.54,;-3.44,-2.31,;-3.44,-3.85,;-2.11,-4.62,;-.77,-3.85,;-.77,-2.31,;.56,-1.54,;1.89,-2.31,;-2.11,-1.54,;-2.11,,;-.77,.77,;.56,,;-.77,2.31,;-2.11,3.08,;-2.11,4.62,;-3.44,2.31,;-3.44,.77,;-4.77,,;-5.73,1.2,;-6.99,.38,;-7.44,-.71,;-5.96,-.98,;.56,3.08,;-.21,4.41,;1.33,4.41,;1.89,2.31,;1.89,.77,;3.23,,;4.56,.77,;4.56,2.31,;3.23,3.08,;5.9,,;6.67,-1.33,;7.44,,)|

BDBM422193

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cc1)C1CC1 |(-8.11,.77,;-6.77,,;-5.44,.77,;-4.1,,;-2.77,.77,;-2.77,2.31,;-1.44,3.08,;-1.44,4.62,;-.1,2.31,;-.1,.77,;1.23,,;-1.44,,;-1.44,-1.54,;-2.77,-2.31,;-4.1,-1.54,;-5.44,-2.31,;-2.77,-3.85,;-1.44,-4.62,;-.1,-3.85,;-.1,-2.31,;1.23,-1.54,;2.56,-2.31,;1.23,3.08,;.46,4.41,;2,4.41,;2.56,2.31,;2.56,.77,;3.9,,;5.23,.77,;5.23,2.31,;3.9,3.08,;6.57,,;7.34,-1.33,;8.11,,)|

BDBM422194

CCOCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cc1)C1CC1 |(-8.11,.77,;-6.77,,;-5.44,.77,;-4.1,,;-2.77,.77,;-2.77,2.31,;-1.44,3.08,;-1.44,4.62,;-.1,2.31,;-.1,.77,;1.23,,;-1.44,,;-1.44,-1.54,;-2.77,-2.31,;-4.1,-1.54,;-5.44,-2.31,;-2.77,-3.85,;-1.44,-4.62,;-.1,-3.85,;-.1,-2.31,;1.23,-1.54,;2.56,-2.31,;1.23,3.08,;.46,4.41,;2,4.41,;2.56,2.31,;2.56,.77,;3.9,,;5.23,.77,;5.23,2.31,;3.9,3.08,;6.57,,;7.34,-1.33,;8.11,,)|

BDBM422195

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)NC1CC1 |(-9.44,.77,;-8.11,,;-6.77,.77,;-5.44,,;-4.1,.77,;-4.1,2.31,;-2.77,3.08,;-2.77,4.62,;-1.44,2.31,;-1.44,.77,;-.1,,;-2.77,,;-2.77,-1.54,;-4.1,-2.31,;-5.44,-1.54,;-6.77,-2.31,;-4.1,-3.85,;-2.77,-4.62,;-1.44,-3.85,;-1.44,-2.31,;-.1,-1.54,;1.23,-2.31,;-.1,3.08,;-.87,4.41,;.67,4.41,;1.23,2.31,;1.23,.77,;2.56,,;3.9,.77,;3.9,2.31,;2.56,3.08,;5.23,,;5.23,-1.54,;6.57,.77,;7.9,,;8.67,-1.33,;9.44,,)|

BDBM422196

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)NC |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;4.67,2.31,;3.33,3.08,;6,,;6,-1.54,;7.34,.77,;8.67,,)|

BDBM422197

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)N1CC(F)(F)C1 |(-9.61,.72,;-8.28,-.05,;-6.94,.72,;-5.61,-.05,;-4.28,.72,;-4.28,2.26,;-2.94,3.03,;-2.94,4.56,;-1.61,2.26,;-1.61,.72,;-.28,-.05,;-2.94,-.05,;-2.94,-1.59,;-4.28,-2.36,;-5.61,-1.59,;-6.94,-2.36,;-4.28,-3.9,;-2.94,-4.67,;-1.61,-3.9,;-1.61,-2.36,;-.28,-1.59,;1.06,-2.36,;-.28,3.03,;-1.21,4.64,;.68,4.67,;1.06,2.26,;1.06,.72,;2.39,-.05,;3.72,.72,;3.72,2.26,;2.39,3.03,;5.06,-.05,;5.06,-1.59,;6.39,.72,;7.88,.32,;8.28,1.8,;9.61,2.57,;7.88,3.29,;6.79,2.2,)|

BDBM422198

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)N1CC(C)(O)C1 |(-9.61,.77,;-8.28,,;-6.94,.77,;-5.61,,;-4.28,.77,;-4.28,2.31,;-2.94,3.08,;-2.94,4.62,;-1.61,2.31,;-1.61,.77,;-.28,,;-2.94,,;-2.94,-1.54,;-4.28,-2.31,;-5.61,-1.54,;-6.94,-2.31,;-4.28,-3.85,;-2.94,-4.62,;-1.61,-3.85,;-1.61,-2.31,;-.28,-1.54,;1.06,-2.31,;-.28,3.08,;-1.14,4.57,;.61,4.61,;1.06,2.31,;1.06,.77,;2.39,,;3.72,.77,;3.72,2.31,;2.39,3.08,;5.06,,;5.06,-1.54,;6.39,.77,;7.88,.37,;8.28,1.86,;7.88,3.35,;9.61,2.63,;6.79,2.26,)|

BDBM422199

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)N1CCC(F)(F)C1 |(-9.96,.77,;-8.62,,;-7.29,.77,;-5.96,,;-4.62,.77,;-4.62,2.31,;-3.29,3.08,;-3.29,4.62,;-1.95,2.31,;-1.95,.77,;-.62,,;-3.29,,;-3.29,-1.54,;-4.62,-2.31,;-5.96,-1.54,;-7.29,-2.31,;-4.62,-3.85,;-3.29,-4.62,;-1.95,-3.85,;-1.95,-2.31,;-.62,-1.54,;.71,-2.31,;-.62,3.08,;-1.39,4.41,;.15,4.41,;.71,2.31,;.71,.77,;2.05,,;3.38,.77,;3.38,2.31,;2.05,3.08,;4.71,,;4.71,-1.54,;6.05,.77,;6.05,2.31,;7.51,2.79,;8.42,1.54,;9.19,2.87,;9.96,1.54,;7.51,.29,)|

BDBM422200

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)N1CCOCC1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,.77,;8,,;9.34,.77,;9.34,2.31,;8,3.08,;6.67,2.31,)|

BDBM422201

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1ccc(F)nc1 |(-10.67,.77,;-9.34,,;-8,.77,;-6.67,,;-5.33,.77,;-5.33,2.31,;-4,3.08,;-4,4.62,;-2.67,2.31,;-2.67,.77,;-1.33,,;-4,,;-4,-1.54,;-5.33,-2.31,;-6.67,-1.54,;-8,-2.31,;-5.33,-3.85,;-4,-4.62,;-2.67,-3.85,;-2.67,-2.31,;-1.33,-1.54,;,-2.31,;-1.33,3.08,;-2.1,4.41,;-.56,4.41,;,2.31,;,.77,;1.33,,;2.67,.77,;2.67,2.31,;1.33,3.08,;4,,;4,-1.54,;5.33,.77,;6.67,,;6.67,-1.54,;8,-2.31,;9.34,-1.54,;10.67,-2.31,;9.34,,;8,.77,)|

BDBM422202

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccccn1 |(-4,-2.31,;-2.67,-1.54,;-1.33,-2.31,;-1.33,-3.85,;,-4.62,;1.33,-3.85,;1.33,-2.31,;2.67,-1.54,;4,-2.31,;,-1.54,;;1.33,.77,;2.67,,;1.33,2.31,;,3.08,;,4.62,;-1.33,2.31,;-1.33,.77,;-2.67,,;-4,.77,;-5.33,,;-6.67,.77,;-5.33,-1.54,;2.67,3.08,;1.9,4.41,;3.44,4.41,;4,2.31,;4,.77,;5.33,,;6.67,.77,;6.67,2.31,;5.33,3.08,)|

BDBM422203

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1cc(C)oc1C |(-6.52,.77,;-5.19,,;-3.85,.77,;-2.52,,;-1.18,.77,;-1.18,2.31,;.15,3.08,;.15,4.62,;1.48,2.31,;1.48,.77,;2.82,,;.15,,;.15,-1.54,;-1.18,-2.31,;-2.52,-1.54,;-3.85,-2.31,;-1.18,-3.85,;.15,-4.62,;1.48,-3.85,;1.48,-2.31,;2.82,-1.54,;4.15,-2.31,;2.82,3.08,;2.05,4.41,;3.59,4.41,;4.15,2.31,;4.15,.77,;5.61,.29,;6.38,-1.04,;6.52,1.54,;5.61,2.79,;6.38,4.12,)|

BDBM422204

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cn1)C1CC1 |(-8.1,.77,;-6.77,,;-5.44,.77,;-4.1,,;-2.77,.77,;-2.77,2.31,;-1.44,3.08,;-1.44,4.62,;-.1,2.31,;-.1,.77,;1.23,,;-1.44,,;-1.44,-1.54,;-2.77,-2.31,;-4.1,-1.54,;-5.44,-2.31,;-2.77,-3.85,;-1.44,-4.62,;-.1,-3.85,;-.1,-2.31,;1.23,-1.54,;2.56,-2.31,;1.23,3.08,;.46,4.41,;2,4.41,;2.56,2.31,;2.56,.77,;3.9,,;5.23,.77,;5.23,2.31,;3.9,3.08,;6.57,,;7.34,-1.33,;8.1,,)|

BDBM422205

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cn1)C1CC1 |(-8.11,.77,;-6.77,,;-5.44,.77,;-4.1,,;-2.77,.77,;-2.77,2.31,;-1.44,3.08,;-1.44,4.62,;-.1,2.31,;-.1,.77,;1.23,,;-1.44,,;-1.44,-1.54,;-2.77,-2.31,;-4.1,-1.54,;-5.44,-2.31,;-2.77,-3.85,;-1.44,-4.62,;-.1,-3.85,;-.1,-2.31,;1.23,-1.54,;2.56,-2.31,;1.23,3.08,;.46,4.41,;2,4.41,;2.56,2.31,;2.56,.77,;3.9,,;5.23,.77,;5.23,2.31,;3.9,3.08,;6.57,,;7.34,-1.33,;8.11,,)|

BDBM422206

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cn1)-c1ccc(F)cc1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,-2.31,;8,-1.54,;9.34,-2.31,;8,,;6.67,.77,)|

BDBM422207

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(C)cn1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422208

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)C1CCN(CC)CC1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;7.34,-1.54,;6,2.31,;4.67,3.08,)|

BDBM422209

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)C1CCN(Cc2cccc(F)c2F)CC1 |(-8.67,.77,;-7.34,,;-6,.77,;-4.67,,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,2.31,;-.67,.77,;.67,,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-6,-2.31,;-3.33,-3.85,;-2,-4.62,;-.67,-3.85,;-.67,-2.31,;.67,-1.54,;2,-2.31,;.67,3.08,;-.1,4.41,;1.44,4.41,;2,2.31,;2,.77,;3.33,,;4.67,.77,;6,,;6,-1.54,;4.67,-2.31,;4.67,-3.85,;6,-4.62,;7.34,-3.85,;8.67,-4.62,;7.34,-2.31,;8.67,-1.54,;4.67,2.31,;3.33,3.08,)|

BDBM422210

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)C1CCN(CC1)C(=O)c1ccccc1 |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,.77,;8,,;9.34,.77,;9.34,2.31,;8,3.08,;6.67,2.31,)|

BDBM422211

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)C1CCN(CC1)C(=O)c1ccc(Cl)cc1 |(-10,.77,;-8.67,,;-7.33,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.33,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;4.67,-1.54,;6,.77,;7.33,,;8.67,.77,;8.67,2.31,;10,3.08,;7.33,3.08,;6,2.31,)|

BDBM422212

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)C1CCN(CC1)C(=O)C1CC1 |(-8.77,.77,;-7.44,,;-6.1,.77,;-4.77,,;-3.44,.77,;-3.44,2.31,;-2.1,3.08,;-2.1,4.62,;-.77,2.31,;-.77,.77,;.56,,;-2.1,,;-2.1,-1.54,;-3.44,-2.31,;-4.77,-1.54,;-6.1,-2.31,;-3.44,-3.85,;-2.1,-4.62,;-.77,-3.85,;-.77,-2.31,;.56,-1.54,;1.9,-2.31,;.56,3.08,;-.21,4.41,;1.33,4.41,;1.9,2.31,;1.9,.77,;3.23,,;4.56,.77,;4.56,2.31,;3.23,3.08,;5.9,,;5.9,-1.54,;7.23,.77,;8.77,.77,;8,2.1,)|

BDBM422213

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)C1CCN(CC1)C(=O)CC(F)(F)F |(-9.34,.77,;-8,,;-6.67,.77,;-5.33,,;-4,.77,;-4,2.31,;-2.67,3.08,;-2.67,4.62,;-1.33,2.31,;-1.33,.77,;;-2.67,,;-2.67,-1.54,;-4,-2.31,;-5.33,-1.54,;-6.67,-2.31,;-4,-3.85,;-2.67,-4.62,;-1.33,-3.85,;-1.33,-2.31,;,-1.54,;1.33,-2.31,;,3.08,;-.77,4.41,;.77,4.41,;1.33,2.31,;1.33,.77,;2.67,,;4,.77,;4,2.31,;2.67,3.08,;5.33,,;5.33,-1.54,;6.67,.77,;8,,;9.34,.77,;8,1.54,;8,-1.54,)|

BDBM422214

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)C1CCN(CC1)c1nnc(o1)C1CC1 |(-9.12,.9,;-7.79,.13,;-6.45,.9,;-5.12,.13,;-3.78,.9,;-3.78,2.44,;-2.45,3.21,;-2.45,4.75,;-1.12,2.44,;-1.12,.9,;.22,.13,;-2.45,.13,;-2.45,-1.41,;-3.78,-2.18,;-5.12,-1.41,;-6.45,-2.18,;-3.78,-3.72,;-2.45,-4.49,;-1.12,-3.72,;-1.12,-2.18,;.22,-1.41,;1.55,-2.18,;.22,3.21,;-.55,4.55,;.99,4.55,;1.55,2.44,;1.55,.9,;2.88,.13,;4.22,.9,;4.22,2.44,;2.88,3.21,;5.55,.13,;7.02,.61,;7.92,-.64,;7.02,-1.88,;5.55,-1.41,;7.79,-3.21,;7.79,-4.75,;9.12,-3.98,)|

BDBM422215

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422216

CCCCc1nc(=O)c(c(O)n1C1CCc2ccccc12)S(=O)(=O)c1ccc(Br)cc1

BDBM422217

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422218

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1C#N)S(=O)(=O)c1ccc(Br)cc1 |(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-.77,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422219

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422220

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(OC)c1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422221

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422222

CCCCc1nc(=O)c(c(O)n1[C@H](CC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422223

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422224

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1)S(=O)(=O)c1ccc(C)cc1 |r|

BDBM422225

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccccc1)S(=O)(=O)c1ccc(C)cc1 |r|

BDBM422226

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422227

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422228

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422229

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422230

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422231

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422232

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(C)cc1 |r|

BDBM422233

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422234

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422235

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1C#N)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |(-9.34,1.18,;-8,.41,;-6.67,1.18,;-5.33,.41,;-4,1.18,;-4,2.72,;-2.67,3.49,;-2.67,5.03,;-1.33,2.72,;-1.33,1.18,;,.41,;-2.67,.41,;-2.67,-1.95,;-4,-2.72,;-5.33,-1.95,;-5.33,-.41,;-4,-4.26,;-2.67,-5.03,;-1.33,-4.26,;-1.33,-2.72,;,-1.95,;1.33,-1.18,;,3.49,;-.77,4.82,;.77,4.82,;1.33,2.72,;1.33,1.18,;2.67,.41,;4,1.18,;4,2.72,;2.67,3.49,;5.33,.41,;5.33,-1.13,;6.67,-1.9,;8,-1.13,;8,.41,;9.34,1.18,;6.67,1.18,)|

BDBM422236

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422237

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422238

CCCCc1nc(=O)c(c(O)n1[C@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422239

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(OC)c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422240

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(OC)c1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422241

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(OC)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422242

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(OC)nc1C |r|

BDBM422243

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422244

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422245

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422246

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(C)c1 |r|

BDBM422247

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cnc(F)cc1C |r|

BDBM422248

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(C)c1 |r|

BDBM422249

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cc(C)nc(C)c1 |r|

BDBM422250

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422251

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(C)c1 |r|

BDBM422252

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422253

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422254

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422255

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cncc(C)c1 |r|

BDBM422256

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cc(C)nc(C)c1 |r|

BDBM422257

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422258

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422259

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422260

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(OC)c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422261

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422262

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(OC)nc1C |r|

BDBM422263

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422264

CCCCC1NC(=O)C(=C(O)N1[C@@H](CC)c1cccc(OC)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r,t:8|

BDBM422265

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cnc(F)cc1C |r|

BDBM422266

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422267

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422268

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422269

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422270

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422271

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422272

CCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422273

COC[C@@H](c1ccccc1)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422274

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422275

COC[C@@H](c1ccccc1)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422276

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422277

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422278

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422279

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422280

CCCCc1nc(O)c(c(=O)n1C(C1CC1)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1

BDBM422281

CCCCc1nc(O)c(c(=O)n1C(C)c1cccnc1)S(=O)(=O)c1ccc(Br)cc1

BDBM422282

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422283

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422284

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422285

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422286

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422287

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422288

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422289

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422290

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422291

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422292

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422294

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(Cl)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422295

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C

BDBM422296

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C

BDBM422297

CCCCc1nc(=O)c(c(O)n1C(C)c1cccnc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C

BDBM422298

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C

BDBM422300

CCCCc1nc(=O)c(c(O)n1C(C)c1cccnc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C

BDBM422301

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C

BDBM422302

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422303

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1CCC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422304

CC[C@@H](c1ccccc1)n1c(CCC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422305

CCCCc1nc(=O)c(c(O)n1[C@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422306

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc2OCOc2c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422307

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422308

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(F)c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422309

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(F)c1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422311

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc2OCOc2c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422312

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1cccc(F)c1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422313

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422314

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc2OCOc2c1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422315

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1ccc2OCOc2c1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422316

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc2OCOc2c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422317

CCCCc1nc(=O)c(c(O)n1[C@H]1CCCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422319

CCCCc1nc(=O)c(c(O)n1[C@H]1CCCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422320

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422321

CCCCc1nc(=O)c(c(O)n1[C@H]1CCCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422322

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422323

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422325

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422326

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422327

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422328

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422329

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422330

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1OC)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422331

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422333

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422334

CCCCc1nc(O)c(c(=O)n1[C@H]1CCCc2ccccc12)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422335

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422336

CCCCc1nc(=O)c(c(O)n1[C@H]1CCCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422337

CCCCc1nc(O)c(c(=O)n1[C@@H](C)c1ccccc1OC)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422338

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422339

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422341

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422342

CCCCCc1nc(=O)c(c(O)n1[C@@H](CO)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422343

CCCCc1nc(=O)c(c(O)n1[C@H]1CCCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422344

CCCCc1nc(=O)c(c(O)n1[C@@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422345

CCCCCc1nc(=O)c(c(O)n1[C@@H](CO)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422346

CCCCc1nc(O)c(c(=O)n1[C@@H](C)c1ccc(OC)cc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422347

CCCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422348

CCCCCc1nc(=O)c(c(O)n1[C@@H](CO)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422349

CCCCCc1nc(=O)c(c(O)n1[C@@H](CO)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422350

CCCCCc1nc(=O)c(c(O)n1[C@@H](CO)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422351

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422352

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc2OCOc2c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422354

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422355

CCCCc1nc(O)c(c(=O)n1[C@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422356

CCCCc1nc(=O)c(c(O)n1[C@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422357

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422358

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422360

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422361

CCCCc1nc(=O)c(c(O)n1[C@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422362

CCCCc1nc(=O)c(c(O)n1[C@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422363

CCCCc1nc(O)c(c(=O)n1[C@@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422364

CCCCc1nc(=O)c(c(O)n1[C@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422365

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422366

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc2OCOc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422367

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(cc1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422368

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(cc1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422369

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(cc1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422370

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(cc1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422371

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1-c1cncc(C)c1)S(=O)(=O)c1ccc(Br)cc1 |(-5.44,-2.31,;-4.1,-1.54,;-2.77,-2.31,;-2.77,-3.85,;-1.44,-4.62,;-.1,-3.85,;-.1,-2.31,;1.23,-1.54,;2.57,-2.31,;-1.44,-1.54,;-1.44,,;-.1,.77,;1.23,,;-.1,2.31,;-1.44,3.08,;-1.44,4.62,;-2.77,2.31,;-2.77,.77,;-4.1,,;-4.87,-1.33,;-6.41,-1.33,;-7.18,,;-6.41,1.33,;-7.18,2.67,;-4.87,1.33,;1.23,3.08,;.46,4.41,;2,4.41,;2.72,2.68,;3.12,1.19,;4.61,.8,;5.69,1.88,;7.18,1.49,;5.3,3.37,;3.81,3.77,)|

BDBM422372

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1-c1cncc(C)c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |(-6.92,-2.31,;-5.59,-1.54,;-4.26,-2.31,;-4.26,-3.85,;-2.92,-4.62,;-1.59,-3.85,;-1.59,-2.31,;-.26,-1.54,;1.08,-2.31,;-2.92,-1.54,;-2.92,,;-1.59,.77,;-.26,,;-1.59,2.31,;-2.92,3.08,;-2.92,4.62,;-4.26,2.31,;-4.26,.77,;-5.59,,;-6.36,-1.33,;-7.9,-1.33,;-8.67,,;-7.9,1.33,;-8.67,2.67,;-6.36,1.33,;-.26,3.08,;-1.03,4.41,;.51,4.41,;1.23,2.68,;1.63,1.19,;3.12,.8,;4.21,1.88,;3.81,3.37,;2.32,3.77,;5.69,1.49,;6.78,2.57,;8.27,2.18,;8.67,.69,;7.58,-.4,;6.09,-0,;5,-1.09,)|

BDBM422373

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1-c1ccc(F)cc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |(-6.15,-2.31,;-4.82,-1.54,;-3.49,-2.31,;-3.49,-3.85,;-2.15,-4.62,;-.82,-3.85,;-.82,-2.31,;.51,-1.54,;1.85,-2.31,;-2.15,-1.54,;-2.15,,;-.82,.77,;.51,,;-.82,2.31,;-2.15,3.08,;-2.15,4.62,;-3.49,2.31,;-3.49,.77,;-4.82,,;-5.59,1.33,;-7.13,1.33,;-7.9,,;-9.44,,;-7.13,-1.33,;-5.59,-1.33,;.51,3.08,;-.26,4.41,;1.28,4.41,;2,2.68,;2.4,1.19,;3.89,.8,;4.98,1.88,;4.58,3.37,;3.09,3.77,;6.46,1.49,;7.55,2.57,;9.04,2.18,;9.44,.69,;8.35,-.4,;6.86,-0,;5.77,-1.09,)|

BDBM422374

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1-c1cncc(C)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |(-6.92,-2.31,;-5.59,-1.54,;-4.26,-2.31,;-4.26,-3.85,;-2.92,-4.62,;-1.59,-3.85,;-1.59,-2.31,;-.26,-1.54,;1.08,-2.31,;-2.92,-1.54,;-2.92,,;-1.59,.77,;-.26,,;-1.59,2.31,;-2.92,3.08,;-2.92,4.62,;-4.26,2.31,;-4.26,.77,;-5.59,,;-6.36,-1.33,;-7.9,-1.33,;-8.67,,;-7.9,1.33,;-8.67,2.67,;-6.36,1.33,;-.26,3.08,;-1.03,4.41,;.51,4.41,;1.23,2.68,;1.63,1.19,;3.12,.8,;4.21,1.88,;3.81,3.37,;2.32,3.77,;5.69,1.49,;6.78,2.57,;8.27,2.18,;8.67,.69,;7.58,-.4,;7.98,-1.89,;6.09,-0,;5,-1.09,)|

BDBM422375

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1-c1cncc(C)c1)S(=O)(=O)c1ccc(cc1)-n1cc(Cl)ccc1=O |(-6.92,-2.31,;-5.59,-1.54,;-4.26,-2.31,;-4.26,-3.85,;-2.92,-4.62,;-1.59,-3.85,;-1.59,-2.31,;-.26,-1.54,;1.08,-2.31,;-2.92,-1.54,;-2.92,,;-1.59,.77,;-.26,,;-1.59,2.31,;-2.92,3.08,;-2.92,4.62,;-4.26,2.31,;-4.26,.77,;-5.59,,;-6.36,-1.33,;-7.9,-1.33,;-8.67,,;-7.9,1.33,;-8.67,2.67,;-6.36,1.33,;-.26,3.08,;-1.03,4.41,;.51,4.41,;1.23,2.68,;1.63,1.19,;3.12,.8,;4.21,1.88,;3.81,3.37,;2.32,3.77,;5.69,1.49,;6.09,-0,;7.58,-.4,;7.98,-1.89,;8.67,.69,;8.27,2.18,;6.78,2.57,;6.39,4.06,)|

BDBM422376

COc1cccc(OC)c1-n1c(O)c(c(=O)nc1-c1cncc(C)c1)S(=O)(=O)c1ccc(cc1)C1CC1 |(-6.18,-2.31,;-4.85,-1.54,;-3.51,-2.31,;-3.51,-3.85,;-2.18,-4.62,;-.85,-3.85,;-.85,-2.31,;.49,-1.54,;1.82,-2.31,;-2.18,-1.54,;-2.18,,;-.85,.77,;.49,,;-.85,2.31,;-2.18,3.08,;-2.18,4.62,;-3.51,2.31,;-3.51,.77,;-4.85,,;-5.62,-1.33,;-7.16,-1.33,;-7.93,,;-7.16,1.33,;-7.93,2.67,;-5.62,1.33,;.49,3.08,;-.28,4.41,;1.26,4.41,;1.98,2.68,;2.37,1.19,;3.86,.8,;4.95,1.88,;4.55,3.37,;3.06,3.77,;6.44,1.49,;7.53,.4,;7.93,1.88,)|

BDBM422377

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422378

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(cc1)-c1cncc(C)c1 |r|

BDBM422379

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422380

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCC1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422381

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422382

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422383

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422384

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-n1ccccc1=O |r|

BDBM422385

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-n1cc(Cl)ccc1=O |r|

BDBM422386

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422387

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422388

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422389

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cnc(C)nc1 |r|

BDBM422390

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(C)c1 |r|

BDBM422391

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(Br)c(F)c1 |r|

BDBM422392

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422393

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422394

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422395

CCOCc1nc(=O)c(c(O)n1C(COC)c1cccc(F)c1)S(=O)(=O)c1ccc(Br)c(F)c1

BDBM422396

CC(C)OCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422397

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(Br)c(F)c1 |r|

BDBM422398

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(Br)c(F)c1 |r|

BDBM422399

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422400

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)C1CC1 |r|

BDBM422401

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1C |r|

BDBM422402

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422403

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422404

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422405

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422406

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(OC)nc1C |r|

BDBM422407

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422408

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422409

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422410

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422411

CC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422412

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422413

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422414

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422415

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422416

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422417

CC(C)OCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422418

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422419

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422420

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422421

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422422

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422423

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422424

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422425

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422426

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422427

CC(C)OCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422428

CC(C)OCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422429

CC(C)OCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422430

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1ccnc(F)c1C |r|

BDBM422431

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1)S(=O)(=O)c1ccc(cc1)-c1cncc(F)c1 |r|

BDBM422432

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1 |r|

BDBM422433

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1ccncc1C |r|

BDBM422434

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(F)c(F)c1 |r|

BDBM422435

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(c(F)c1)-c1ccnc(F)c1C |r|

BDBM422436

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1C |r|

BDBM422437

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(c(F)c1)-c1ccncc1C |r|

BDBM422438

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1ccccc1)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1 |r|

BDBM422439

CCOCc1nc(=O)c(c(O)n1[C@H]1CCOc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422440

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(c(F)c1)-c1ccnc(F)c1C |r|

BDBM422441

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1C |r|

BDBM422442

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(c(F)c1)-c1ccncc1C |r|

BDBM422443

CCOCc1nc(=O)c(c(O)n1C(COC)c1cccc(F)c1)S(=O)(=O)c1ccc(c(F)c1)-c1ccnc(F)c1C

BDBM422444

CCOCc1nc(=O)c(c(O)n1C(COC)c1cccc(F)c1)S(=O)(=O)c1ccc(c(F)c1)-c1ccc(F)nc1C

BDBM422445

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)C1CC1 |r|

BDBM422446

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCO1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422447

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCO1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422450

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCO1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422451

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCO1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |r|

BDBM422452

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1C1CCCO1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422457

CCOCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cc1)C(C)(C)C |(-8,.77,;-6.67,,;-5.33,.77,;-4,,;-2.67,.77,;-2.67,2.31,;-1.33,3.08,;-1.33,4.62,;,2.31,;,.77,;1.33,,;-1.33,,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-5.33,-2.31,;-2.67,-3.85,;-1.33,-4.62,;,-3.85,;,-2.31,;1.33,-1.54,;2.67,-2.31,;1.33,3.08,;.56,4.41,;2.1,4.41,;2.67,2.31,;2.67,.77,;4,,;5.33,.77,;5.33,2.31,;4,3.08,;6.67,,;6.67,-1.54,;8,.77,;8,-.77,)|

BDBM422458

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)c1ccc(cc1)C(C)(C)C |(-8,.77,;-6.67,,;-5.33,.77,;-4,,;-2.67,.77,;-2.67,2.31,;-1.33,3.08,;-1.33,4.62,;,2.31,;,.77,;1.33,,;-1.33,,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-5.33,-2.31,;-2.67,-3.85,;-1.33,-4.62,;,-3.85,;,-2.31,;1.33,-1.54,;2.67,-2.31,;1.33,3.08,;.56,4.41,;2.1,4.41,;2.67,2.31,;2.67,.77,;4,,;5.33,.77,;5.33,2.31,;4,3.08,;6.67,,;6.67,-1.54,;8,.77,;8,-.77,)|

BDBM422459

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C(C)(C)C |(-8,.77,;-6.67,,;-5.33,.77,;-4,,;-2.67,.77,;-2.67,2.31,;-1.33,3.08,;-1.33,4.62,;,2.31,;,.77,;1.33,,;-1.33,,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-5.33,-2.31,;-2.67,-3.85,;-1.33,-4.62,;,-3.85,;,-2.31,;1.33,-1.54,;2.67,-2.31,;1.33,3.08,;.56,4.41,;2.1,4.41,;2.67,2.31,;2.67,.77,;4,,;5.33,.77,;5.33,2.31,;4,3.08,;6.67,,;6.67,-1.54,;8,.77,;8,-.77,)|

BDBM422460

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)[C@H]1CC[C@@H](CC1)OCc1ccccc1 |r,wU:25.26,wD:28.33,(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;2,3.08,;3.33,2.31,;3.33,.77,;2,,;.67,.77,;4.67,,;6,.77,;7.34,,;7.34,-1.54,;8.67,-2.31,;10,-1.54,;10,,;8.67,.77,)|

BDBM422461

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)[C@@H]1CC[C@@H](CC1)OCc1ccccc1 |r,wU:25.26,28.33,(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;6,.77,;7.34,,;7.34,-1.54,;8.67,-2.31,;10,-1.54,;10,,;8.67,.77,)|

BDBM422462

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)[C@H]1CC[C@@H](CC1)OCc1ccccc1 |r,wU:25.26,wD:28.33,(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;2,3.08,;3.33,2.31,;3.33,.77,;2,,;.67,.77,;4.67,,;6,.77,;7.34,,;7.34,-1.54,;8.67,-2.31,;10,-1.54,;10,,;8.67,.77,)|

BDBM422463

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)[C@@H]1CC[C@@H](CC1)OCc1ccccc1 |r,wU:25.26,28.33,(-10,.77,;-8.67,,;-7.34,.77,;-6,,;-4.67,.77,;-4.67,2.31,;-3.33,3.08,;-3.33,4.62,;-2,2.31,;-2,.77,;-.67,,;-3.33,,;-3.33,-1.54,;-4.67,-2.31,;-6,-1.54,;-7.34,-2.31,;-4.67,-3.85,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;.67,-2.31,;-.67,3.08,;-1.44,4.41,;.1,4.41,;.67,2.31,;.67,.77,;2,,;3.33,.77,;3.33,2.31,;2,3.08,;4.67,,;6,.77,;7.34,,;7.34,-1.54,;8.67,-2.31,;10,-1.54,;10,,;8.67,.77,)|

BDBM422464

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422465

CC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422466

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422467

COC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422468

CC(C)OCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(Br)cc1 |r|

BDBM422473

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422474

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422476

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422477

CC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422478

CC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422479

CC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422480

CC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422481

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422482

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422483

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422484

CCOCc1nc(=O)c(c(O)n1[C@@H](COC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422485

COC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422486

COC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422487

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cncc(c1)C#N |r|

BDBM422488

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422489

COC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cn(C)nc1C |r|

BDBM422490

COC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1c[nH]nc1C |r|

BDBM422491

COC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422492

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cn(C)nc1C |r|

BDBM422493

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cnn(C)c1C |r|

BDBM422494

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1ccncc1C#N |r|

BDBM422495

COC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422496

CC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422497

CCOCc1nc(=O)c(c(O)n1C(COC)c1cccc(F)c1)S(=O)(=O)c1ccc(c(F)c1)-c1ccccc1C(N)=O

BDBM422498

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1ccccc1C(N)=O |r|

BDBM422499

CC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C#N |r|

BDBM422500

COC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C#N |r|

BDBM422501

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1ccncc1C#N |r|

BDBM422502

COC[C@@H](c1ccccc1)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C#N |r|

BDBM422503

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cnccc1C#N |r|

BDBM422504

COC[C@@H](c1cc(F)cc(F)c1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(cc1)-c1cccn(C)c1=O |r|

BDBM422505

COC[C@@H](c1ccccc1)n1c(O)c(c(=O)nc1COC(C)C)S(=O)(=O)c1ccc(c(F)c1)-c1cnccc1C#N |r|

BDBM422507

COC[C@@H](c1cccc(c1)C#N)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cnccc1C#N |r|

BDBM422508

CCCCc1nc(=O)c(c(O)n1[C@@H](COC)c1cccc(c1)C(N)=O)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422509

COC[C@@H](c1ccccc1)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cnccc1C#N |r|

BDBM422510

CC(C)OCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cnccc1C#N |r|

BDBM422511

CC(C)OCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C#N |r|

BDBM422513

CC(C)OCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C(N)=O |r|

BDBM422514

CC(C)OCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422515

CC(C)OCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422516

CNC(=O)c1ccccc1-c1ccc(cc1)S(=O)(=O)c1c(O)n([C@@H](C2CC2)c2cccc(c2)C#N)c(COC(C)C)nc1=O |r|

BDBM422517

CCOCc1nc(=O)c(c(O)n1[C@H]1CCc2ccccc12)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422518

CC[C@@H](c1ccccc1)n1c(COC(C)C)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422519

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)cc1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422520

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)cc1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422521

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)cc1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422522

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)cc1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422523

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422524

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1F)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422527

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1F)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422528

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccccc1F)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422529

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422530

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422531

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422532

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422533

CCOCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422534

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)c(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422535

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)c(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422536

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(F)c(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422537

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422538

CC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422539

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422540

CC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422542

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422543

CCCCc1nc(=O)c(c(O)n1[C@@H](C(C)C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422544

CCCCc1nc(=O)c(c(O)n1[C@@H](C(C)C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422545

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422546

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422547

CCCCc1nc(=O)c(c(O)n1[C@@H](C(C)C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422548

CCCCc1nc(=O)c(c(O)n1[C@@H](C(C)C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422549

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422550

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccc(F)nc1C |r|

BDBM422551

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1cccnc1C |r|

BDBM422552

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccnc(F)c1C |r|

BDBM422553

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccncc1C |r|

BDBM422554

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cc(F)cc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422555

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C

BDBM422556

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C

BDBM422557

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C

BDBM422558

CCCCc1nc(=O)c(c(O)n1C(C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C

BDBM422559

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccccc1C#N |r|

BDBM422560

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccc(F)cc1C(N)=O |r|

BDBM422561

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422562

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C#N |r|

BDBM422563

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccccc1C(N)=O |r|

BDBM422564

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422565

CC[C@@H](c1cccc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C(N)=O |r|

BDBM422566

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C(N)=O |r|

BDBM422567

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cnccc1C#N |r|

BDBM422568

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cnccc1C(N)=O |r|

BDBM422569

CC[C@@H](c1cc(F)cc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C(N)=O |r|

BDBM422570

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1ccncc1C#N |r|

BDBM422571

CC[C@@H](c1cc(F)cc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422572

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422573

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C(N)=O |r|

BDBM422574

CCCCc1nc(=O)c(c(O)n1\C(=C/C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C

BDBM422575

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422576

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccn(C)c1=O |r|

BDBM422577

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccccc1C(=O)OC |r|

BDBM422578

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1ccccc1C |r|

BDBM422579

CCCCc1nc(=O)c(c(O)n1\C(=C/C)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C

BDBM422580

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422581

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cn1)-c1cccn(C)c1=O |r|

BDBM422582

CC[C@@H](c1cccc(c1)C#N)n1c(CC2CC2)nc(=O)c(c1O)S(=O)(=O)c1ccc(cc1)-c1cccnc1C(N)=O |r|

BDBM422583

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422584

CC[C@@H](c1cc(F)cc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422585

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)N1CCOCC1 |r|

BDBM422586

Cn1cccc(-c2ccc(cc2)S(=O)(=O)c2c(O)n([C@@H](C3CC3)c3cccc(c3)C#N)c(CC3CC3)nc2=O)c1=O |r|

BDBM422587

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C |r|

BDBM422588

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(C#N)c1C |r|

BDBM422589

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cc(ccc1C)C#N |r|

BDBM422590

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C(N)=O |r|

BDBM422591

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1c[nH]nc1C |r|

BDBM422592

Cc1cnccc1-c1ccc(cc1)S(=O)(=O)c1c(O)n([C@@H](C2CC2)c2cccc(c2)C#N)c(CC2CC2)nc1=O |r|

BDBM422593

Cc1ncccc1-c1ccc(cc1)S(=O)(=O)c1c(O)n([C@@H](C2CC2)c2cccc(c2)C#N)c(CC2CC2)nc1=O |r|

BDBM422594

Cc1c(F)nccc1-c1ccc(cc1)S(=O)(=O)c1c(O)n([C@@H](C2CC2)c2cccc(c2)C#N)c(CC2CC2)nc1=O |r|

BDBM422595

Cc1nc(F)ccc1-c1ccc(cc1)S(=O)(=O)c1c(O)n([C@@H](C2CC2)c2cccc(c2)C#N)c(CC2CC2)nc1=O |r|

BDBM422596

NC(=O)c1cc(F)ccc1-c1ccc(cc1)S(=O)(=O)c1c(O)n([C@@H](C2CC2)c2cccc(c2)C#N)c(CC2CC2)nc1=O |r|

BDBM422597

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)OC |r|

BDBM422598

CC[C@@H](c1cc(F)cc(c1)C#N)n1c(O)c(c(=O)nc1CC1CC1)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(N)=O |r|

BDBM422599

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1F |r|

BDBM422600

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccn(C)c1=O |r|

BDBM422601

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1F |r|

BDBM422602

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1F |r|

BDBM422603

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422604

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cnc(OC)nc1OC |r|

BDBM422605

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C(N)=O |r|

BDBM422606

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12 |r|

BDBM422607

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1F |r|

BDBM422608

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1F |r|

BDBM422609

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)N(C)C |r|

BDBM422610

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1C(N)=O |r|

BDBM422611

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422612

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422613

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422614

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1cccn(C)c1=O |r|

BDBM422615

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422616

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422617

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccc(C#N)c(F)c1)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)N(C)C |r|

BDBM422618

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC1CC1 |r|

BDBM422619

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(=O)NC |r|

BDBM422620

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc2CNC(=O)c12 |r|

BDBM422621

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(cc1F)C(N)=O |r|

BDBM422622

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1ccnc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422623

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)C1CCOCC1)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422624

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)C1CCOCC1)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422625

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc2CNC(=O)c12 |r|

BDBM422626

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422627

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(C)(C)O |r|

BDBM422628

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(cc1)C(C)(C)O |r|

BDBM422629

CCCCc1nc(=O)c(c(O)n1[C@@H](C1CC1)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC1CC1 |r|

BDBM422630

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(C(=O)NC2CC2)c1F |r|

BDBM422631

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc2C(=O)NCc12 |r|

BDBM422632

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cc(F)ncc1C |r|

BDBM422633

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2c1cccc2C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422634

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(F)c1C(N)=O |r|

BDBM422635

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2c1cccc2C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422636

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2c1cccc2C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422637

CCCCc1nc(=O)c(c(O)n1[C@H]1CCc2c1cccc2C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422638

CCCCc1nc(=O)c(c(O)n1[C@@H]1CCc2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422639

CCCCc1nc(=O)c(c(O)n1[C@@H]1CCc2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(=O)NC |r|

BDBM422640

CCCCc1nc(=O)c(c(O)n1[C@@H]1CCc2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422641

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(c1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(cc1F)C(=O)NC |r|

BDBM422642

CCCCc1nc(=O)c(c(O)n1[C@@H]1CCc2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1C |r|

BDBM422643

CCCCc1nc(=O)c(c(O)n1[C@@H]1CCc2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1)-c1cccnc1C |r|

BDBM422644

CCCCc1nc(=O)c(c(O)n1[C@@H]1CCc2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422645

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(n1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccnc(F)c1C |r|

BDBM422646

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(n1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |r|

BDBM422647

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(n1)C#N)S(=O)(=O)c1ccc(cc1)-c1ccccc1C(=O)NC |r|

BDBM422648

CCCCc1nc(=O)c(c(O)n1[C@@H](CC)c1cccc(n1)C#N)S(=O)(=O)c1ccc(cc1)-c1cccc(c1)C(=O)NC |r|

BDBM422649

CCCCc1nc(=O)c(c(O)n1-c1c(CC)cccc1CC)S(=O)(=O)[C@@H]1CC[C@H](O)CC1 |r,wU:25.26,28.30,(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422650

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)[C@@H]1CC[C@H](O)CC1 |r,wU:25.26,28.30,(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;3.33,.77,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,3.08,)|

BDBM422651

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)[C@H]1CC[C@H](O)CC1 |r,wU:25.26,wD:28.30,(-7.34,.77,;-6,,;-4.67,.77,;-3.33,,;-2,.77,;-2,2.31,;-.67,3.08,;-.67,4.62,;.67,2.31,;.67,.77,;2,,;-.67,,;-.67,-1.54,;-2,-2.31,;-3.33,-1.54,;-4.67,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;2,-1.54,;3.33,-2.31,;2,3.08,;1.23,4.41,;2.77,4.41,;3.33,2.31,;4.67,3.08,;6,2.31,;6,.77,;7.34,,;4.67,,;3.33,.77,)|

BDBM447681

CO[C@@H]1CCC[C@H](OC)[C@H]1n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447682

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1CC1COC1 |r|

BDBM447683

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447684

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447685

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C(CO)CO)c1ncc(Cl)cn1 |r|

BDBM447686

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447687

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC2(COC2)C1)c1ncc(Cl)cn1 |r|

BDBM447688

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)nnc1-c1ccccn1 |r|

BDBM447689

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447691

CCC(CC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447692

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM447693

COCCn1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447694

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447695

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447696

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447697

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447698

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccnc1 |r|

BDBM447699

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447700

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447701

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(OC)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447702

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(OC)cn2)nnc1-c1ccccn1 |r|

BDBM447703

CCOCCn1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447704

COCCn1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447706

COCCn1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447707

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C(C1CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM447710

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCSC)c1ncc(Cl)cn1 |r|

BDBM447711

COCCOc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1C(COC)COC |r|

BDBM447712

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCOC(F)F)c1ncc(Cl)cn1 |r|

BDBM447714

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCC#N)c1ncc(Cl)cn1 |r|

BDBM447715

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCC(N)=O)c1ncc(Cl)cn1 |r|

BDBM447721

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C(C1CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM447724

CCC(CC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447725

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447726

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447727

COCC1(CCC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447728

COCC1(CCC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447729

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447734

CC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447736

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H]1CCC11CCC1)c1ncc(Cl)cn1 |r|

BDBM447738

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCS(C)(=O)=O)c1ncc(Cl)cn1 |r|

BDBM447739

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1C1(C)CC1)c1ncc(C)cn1 |r|

BDBM447740

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(C)n2)n1C1(C)CCC1)c1ncc(Cl)cn1 |r|

BDBM447741

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447742

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447743

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccnc1 |r|

BDBM447744

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447745

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447746

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccccn1 |r|

BDBM447747

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccnc1 |r|

BDBM447748

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)nnc1-c1ccccn1 |r|

BDBM447749

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447750

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM447751

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)n1C1CC1 |r|

BDBM447752

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC1CCC1)c1ncc(Cl)cn1 |r|

BDBM447753

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCc1ccc(F)cc1)c1ncc(Cl)cn1 |r|

BDBM447754

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H]1CCCC[C@H]1C)c1ncc(Cl)cn1 |r|

BDBM447755

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1ccon1)c1ncc(Cl)cn1 |r|

BDBM447756

COC(Cn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1)OC |r|

BDBM447757

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1ccccc1)c1ncc(Cl)cn1 |r|

BDBM447758

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC(C)C)c1ncc(Cl)cn1 |r|

BDBM447759

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC1CCCC1)c1ncc(Cl)cn1 |r|

BDBM447760

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC1CCCCC1)c1ncc(Cl)cn1 |r|

BDBM447761

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)C1CCCO1)c1ncc(Cl)cn1 |r|

BDBM447762

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC(=O)NC1CC1)c1ncc(Cl)cn1 |r|

BDBM447763

CCN1CCC[C@H]1Cn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447764

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C12CC3CC(CC(C3)C1)C2)c1ncc(Cl)cn1 |r,TLB:29:28:31:25.23.24,29:24:31:30.28.27,25:26:30:29.23.24,THB:25:24:30:26.31.27|

BDBM447765

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM447766

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM447767

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccncc2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM447768

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1ccc(OC)cc1)c1ncc(Cl)cn1 |r|

BDBM447769

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H]1CC11CC1)c1ncc(Cl)cn1 |r|

BDBM447773

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC[S@](C)=O)c1ncc(Cl)cn1 |r|

BDBM447775

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM447776

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447777

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(OC)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447778

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447779

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(OC)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447780

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447781

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447782

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447783

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447784

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1(CF)CC1)c1ncc(Cl)cn1 |r|

BDBM447785

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1(CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM447786

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C1(CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM447787

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1(CC1)C1CC1)c1cnc(C)cn1 |r|

BDBM447788

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C1(CC1)C1CC1)c1cnc(C)cn1 |r|

BDBM447789

CCC(CC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447790

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1C(C1CC1)C1CC1)c1ncc(Cl)cn1 |r|

BDBM447791

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447792

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1C1CC1 |r|

BDBM447793

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)n1C1CC1 |r|

BDBM447794

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC1 |r|

BDBM447795

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC1)c1ncc(C)cn1 |r|

BDBM447796

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC1)c1cnc(OC)cn1 |r|

BDBM447797

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC1)c1cnc(C)cn1 |r|

BDBM447798

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)n1C1CC1 |r|

BDBM447799

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447800

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccnc1 |r|

BDBM447801

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447802

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM447803

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM447804

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM447805

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccn2)n1C)c1ncc(Cl)cn1 |r|

BDBM447806

CCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447807

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447811

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC1CCO1)c1ncc(Cl)cn1 |r|

BDBM447812

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)[C@@H]1CN(C)CCO1)c1ncc(Cl)cn1 |r|

BDBM447814

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@@H]1CCO1)c1ncc(Cl)cn1 |r|

BDBM447816

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)[C@@H]1COCCO1)c1ncc(Cl)cn1 |r|

BDBM447818

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@H](C)[C@@H]1COCCO1 |r|

BDBM447820

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)n1[C@H](C)[C@@H]1COCCO1 |r|

BDBM447822

S=C=NC1CC1

BDBM447823

CO[C@@H]([C@H](C)S(=O)(=O)N\C(NC1CC1)=N\NC(=O)c1cncc(C)c1)c1ncc(Cl)cn1 |r|

BDBM447824

S=C=NC1C[C@]11CC1 |r|

BDBM447825

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1C1C[C@]11CC1)c1ncc(Cl)cn1 |r|

BDBM447827

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1C1C[C@]11CC1 |r|

BDBM447828

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1C[C@]11CC1)c1ncc(OC)cn1 |r|

BDBM447829

CO[C@H]1CC[C@@H]1N=C=S |r|

BDBM447830

CO[C@@H]([C@H](C)S(=O)(=O)N\C(NC1CC1(F)F)=N\NC(=O)c1cccc(OC)n1)c1ncc(Cl)cn1 |r|

BDBM447835

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H]1CC[C@H]1OC)c1ncc(Cl)cn1 |r|

BDBM447837

S=C=NC1C2(CC2)C11CC1

BDBM447838

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1C1CC1 |r|

BDBM447839

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CC1(F)F)c1ncc(Cl)cn1 |r|

BDBM447841

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H]1C[C@@H]1F)c1ncc(Cl)cn1 |r|

BDBM447843

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(F)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447844

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(OC)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447845

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447846

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447847

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccccn1 |r|

BDBM447848

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cncc(C)c1 |r|

BDBM447849

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)n1C(C)C |r|

BDBM447850

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447851

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447852

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H]1C[C@@H](C1)OC)c1ncc(Cl)cn1 |r,wU:22.23,3.3,2.1,24.28,(4.11,-5.45,;3.03,-4.36,;3.42,-2.87,;2.33,-1.78,;2.73,-.29,;.85,-2.18,;-.24,-3.27,;1.25,-3.67,;-.24,-1.09,;-1.73,-1.49,;-2.21,-2.95,;-3.75,-2.95,;-4.22,-1.49,;-5.71,-1.09,;-6.11,.4,;-7.59,.8,;-8.68,-.29,;-8.29,-1.78,;-9.37,-2.87,;-8.98,-4.36,;-6.8,-2.18,;-2.98,-.58,;-2.98,.96,;-1.89,2.05,;-2.98,3.14,;-4.06,2.05,;-2.98,4.68,;-4.31,5.45,;4.91,-2.47,;6,-3.56,;7.49,-3.16,;7.89,-1.67,;9.37,-1.27,;6.8,-.58,;5.31,-.98,)|

BDBM447853

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H]1C[C@@H](C1)OC)c1ncc(Cl)cn1 |r,wU:22.23,3.3,2.1,wD:24.28,(4.11,-5.45,;3.03,-4.36,;3.42,-2.87,;2.33,-1.78,;2.73,-.29,;.85,-2.18,;-.24,-3.27,;1.25,-3.67,;-.24,-1.09,;-1.73,-1.49,;-2.21,-2.95,;-3.75,-2.95,;-4.22,-1.49,;-5.71,-1.09,;-6.11,.4,;-7.59,.8,;-8.68,-.29,;-8.29,-1.78,;-9.37,-2.87,;-8.98,-4.36,;-6.8,-2.18,;-2.98,-.58,;-2.98,.96,;-4.06,2.05,;-2.98,3.14,;-1.89,2.05,;-2.98,4.68,;-4.31,5.45,;4.91,-2.47,;6,-3.56,;7.49,-3.16,;7.89,-1.67,;9.37,-1.27,;6.8,-.58,;5.31,-.98,)|

BDBM447854

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCC1)c1ncc(Cl)cn1 |r|

BDBM447855

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCCC1)c1ncc(Cl)cn1 |r|

BDBM447856

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C1CCCCC1)c1ncc(Cl)cn1 |r|

BDBM447857

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H]1[C@@H](CCC[C@@H]1OC)OC)c1ncc(Cl)cn1 |r|

BDBM447858

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cnoc1)c1ncc(Cl)cn1 |r|

BDBM447859

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1Cc1cnoc1 |r|

BDBM447860

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cnoc1)c1cnc(C)cn1 |r|

BDBM447861

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(C)no1)c1ncc(Cl)cn1 |r|

BDBM447862

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1Cc1cc(C)no1 |r|

BDBM447863

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(C)no1)c1cnc(C)cn1 |r|

BDBM447864

CCc1noc(C)c1Cn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447865

CCc1noc(C)c1Cn1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447866

CCc1noc(C)c1Cn1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447867

CCc1noc(C)c1Cn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447868

CCc1cc(Cn2c(NS(=O)(=O)[C@@H](C)[C@H](C)c3ncc(Cl)cn3)nnc2-c2cccc(OC)n2)on1 |r|

BDBM447869

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(OC)no1)c1ncc(Cl)cn1 |r|

BDBM447870

COc1cc(Cn2c(NS(=O)(=O)[C@@H](C)[C@H](C)c3ncc(Cl)cn3)nnc2-c2cccc(OC)n2)on1 |r|

BDBM447871

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(OC)no1)c1cnc(C)cn1 |r|

BDBM447872

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1ccno1)c1ncc(Cl)cn1 |r|

BDBM447873

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1ccno1 |r|

BDBM447874

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1ccno1 |r|

BDBM447875

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(no1)C(F)(F)F)c1cnc(C)cn1 |r|

BDBM447876

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1Cc1cc(no1)C(F)(F)F |r|

BDBM447877

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(no1)C(F)(F)F)c1ncc(Cl)cn1 |r|

BDBM447878

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1ccno1)c1cnc(C)cn1 |r|

BDBM447879

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1Cc1ccno1 |r|

BDBM447880

CC[C@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447881

CC[C@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447882

CC[C@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447883

CC[C@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447890

CC[C@@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447892

CC[C@@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447894

CC[C@@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447896

CC[C@@H](c1c(C)noc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447898

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C1CC1)c1conc1C |r|

BDBM447899

CC[C@@H](c1conc1C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM447900

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C1CC1)c1conc1C |r|

BDBM447905

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1ncn(C)n1 |r|

BDBM447907

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1ncn(C)n1)c1ncc(Cl)cn1 |r|

BDBM447909

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1ncn(C)n1 |r|

BDBM447911

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1nc(C)no1 |r|

BDBM447913

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1ncc(C)o1 |r|

BDBM447915

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1noc(C)n1)c1ncc(Cl)cn1 |r|

BDBM447917

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1noc(C)n1 |r|

BDBM447918

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1nc(C)no1 |r|

BDBM447920

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1ncnn1C)c1ncc(Cl)cn1 |r|

BDBM447922

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1ncnn1C |r|

BDBM447924

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1ncnn1C |r|

BDBM447926

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1ncc(C)o1 |r|

BDBM447927

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1ncc(C)o1)c1ncc(Cl)cn1 |r|

BDBM447931

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1noc(C)n1 |r|

BDBM447932

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1Cc1ccon1 |r|

BDBM447933

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1Cc1ccon1 |r|

BDBM447934

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1Cc1ccon1)c1ncc(Cl)cn1 |r|

BDBM447935

CO[C@@H]([C@H](C)S(=O)(=O)N\C(NNC(=O)c1cccc(OC)n1)=N/C12CC(C1)C2)c1ncc(Cl)cn1 |r|

BDBM447936

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1ccon1)c1ncc(Cl)cn1 |r|

BDBM447938

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1ccno1)c1ncc(Cl)cn1 |r|

BDBM447939

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1ccon1 |r|

BDBM447941

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1ccon1 |r|

BDBM447943

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1Cc1cc(C)on1)c1ncc(Cl)cn1 |r|

BDBM447944

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1Cc1cc(C)on1 |r|

BDBM447945

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)[C@H]1CCCO1 |r|

BDBM447949

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1C[C@H]1CCCO1 |r|

BDBM447951

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@H]1CCCO1)c1ncc(Cl)cn1 |r|

BDBM447953

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1C[C@H]1CCCO1 |r|

BDBM447955

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCc1ccccn1)c1ncc(Cl)cn1 |r|

BDBM447956

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CCc1cccnc1)c1ncc(Cl)cn1 |r|

BDBM447959

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@H]1CCCCO1)c1ncc(Cl)cn1 |r|

BDBM447961

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@H]1CCC(C)(C)O1)c1ncc(Cl)cn1 |r|

BDBM447963

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1Cc1ccon1 |r|

BDBM447964

CCc1cc(C\N=C(\NNC(=O)c2cccc(OC)n2)NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)on1 |r|

BDBM447965

CCc1cc(Cn2c(NS(=O)(=O)[C@@H](C)[C@H](OC)c3ncc(Cl)cn3)nnc2-c2cncc(C)c2)on1 |r|

BDBM447966

CCc1cc(Cn2c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)nnc2-c2cccc(OC)n2)on1 |r|

BDBM447967

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@H](C)c1csnn1 |r|

BDBM447969

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@H](C)c1cnn(C)c1 |r|

BDBM447971

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1C[C@H]1CCCCO1)c1ncc(Cl)cn1 |r|

BDBM447972

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1C[C@H]1CCCCO1 |r|

BDBM447974

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1CC1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM447975

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@@H]1COCCO1)c1ncc(Cl)cn1 |r|

BDBM447977

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@@H]1CCC[C@H](C)O1)c1ncc(Cl)cn1 |r|

BDBM447981

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@@H](C)c1c(C)noc1C)c1ncc(Cl)cn1 |r|

BDBM447983

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1C[C@@H]1CCCOC1)c1ncc(Cl)cn1 |r|

BDBM447985

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1[C@@H](C)c1c(C)noc1C |r|

BDBM447987

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@@H](C)c1c(C)noc1C |r|

BDBM447989

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)[C@@H]1CCCCO1)c1ncc(Cl)cn1 |r|

BDBM447992

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC(C)C)c2ncc(Cl)cn2)n1[C@H](C)[C@@H]1CCCCO1 |r|

BDBM447993

COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1[C@H](C)[C@@H]1CCCCO1 |r|

BDBM447997

CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM448001

CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM448005

CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r|

BDBM448008

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cncnc1)c1ncc(Cl)cn1 |r|

BDBM448010

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cnn(C)c1)c1ncc(Cl)cn1 |r|

BDBM448012

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cc(F)cc(F)c1)c1ncc(Cl)cn1 |r|

BDBM448014

CC[C@H](c1cc(F)cc(F)c1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r|

BDBM448016

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cscn1)c1ncc(Cl)cn1 |r|

BDBM448018

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cncs1)c1ncc(Cl)cn1 |r|

BDBM448020

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cncc(F)c1)c1ncc(Cl)cn1 |r|

BDBM448022

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1[C@H](C)c1cccnc1)c1ncc(Cl)cn1 |r|

BDBM456559

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2Cc3ccccc3C2=O)nnc1-c1ccco1 |(-7.67,1.44,;-6.34,.67,;-5.01,1.44,;-5.01,2.98,;-3.67,3.75,;-2.34,2.98,;-2.34,1.44,;-1.01,.67,;.33,1.44,;-3.67,.67,;-3.67,-.87,;-2.43,-1.77,;-.96,-1.3,;.13,-2.39,;-.64,-3.72,;.9,-3.72,;1.46,-1.62,;2.79,-2.39,;4.13,-1.62,;4.29,-.09,;5.8,.23,;6.57,1.57,;8.11,1.57,;8.88,.23,;8.11,-1.1,;6.57,-1.1,;5.53,-2.24,;5.85,-3.75,;-2.9,-3.24,;-4.44,-3.24,;-4.92,-1.77,;-6.38,-1.3,;-6.86,.17,;-8.4,.17,;-8.88,-1.3,;-7.63,-2.2,)|

BDBM456560

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(.32,2.87,;1.66,3.64,;2.99,2.87,;2.99,1.33,;4.33,.56,;1.66,.56,;2.43,-.78,;.89,1.89,;.32,-.21,;.32,-1.75,;1.57,-2.66,;1.09,-4.12,;-.45,-4.12,;-1.35,-5.37,;-2.89,-5.37,;-3.37,-6.83,;-2.12,-7.74,;-2.12,-9.28,;-.87,-6.83,;-.92,-2.66,;-2.39,-2.18,;-3.53,-3.21,;-3.21,-4.72,;-4.35,-5.75,;-4.99,-2.74,;-5.31,-1.23,;-4.17,-.2,;-2.71,-.68,;-1.56,.35,;-1.88,1.86,;4.33,3.64,;5.66,2.87,;6.99,3.64,;6.99,5.18,;8.33,5.95,;5.66,5.95,;4.33,5.18,)|

BDBM456561

COCn1cnc2c(C[C@H](C)S(=O)(=O)Nc3nnc(-c4ccco4)n3-c3c(OC)cccc3OC)ncc(F)c12 |r,wU:9.9,(9.72,4,;8.06,3.64,;6.92,4.91,;5.25,4.55,;4.63,3.15,;3.09,3.31,;2.77,4.82,;1.44,5.59,;.11,4.82,;-1.23,5.59,;-1.23,7.13,;-2.56,4.82,;-3.33,3.48,;-1.79,3.48,;-3.65,5.9,;-5.11,5.43,;-5.59,3.96,;-7.13,3.96,;-7.61,5.43,;-9.07,5.9,;-9.55,7.37,;-11.09,7.37,;-11.56,5.9,;-10.32,5,;-6.36,6.33,;-6.36,7.87,;-5.03,8.64,;-3.69,7.87,;-2.36,8.64,;-5.03,10.18,;-6.36,10.95,;-7.69,10.18,;-7.69,8.64,;-9.03,7.87,;-10.36,8.64,;1.44,7.13,;2.77,7.9,;4.11,7.13,;5.44,7.9,;4.11,5.59,)|

BDBM456568

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)c3[nH]cnc23)nnc1-c1ccco1 |r,wD:16.17,(-6.73,-3.35,;-5.39,-4.12,;-4.06,-3.35,;-4.06,-1.81,;-2.73,-1.04,;-1.39,-1.81,;-1.39,-3.35,;-.06,-4.12,;1.28,-3.35,;-2.73,-4.12,;-2.73,-5.66,;-1.48,-6.57,;-.02,-6.09,;1.07,-7.18,;1.84,-8.52,;.3,-8.52,;2.41,-6.41,;2.41,-4.87,;3.74,-7.18,;5.07,-6.41,;5.07,-4.87,;6.41,-4.1,;7.74,-4.87,;9.08,-4.1,;7.74,-6.41,;8.89,-7.44,;8.26,-8.85,;6.73,-8.69,;6.41,-7.18,;-1.96,-8.03,;-3.5,-8.03,;-3.97,-6.57,;-5.44,-6.09,;-5.91,-4.63,;-7.45,-4.63,;-7.93,-6.09,;-6.68,-7,)|

BDBM456569

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)c3n(C)cnc23)nnc1-c1ccco1 |r,wU:16.17,(-8.36,9.28,;-7.02,8.51,;-5.69,9.28,;-5.69,10.82,;-4.36,11.59,;-3.02,10.82,;-3.02,9.28,;-1.69,8.51,;-.36,9.28,;-4.36,8.51,;-4.36,6.97,;-3.11,6.07,;-1.65,6.54,;-.56,5.45,;.21,4.12,;-1.33,4.12,;.78,6.22,;.78,7.76,;2.11,5.45,;3.44,6.22,;3.44,7.76,;4.78,8.53,;6.11,7.76,;7.44,8.53,;6.11,6.22,;7.26,5.19,;8.76,5.51,;6.63,3.79,;5.1,3.95,;4.78,5.45,;-3.59,4.6,;-5.13,4.6,;-5.6,6.07,;-7.07,6.54,;-7.54,8.01,;-9.08,8.01,;-9.56,6.54,;-8.31,5.64,)|

BDBM456570

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,(-7.44,9.4,;-6.1,8.64,;-4.77,9.4,;-4.77,10.94,;-3.43,11.72,;-2.1,10.94,;-2.1,9.4,;-.77,8.64,;.57,9.4,;-3.43,8.64,;-3.43,7.1,;-2.19,6.19,;-.72,6.67,;.36,5.58,;1.13,4.24,;-.4,4.24,;1.7,6.35,;1.7,7.89,;3.03,5.58,;4.37,6.35,;5.7,5.58,;7.03,6.35,;7.03,7.89,;8.37,8.66,;5.7,8.66,;4.37,7.89,;-2.66,4.73,;-4.2,4.73,;-4.68,6.19,;-6.15,6.67,;-6.62,8.13,;-8.16,8.13,;-8.64,6.67,;-10.1,6.19,;-7.39,5.76,)|

BDBM456571

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)c3[nH]cnc23)nnc1-c1ccco1 |r,wU:16.17,(-7.89,9.28,;-6.56,8.51,;-5.22,9.28,;-5.22,10.82,;-3.89,11.59,;-2.56,10.82,;-2.56,9.28,;-1.22,8.51,;.11,9.28,;-3.89,8.51,;-3.89,6.97,;-2.64,6.07,;-1.18,6.54,;-.09,5.45,;.68,4.12,;-.86,4.12,;1.24,6.22,;1.24,7.76,;2.58,5.45,;3.91,6.22,;3.91,7.76,;5.24,8.53,;6.58,7.76,;7.91,8.53,;6.58,6.22,;7.72,5.19,;7.1,3.79,;5.56,3.95,;5.24,5.45,;-3.12,4.6,;-4.66,4.6,;-5.14,6.07,;-6.6,6.54,;-7.08,8.01,;-8.62,8.01,;-9.09,6.54,;-7.85,5.64,)|

BDBM456572

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(Cl)cc2NC(C)=O)nnc1-c1ccco1 |r,wU:16.17,(.14,-3.48,;-.94,-4.57,;-2.43,-4.17,;-2.83,-2.69,;-4.32,-2.29,;-5.41,-3.38,;-5.01,-4.86,;-6.1,-5.95,;-7.58,-5.55,;-3.52,-5.26,;-3.12,-6.75,;-1.66,-7.23,;-.32,-6.46,;1.01,-7.23,;2.34,-8,;.24,-8.56,;1.78,-5.89,;1.01,-4.56,;3.32,-5.89,;4.09,-4.56,;3.32,-3.22,;4.09,-1.89,;5.63,-1.89,;6.4,-.56,;6.4,-3.22,;5.63,-4.56,;6.4,-5.89,;7.94,-5.89,;8.71,-7.23,;8.71,-4.56,;-1.66,-8.77,;-3.12,-9.24,;-4.03,-8,;-5.51,-7.6,;-6.42,-6.35,;-7.88,-6.83,;-7.88,-8.37,;-6.42,-8.84,)|

BDBM456573

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-.07,-1.2,;-1.16,-2.29,;-2.65,-1.9,;-3.05,-.41,;-4.54,-.01,;-5.62,-1.1,;-5.23,-2.59,;-6.31,-3.67,;-7.8,-3.28,;-3.74,-2.98,;-3.34,-4.47,;-1.87,-4.95,;-.54,-4.18,;.79,-4.95,;1.56,-3.61,;.02,-6.28,;2.13,-5.72,;2.13,-7.26,;3.46,-4.95,;3.46,-3.41,;4.79,-5.72,;4.79,-7.26,;6.13,-8.03,;7.51,-7.29,;7.46,-5.72,;6.13,-4.95,;8.84,-8.06,;10.18,-8.83,;-1.87,-6.49,;-3.34,-6.96,;-4.24,-5.72,;-5.73,-5.32,;-6.79,-4.23,;-8.1,-4.55,;-8.1,-6.09,;-9.35,-6.99,;-6.64,-6.56,)|

BDBM456574

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(Cl)cn2)nnc1-c1ccco1 |r,wU:16.17,(1.57,-3.44,;.48,-4.53,;-1.01,-4.13,;-1.41,-2.64,;-2.9,-2.24,;-3.99,-3.33,;-3.59,-4.82,;-4.68,-5.91,;-6.16,-5.51,;-2.1,-5.22,;-1.7,-6.71,;-.24,-7.18,;1.1,-6.41,;2.43,-7.18,;3.76,-7.95,;1.66,-8.51,;3.2,-5.85,;2.43,-4.51,;4.74,-5.85,;5.51,-4.51,;7.05,-4.51,;7.82,-3.18,;7.05,-1.85,;7.82,-.51,;5.51,-1.85,;4.74,-3.18,;-.24,-8.72,;-1.7,-9.2,;-2.61,-7.95,;-4.09,-7.55,;-5,-6.31,;-6.46,-6.78,;-6.46,-8.32,;-5,-8.8,)|

BDBM456575

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.17,(1.63,-4.1,;.54,-5.19,;-.95,-4.79,;-1.34,-3.3,;-2.83,-2.9,;-3.92,-3.99,;-3.52,-5.48,;-4.61,-6.57,;-6.1,-6.17,;-2.03,-5.88,;-1.64,-7.37,;-.17,-7.84,;1.16,-7.07,;2.5,-7.84,;3.83,-8.61,;1.73,-9.18,;3.27,-6.51,;2.5,-5.17,;4.81,-6.51,;5.58,-5.17,;7.12,-5.17,;7.89,-3.84,;7.14,-2.46,;5.58,-2.51,;4.81,-3.84,;7.91,-1.13,;8.68,.21,;-.17,-9.38,;-1.64,-9.86,;-2.54,-8.61,;-4.03,-8.21,;-5.09,-7.12,;-6.4,-7.44,;-6.4,-8.98,;-7.64,-9.89,;-4.93,-9.46,)|

BDBM456576

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(Cl)cc2NC(C)=O)nnc1-c1ccco1 |r,wD:16.17,(-6.81,-2.64,;-5.47,-3.41,;-4.14,-2.64,;-4.14,-1.1,;-2.81,-.33,;-1.47,-1.1,;-1.47,-2.64,;-.14,-3.41,;1.19,-2.64,;-2.81,-3.41,;-2.81,-5.09,;-1.56,-6,;-.23,-5.23,;1.11,-6,;.34,-7.33,;1.88,-7.33,;2.44,-5.23,;2.44,-3.69,;3.77,-6,;5.11,-5.23,;5.11,-3.69,;6.44,-2.92,;7.77,-3.69,;9.11,-2.92,;7.77,-5.23,;6.44,-6,;6.44,-7.54,;7.77,-8.31,;7.77,-9.85,;9.11,-7.54,;-2.04,-7.46,;-3.58,-7.46,;-4.05,-6,;-5.42,-5.41,;-5.9,-3.94,;-7.44,-3.94,;-7.91,-5.41,;-6.67,-6.31,)|

BDBM456577

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ccc(Cl)cn2)nnc1-c1ccco1 |r,wD:16.17,(1.69,-3.6,;.6,-4.69,;-.88,-4.29,;-1.28,-2.8,;-2.77,-2.41,;-3.86,-3.49,;-3.46,-4.98,;-4.55,-6.07,;-6.04,-5.67,;-1.97,-5.38,;-1.57,-6.87,;-.11,-7.34,;1.22,-6.57,;2.56,-7.34,;3.89,-8.11,;1.79,-8.68,;3.33,-6.01,;2.56,-4.68,;4.87,-6.01,;5.64,-4.68,;7.18,-4.68,;7.95,-3.34,;7.18,-2.01,;7.95,-.68,;5.64,-2.01,;4.87,-3.34,;-.11,-8.88,;-1.57,-9.36,;-2.48,-8.11,;-3.97,-7.72,;-4.87,-6.47,;-6.34,-6.95,;-6.34,-8.49,;-4.87,-8.96,)|

BDBM456578

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cc2NC(C)=O)nnc1-c1ccco1 |r,wD:16.17,(-.77,6.35,;-1.86,5.26,;-3.34,5.66,;-3.74,7.15,;-5.23,7.55,;-6.32,6.46,;-5.92,4.97,;-7.01,3.88,;-8.5,4.28,;-4.43,4.57,;-4.03,3.09,;-2.57,2.61,;-1.23,3.38,;.1,2.61,;1.43,1.84,;-.67,1.28,;.87,3.94,;.1,5.28,;2.41,3.94,;3.18,5.28,;2.41,6.61,;3.18,7.94,;4.72,7.94,;5.49,9.28,;5.49,6.61,;4.72,5.28,;5.49,3.94,;7.03,3.94,;7.8,2.61,;7.8,5.28,;-2.57,1.07,;-4.03,.59,;-4.94,1.84,;-6.43,2.24,;-7.33,3.48,;-8.8,3.01,;-8.8,1.47,;-7.33,.99,)|

BDBM456579

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,(-6.18,-2.72,;-4.85,-3.49,;-3.52,-2.72,;-3.52,-1.18,;-2.18,-.41,;-.85,-1.18,;-.85,-2.72,;.48,-3.49,;1.82,-2.72,;-2.18,-3.49,;-2.18,-5.18,;-.94,-6.08,;.4,-5.31,;1.73,-6.08,;.96,-7.42,;2.5,-7.42,;3.06,-5.31,;3.06,-3.77,;4.4,-6.08,;5.73,-5.31,;7.07,-6.08,;8.4,-5.31,;8.4,-3.77,;9.73,-3,;7.07,-3,;5.73,-3.77,;-1.41,-7.55,;-2.95,-7.55,;-3.43,-6.08,;-4.8,-5.49,;-5.27,-4.03,;-6.81,-4.03,;-7.29,-5.49,;-8.75,-5.97,;-6.04,-6.4,)|

BDBM456580

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(Cl)cc2C(N)=O)nnc1-c1ccco1 |r,wD:16.17,(-6.97,-2.85,;-5.64,-3.62,;-4.3,-2.85,;-4.3,-1.31,;-2.97,-.54,;-1.64,-1.31,;-1.64,-2.85,;-.3,-3.62,;1.03,-2.85,;-2.97,-3.62,;-2.97,-5.3,;-1.72,-6.21,;-.39,-5.44,;.94,-6.21,;.17,-7.54,;1.71,-7.54,;2.28,-5.44,;2.28,-3.9,;3.61,-6.21,;4.94,-5.44,;4.94,-3.9,;6.28,-3.13,;7.61,-3.9,;8.94,-3.13,;7.61,-5.44,;6.28,-6.21,;6.28,-7.75,;4.94,-8.52,;7.61,-8.52,;-2.2,-7.67,;-3.74,-7.67,;-4.22,-6.21,;-5.59,-5.62,;-6.06,-4.16,;-7.6,-4.16,;-8.08,-5.62,;-6.83,-6.53,)|

BDBM456581

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(Cl)cc2Br)nnc1-c1ccco1 |r,wD:16.17,(-6.96,-2.72,;-5.63,-3.49,;-4.3,-2.72,;-4.3,-1.18,;-2.96,-.41,;-1.63,-1.18,;-1.63,-2.72,;-.3,-3.49,;1.04,-2.72,;-2.96,-3.49,;-2.96,-5.17,;-1.72,-6.08,;-.38,-5.31,;.95,-6.08,;.18,-7.41,;1.72,-7.41,;2.28,-5.31,;2.28,-3.77,;3.62,-6.08,;4.95,-5.31,;4.95,-3.77,;6.28,-3,;7.62,-3.77,;8.95,-3,;7.62,-5.31,;6.28,-6.08,;6.28,-7.62,;-2.19,-7.54,;-3.73,-7.54,;-4.21,-6.08,;-5.58,-5.49,;-6.06,-4.03,;-7.6,-4.03,;-8.07,-5.49,;-6.83,-6.4,)|

BDBM456582

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(cn2)C#N)nnc1-c1ccc(C)o1 |(1.13,.76,;.04,-.32,;-1.45,.07,;-1.85,1.56,;-3.34,1.96,;-4.43,.87,;-4.03,-.62,;-5.12,-1.7,;-6.6,-1.31,;-2.54,-1.01,;-2.14,-2.5,;-.68,-2.98,;.66,-2.21,;1.99,-2.98,;3.32,-3.75,;1.22,-4.31,;2.76,-1.64,;4.3,-1.64,;5.07,-.31,;6.61,-.31,;7.38,1.02,;6.64,2.4,;5.07,2.36,;4.3,1.02,;7.41,3.74,;8.18,5.07,;-.68,-4.52,;-2.14,-4.99,;-3.05,-3.75,;-4.53,-3.35,;-5.59,-2.26,;-6.9,-2.58,;-6.9,-4.12,;-8.15,-5.02,;-5.44,-4.59,)|

BDBM456583

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(Cl)cc2C#N)nnc1-c1ccco1 |r,wU:16.17,(1.08,-3.52,;-.01,-4.6,;-1.5,-4.21,;-1.89,-2.72,;-3.38,-2.32,;-4.47,-3.41,;-4.07,-4.9,;-5.16,-5.99,;-6.65,-5.59,;-2.58,-5.29,;-2.19,-6.78,;-.72,-7.26,;.61,-6.49,;1.95,-7.26,;3.28,-8.03,;1.18,-8.59,;2.72,-5.92,;1.95,-4.59,;4.26,-5.92,;5.03,-4.59,;4.26,-3.26,;5.03,-1.92,;6.57,-1.92,;7.34,-.59,;7.34,-3.26,;6.59,-4.64,;7.36,-5.97,;8.13,-7.31,;-.72,-8.8,;-2.19,-9.27,;-3.09,-8.03,;-4.58,-7.63,;-5.64,-6.54,;-6.95,-6.86,;-6.95,-8.4,;-5.48,-8.88,)|

BDBM456584

CCN(CC)C(=O)c1cc(Cl)cnc1C[C@H](C)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wU:15.16,(3.87,-8.47,;4.64,-7.13,;6.18,-7.13,;6.95,-8.47,;6.18,-9.8,;6.95,-5.8,;8.49,-5.8,;6.18,-4.47,;6.95,-3.13,;6.18,-1.8,;6.95,-.47,;4.64,-1.8,;3.87,-3.13,;4.64,-4.47,;3.87,-5.8,;2.33,-5.8,;1.56,-4.47,;1.56,-7.13,;2.89,-7.9,;.79,-8.47,;.22,-6.36,;-1.11,-7.13,;-1.11,-8.67,;-2.57,-9.15,;-3.48,-7.9,;-4.97,-7.51,;-5.87,-6.26,;-7.34,-6.74,;-7.34,-8.28,;-5.87,-8.75,;-2.57,-6.66,;-2.97,-5.17,;-1.88,-4.08,;-.4,-4.48,;.69,-3.39,;-2.28,-2.6,;-3.77,-2.2,;-4.86,-3.29,;-4.46,-4.77,;-5.55,-5.86,;-7.04,-5.46,)|

BDBM456585

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(Br)cn2)nnc1-c1ccco1 |r,wU:16.17,(-7.77,5.88,;-6.43,5.11,;-5.1,5.88,;-5.1,7.42,;-3.76,8.19,;-2.43,7.42,;-2.43,5.88,;-1.1,5.11,;.24,5.88,;-3.76,5.11,;-3.76,3.43,;-2.52,2.52,;-1.03,2.92,;.06,1.83,;-.71,.5,;.83,.5,;1.39,2.6,;1.39,4.14,;2.73,1.83,;4.06,2.6,;5.39,1.83,;6.73,2.6,;6.73,4.14,;8.06,4.91,;5.39,4.91,;4.06,4.14,;-2.99,1.06,;-4.53,1.06,;-5.01,2.52,;-6.38,3.11,;-6.86,4.57,;-8.4,4.57,;-8.87,3.11,;-7.63,2.2,)|

BDBM456586

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(Br)cn2)nnc1-c1ccco1 |r,wU:16.17,(-6.11,-5.5,;-4.62,-5.9,;-3.53,-4.81,;-3.93,-3.32,;-2.84,-2.23,;-1.35,-2.63,;-.96,-4.12,;.53,-4.52,;1.62,-3.43,;-2.04,-5.21,;-1.54,-7.2,;-.2,-7.97,;1.13,-7.2,;2.46,-7.97,;1.69,-9.3,;3.8,-8.74,;3.23,-6.64,;2.46,-5.3,;4.77,-6.64,;5.54,-5.3,;7.08,-5.3,;7.85,-3.97,;7.08,-2.63,;7.85,-1.3,;5.54,-2.63,;4.77,-3.97,;-.52,-9.48,;-2.06,-9.64,;-2.68,-8.23,;-4.17,-7.83,;-4.87,-6.46,;-6.39,-6.7,;-6.63,-8.22,;-5.26,-8.92,)|

BDBM456587

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2cnc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,(-5.41,-5.53,;-3.93,-5.93,;-2.84,-4.84,;-3.24,-3.35,;-2.15,-2.27,;-.66,-2.66,;-.26,-4.15,;1.23,-4.55,;2.32,-3.46,;-1.35,-5.24,;-.84,-7.23,;.49,-8,;1.83,-7.23,;3.16,-8,;2.39,-9.34,;4.49,-8.77,;3.93,-6.67,;3.16,-5.34,;5.47,-6.67,;6.24,-5.34,;7.78,-5.34,;8.55,-4,;7.78,-2.67,;8.55,-1.34,;6.24,-2.67,;5.47,-4,;.17,-9.51,;-1.36,-9.67,;-1.99,-8.26,;-3.47,-7.87,;-4.17,-6.49,;-5.69,-6.73,;-5.94,-8.26,;-7.27,-9.03,;-4.56,-8.95,)|

BDBM456588

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(F)cn2)nnc1-c1ccco1 |r,wU:16.17,(-6.08,-5.5,;-4.59,-5.9,;-3.51,-4.81,;-3.9,-3.32,;-2.82,-2.23,;-1.33,-2.63,;-.93,-4.12,;.56,-4.52,;1.65,-3.43,;-2.02,-5.21,;-1.51,-7.2,;-.18,-7.97,;1.16,-7.2,;2.49,-7.97,;1.72,-9.3,;3.82,-8.74,;3.26,-6.64,;2.49,-5.3,;4.8,-6.64,;5.57,-5.3,;7.11,-5.3,;7.88,-3.97,;7.11,-2.63,;7.88,-1.3,;5.57,-2.63,;4.8,-3.97,;-.5,-9.48,;-2.03,-9.64,;-2.66,-8.23,;-4.14,-7.83,;-4.84,-6.46,;-6.36,-6.7,;-6.6,-8.22,;-5.23,-8.92,)|

BDBM456589

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(C)cn2)nnc1-c1ccc(C)o1 |(-6.05,-.03,;-4.57,-.43,;-3.48,.66,;-3.88,2.15,;-2.79,3.24,;-1.3,2.84,;-.9,1.35,;.59,.95,;1.68,2.04,;-1.99,.26,;-1.48,-1.73,;-.15,-2.5,;1.19,-1.73,;2.52,-2.5,;1.75,-3.83,;3.85,-3.27,;3.29,-1.17,;4.83,-1.17,;5.6,.17,;7.14,.17,;7.91,1.5,;7.14,2.83,;7.91,4.17,;5.6,2.83,;4.83,1.5,;-.47,-4.01,;-2,-4.17,;-2.63,-2.76,;-4.11,-2.36,;-4.81,-.99,;-6.33,-1.23,;-6.58,-2.75,;-7.91,-3.52,;-5.2,-3.45,)|

BDBM456590

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2N2CCC2=O)nnc1-c1ccco1 |(-8.13,-.03,;-6.64,-.43,;-5.55,.66,;-5.95,2.15,;-4.86,3.24,;-3.38,2.84,;-2.98,1.35,;-1.49,.95,;-.4,2.04,;-4.07,.26,;-3.56,-1.73,;-2.23,-2.5,;-.89,-1.73,;.44,-2.5,;-.33,-3.83,;1.78,-3.27,;1.21,-1.17,;2.75,-1.17,;3.52,.17,;2.75,1.5,;3.52,2.83,;5.06,2.83,;5.83,4.17,;5.83,1.5,;5.06,.17,;5.83,-1.17,;5.43,-2.65,;6.92,-3.05,;7.32,-1.57,;8.65,-.8,;-2.55,-4.01,;-4.08,-4.17,;-4.7,-2.76,;-6.19,-2.36,;-6.89,-.99,;-8.41,-1.23,;-8.65,-2.75,;-7.28,-3.45,)|

BDBM456591

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cc2NC(C)=O)nnc1-c1ccco1 |r,wU:16.17,(-7.43,-6.02,;-5.95,-6.42,;-4.86,-5.33,;-5.26,-3.84,;-4.17,-2.75,;-2.68,-3.15,;-2.28,-4.64,;-.79,-5.04,;.29,-3.95,;-3.37,-5.73,;-2.86,-7.72,;-1.53,-8.49,;-.2,-7.72,;1.14,-8.49,;.37,-9.83,;2.47,-9.26,;1.91,-7.16,;1.14,-5.82,;3.45,-7.16,;4.22,-5.82,;3.45,-4.49,;4.22,-3.16,;5.76,-3.16,;6.53,-1.82,;6.53,-4.49,;5.76,-5.82,;6.53,-7.16,;8.07,-7.16,;8.84,-8.49,;8.84,-5.82,;-1.85,-10,;-3.38,-10.16,;-4.01,-8.75,;-5.5,-8.35,;-6.19,-6.98,;-7.72,-7.22,;-7.96,-8.74,;-6.58,-9.44,)|

BDBM456592

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cc2C#N)nnc1-c1ccco1 |r,wU:16.17,(-6.47,-5.5,;-4.99,-5.9,;-3.9,-4.81,;-4.3,-3.32,;-3.21,-2.23,;-1.72,-2.63,;-1.32,-4.12,;.17,-4.52,;1.26,-3.43,;-2.41,-5.21,;-1.9,-7.2,;-.57,-7.97,;.76,-7.2,;2.1,-7.97,;1.33,-9.3,;3.43,-8.74,;2.87,-6.64,;2.1,-5.3,;4.41,-6.64,;5.18,-5.3,;4.41,-3.97,;5.18,-2.63,;6.72,-2.63,;7.49,-1.3,;7.49,-3.97,;6.75,-5.35,;7.52,-6.68,;8.29,-8.02,;-.89,-9.48,;-2.42,-9.64,;-3.05,-8.23,;-4.53,-7.83,;-5.23,-6.46,;-6.75,-6.7,;-7,-8.22,;-5.62,-8.92,)|

BDBM456593

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(cn2)C#N)nnc1-c1ccco1 |r,wU:16.17,(-6.47,-6.16,;-4.99,-6.56,;-3.9,-5.47,;-4.3,-3.99,;-3.21,-2.9,;-1.72,-3.3,;-1.32,-4.78,;.17,-5.18,;1.26,-4.09,;-2.41,-5.87,;-1.9,-7.87,;-.57,-8.64,;.76,-7.87,;2.1,-8.64,;1.33,-9.97,;3.43,-9.41,;2.87,-7.3,;2.1,-5.97,;4.41,-7.3,;5.18,-5.97,;6.72,-5.97,;7.49,-4.63,;6.75,-3.25,;5.18,-3.3,;4.41,-4.63,;7.52,-1.92,;8.29,-.59,;-.89,-10.14,;-2.42,-10.3,;-3.05,-8.9,;-4.53,-8.5,;-5.23,-7.13,;-6.75,-7.37,;-7,-8.89,;-5.62,-9.59,)|

BDBM456594

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(C)nn2)nnc1-c1ccc(C)o1 |r,wU:16.17,(-5.44,-5.53,;-3.95,-5.93,;-2.86,-4.84,;-3.26,-3.35,;-2.17,-2.27,;-.69,-2.66,;-.29,-4.15,;1.2,-4.55,;2.29,-3.46,;-1.38,-5.24,;-.87,-7.23,;.46,-8,;1.8,-7.23,;3.13,-8,;2.36,-9.34,;4.46,-8.77,;3.9,-6.67,;3.13,-5.34,;5.44,-6.67,;6.21,-5.34,;7.75,-5.34,;8.52,-4,;7.75,-2.67,;8.52,-1.34,;6.21,-2.67,;5.44,-4,;.14,-9.51,;-1.39,-9.67,;-2.01,-8.26,;-3.5,-7.87,;-4.2,-6.49,;-5.72,-6.73,;-5.96,-8.26,;-7.3,-9.03,;-4.59,-8.95,)|

BDBM456595

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2cnc(C)cn2)nnc1-c1ccco1 |r,wU:16.17,(-6.08,-5.53,;-4.59,-5.93,;-3.5,-4.84,;-3.9,-3.35,;-2.81,-2.27,;-1.33,-2.66,;-.93,-4.15,;.56,-4.55,;1.65,-3.46,;-2.02,-5.24,;-1.51,-7.23,;-.18,-8,;1.16,-7.23,;2.49,-8,;1.72,-9.34,;3.83,-8.77,;3.26,-6.67,;2.49,-5.34,;4.8,-6.67,;5.57,-5.34,;7.11,-5.34,;7.88,-4,;7.11,-2.67,;7.88,-1.34,;5.57,-2.67,;4.8,-4,;-.5,-9.51,;-2.03,-9.67,;-2.65,-8.26,;-4.14,-7.87,;-4.84,-6.49,;-6.36,-6.73,;-6.6,-8.26,;-5.23,-8.95,)|

BDBM456596

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.17,(-5.81,-6.16,;-4.32,-6.56,;-3.23,-5.47,;-3.63,-3.99,;-2.54,-2.9,;-1.05,-3.3,;-.65,-4.78,;.83,-5.18,;1.92,-4.09,;-1.74,-5.87,;-1.24,-7.87,;.1,-8.64,;1.43,-7.87,;2.77,-8.64,;2,-9.97,;4.1,-9.41,;3.54,-7.3,;2.77,-5.97,;5.08,-7.3,;5.85,-5.97,;7.39,-5.97,;8.16,-4.63,;7.41,-3.25,;5.85,-3.3,;5.08,-4.63,;8.18,-1.92,;8.95,-.59,;-.22,-10.14,;-1.75,-10.3,;-2.38,-8.9,;-3.87,-8.5,;-4.57,-7.13,;-6.09,-7.37,;-6.33,-8.89,;-7.66,-9.66,;-4.96,-9.59,)|

BDBM456597

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(F)cn2)nnc1-c1ccco1 |(-6.72,-.03,;-5.23,-.43,;-4.14,.66,;-4.54,2.15,;-3.45,3.24,;-1.97,2.84,;-1.57,1.35,;-.08,.95,;1.01,2.04,;-2.66,.26,;-2.15,-1.73,;-.82,-2.5,;.52,-1.73,;1.85,-2.5,;1.08,-3.83,;3.19,-3.27,;2.62,-1.17,;4.16,-1.17,;4.93,.17,;6.47,.17,;7.24,1.5,;6.47,2.83,;7.24,4.17,;4.93,2.83,;4.16,1.5,;-1.14,-4.01,;-2.67,-4.17,;-3.29,-2.76,;-4.78,-2.36,;-5.48,-.99,;-7,-1.23,;-7.24,-2.75,;-5.87,-3.45,)|

BDBM456598

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(cn2)C#N)nnc1-c1ccco1 |(-7.4,-1.04,;-5.92,-1.44,;-4.83,-.35,;-5.23,1.13,;-4.14,2.22,;-2.65,1.82,;-2.25,.34,;-.76,-.06,;.33,1.03,;-3.34,-.75,;-2.7,-2.48,;-1.26,-3.03,;.07,-2.26,;1.4,-3.03,;2.74,-3.8,;.63,-4.37,;2.17,-1.7,;3.71,-1.7,;4.48,-.37,;6.02,-.37,;6.79,.97,;6.05,2.35,;4.48,2.3,;3.71,.97,;6.82,3.68,;7.59,5.02,;-1.34,-4.57,;-2.83,-4.97,;-3.67,-3.68,;-5.16,-3.28,;-6,-1.99,;-7.48,-2.39,;-7.56,-3.92,;-6.13,-4.48,)|

BDBM456599

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(Br)cn2)nnc1-c1ccco1 |r,wD:16.17,(-7.14,6.11,;-5.66,5.71,;-4.57,6.8,;-4.96,8.29,;-3.88,9.38,;-2.39,8.98,;-1.99,7.49,;-.5,7.09,;.59,8.18,;-3.08,6.4,;-2.5,4.55,;-1.09,3.93,;.24,4.7,;1.57,3.93,;.49,2.84,;2.91,3.16,;2.34,5.26,;1.57,6.59,;3.88,5.26,;4.65,6.59,;6.19,6.59,;6.96,7.93,;6.19,9.26,;6.96,10.59,;4.65,9.26,;3.88,7.93,;-1.25,2.39,;-2.76,2.07,;-3.53,3.41,;-5.02,3.81,;-5.57,5.24,;-7.11,5.16,;-7.51,3.68,;-6.21,2.84,)|

BDBM456600

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(Cl)cn2)nnc1-c1ccco1 |r,wU:16.17,(-6.29,-7.06,;-4.8,-7.45,;-3.71,-6.36,;-4.11,-4.88,;-3.02,-3.79,;-1.53,-4.19,;-1.14,-5.67,;.35,-6.07,;1.44,-4.98,;-2.23,-6.76,;-1.59,-8.49,;-.15,-9.04,;1.19,-8.27,;2.52,-9.04,;3.85,-9.81,;1.75,-10.38,;3.29,-7.71,;2.52,-6.38,;4.83,-7.71,;5.6,-6.38,;7.14,-6.38,;7.91,-5.04,;7.14,-3.71,;7.91,-2.37,;5.6,-3.71,;4.83,-5.04,;-.23,-10.58,;-1.72,-10.98,;-2.56,-9.69,;-4.04,-9.29,;-4.88,-8,;-6.37,-8.4,;-6.45,-9.93,;-5.01,-10.49,)|

BDBM456601

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2cnc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,(-6.21,-4.58,;-4.87,-5.35,;-3.54,-4.58,;-3.54,-3.04,;-2.2,-2.27,;-.87,-3.04,;-.87,-4.58,;.46,-5.35,;1.8,-4.58,;-2.2,-5.35,;-2.2,-7.37,;-.96,-8.27,;.53,-7.87,;1.62,-8.96,;.85,-10.3,;2.39,-10.3,;2.95,-8.19,;2.95,-6.65,;4.29,-8.96,;5.62,-8.19,;6.95,-8.96,;8.29,-8.19,;8.29,-6.65,;9.62,-5.88,;6.95,-5.88,;5.62,-6.65,;-1.43,-9.74,;-2.97,-9.74,;-3.45,-8.27,;-4.78,-7.5,;-5.26,-6.04,;-6.8,-6.04,;-7.28,-7.5,;-8.61,-8.27,;-6.03,-8.41,)|

BDBM456602

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(C)cn2)nnc1-c1ccco1 |(-7.02,-.38,;-5.53,-.78,;-4.44,.31,;-4.84,1.8,;-3.75,2.89,;-2.26,2.49,;-1.87,1,;-.38,.6,;.71,1.69,;-2.95,-.09,;-2.32,-1.81,;-.88,-2.37,;.46,-1.6,;1.79,-2.37,;3.12,-3.14,;1.02,-3.7,;2.56,-1.03,;4.1,-1.03,;4.87,.3,;6.41,.3,;7.18,1.64,;6.41,2.97,;7.18,4.3,;4.87,2.97,;4.1,1.64,;-.96,-3.9,;-2.45,-4.3,;-3.28,-3.01,;-4.77,-2.61,;-5.61,-1.32,;-7.1,-1.72,;-7.18,-3.26,;-5.74,-3.81,)|

BDBM456603

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:18.19,16.17,(-7.96,-5.02,;-6.47,-5.42,;-5.38,-4.33,;-5.78,-2.84,;-4.69,-1.75,;-3.2,-2.15,;-2.81,-3.64,;-1.32,-4.04,;-.23,-2.95,;-3.89,-4.73,;-3.26,-6.46,;-1.82,-7.01,;-.48,-6.24,;.85,-7.01,;1.62,-5.67,;.08,-8.34,;2.18,-7.78,;2.18,-9.32,;3.52,-7.01,;3.52,-5.47,;4.85,-7.78,;4.85,-9.32,;6.18,-10.09,;7.57,-9.34,;7.52,-7.78,;6.18,-7.01,;8.9,-10.11,;10.23,-10.88,;-1.9,-8.55,;-3.39,-8.94,;-4.22,-7.65,;-5.71,-7.25,;-6.55,-5.96,;-8.04,-6.36,;-8.12,-7.9,;-9.45,-8.67,;-6.68,-8.45,)|

BDBM456604

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cn2)nnc1-c1ccco1 |(-7.85,2.26,;-6.51,1.49,;-4.97,1.49,;-4.97,3.03,;-3.64,3.8,;-2.31,3.03,;-2.31,1.49,;-.77,1.49,;0,2.82,;-3.64,.72,;-3.64,-.82,;-2.39,-1.73,;-.91,-1.33,;.18,-2.42,;-.91,-3.51,;.95,-3.75,;1.67,-2.02,;2.76,-3.11,;4.25,-2.71,;5.34,-3.8,;6.82,-3.4,;7.22,-1.91,;8.71,-1.51,;6.13,-.82,;4.65,-1.22,;-2.87,-3.19,;-4.41,-3.19,;-4.88,-1.73,;-6.22,-.96,;-6.69,.51,;-8.23,.51,;-8.71,-.96,;-7.46,-1.86,)|

BDBM456605

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(C)nn2)nnc1-c1ccco1 |r,wU:16.17,(-6.18,-7.22,;-4.69,-7.62,;-3.6,-6.53,;-4,-5.05,;-2.91,-3.96,;-1.43,-4.36,;-1.03,-5.84,;.46,-6.24,;1.55,-5.15,;-2.12,-6.93,;-1.48,-8.66,;-.04,-9.21,;1.29,-8.44,;2.63,-9.21,;3.96,-9.98,;1.86,-10.55,;3.4,-7.88,;2.63,-6.54,;4.94,-7.88,;5.71,-6.54,;7.25,-6.54,;8.02,-5.21,;7.25,-3.88,;8.02,-2.54,;5.71,-3.88,;4.94,-5.21,;-.12,-10.75,;-1.61,-11.15,;-2.45,-9.86,;-3.93,-9.46,;-4.77,-8.17,;-6.26,-8.57,;-6.34,-10.1,;-4.9,-10.65,)|

BDBM456606

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccc(C)nn2)nnc1-c1ccc(C)o1 |r,wU:16.17,(-5.51,-7.22,;-4.03,-7.62,;-2.94,-6.53,;-3.34,-5.05,;-2.25,-3.96,;-.76,-4.36,;-.36,-5.84,;1.13,-6.24,;2.22,-5.15,;-1.45,-6.93,;-.81,-8.66,;.63,-9.21,;1.96,-8.44,;3.3,-9.21,;4.63,-9.98,;2.53,-10.55,;4.07,-7.88,;3.3,-6.54,;5.61,-7.88,;6.38,-6.54,;7.92,-6.54,;8.69,-5.21,;7.92,-3.88,;8.69,-2.54,;6.38,-3.88,;5.61,-5.21,;.55,-10.75,;-.94,-11.15,;-1.78,-9.86,;-3.27,-9.46,;-4.11,-8.17,;-5.59,-8.57,;-5.67,-10.1,;-7.01,-10.87,;-4.24,-10.65,)|

BDBM456607

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccncn2)nnc1-c1ccco1 |r,wU:16.17,(-6.18,-6.69,;-4.69,-7.09,;-3.6,-6,;-4,-4.51,;-2.91,-3.42,;-1.43,-3.82,;-1.03,-5.31,;.46,-5.71,;1.55,-4.62,;-2.12,-6.4,;-1.48,-8.12,;-.04,-8.68,;1.29,-7.91,;2.63,-8.68,;3.96,-9.45,;1.86,-10.01,;3.4,-7.34,;2.63,-6.01,;4.94,-7.34,;5.71,-6.01,;7.25,-6.01,;8.02,-4.68,;7.25,-3.34,;5.71,-3.34,;4.94,-4.68,;-.12,-10.21,;-1.61,-10.61,;-2.45,-9.32,;-3.93,-8.92,;-4.77,-7.63,;-6.26,-8.03,;-6.34,-9.57,;-4.9,-10.12,)|

BDBM456608

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2cncnc2)nnc1-c1ccco1 |r,wD:16.17,(-6.97,-5.22,;-5.48,-5.62,;-4.39,-4.53,;-4.79,-3.05,;-3.7,-1.96,;-2.21,-2.35,;-1.81,-3.84,;-.33,-4.24,;.76,-3.15,;-2.9,-4.93,;-2.26,-6.66,;-.83,-7.21,;.51,-6.44,;1.84,-7.21,;1.07,-8.55,;2.61,-5.88,;3.17,-7.98,;3.17,-9.52,;4.51,-7.21,;5.84,-7.98,;5.84,-9.52,;7.18,-10.29,;8.51,-9.52,;8.51,-7.98,;7.18,-7.21,;-.91,-8.75,;-2.39,-9.15,;-3.23,-7.86,;-4.72,-7.46,;-5.56,-6.17,;-7.05,-6.56,;-7.13,-8.1,;-5.69,-8.65,)|

BDBM456609

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ccncn2)nnc1-c1ccco1 |r,wU:16.17,(-6.31,-5.56,;-4.82,-5.96,;-3.73,-4.87,;-4.13,-3.38,;-3.04,-2.29,;-1.55,-2.69,;-1.16,-4.18,;.33,-4.58,;1.42,-3.49,;-2.24,-5.27,;-1.61,-6.99,;-.17,-7.55,;1.17,-6.78,;2.5,-7.55,;3.83,-8.32,;1.73,-8.88,;3.27,-6.21,;2.5,-4.88,;4.81,-6.21,;5.58,-4.88,;7.12,-4.88,;7.89,-3.55,;7.12,-2.21,;5.58,-2.21,;4.81,-3.55,;-.25,-9.08,;-1.74,-9.48,;-2.57,-8.19,;-4.06,-7.79,;-4.9,-6.5,;-6.39,-6.9,;-6.47,-8.44,;-5.03,-8.99,)|

BDBM456610

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccco1 |r,wD:16.17,(-6.74,-4.66,;-5.41,-5.43,;-4.08,-4.66,;-4.08,-3.12,;-2.74,-2.35,;-1.41,-3.12,;-1.41,-4.66,;-.07,-5.43,;1.26,-4.66,;-2.74,-5.43,;-2.74,-6.97,;-1.5,-7.87,;-.03,-7.4,;1.11,-8.43,;.34,-9.76,;1.88,-9.76,;2.45,-7.66,;2.45,-6.12,;3.78,-8.43,;5.11,-7.66,;6.45,-8.43,;7.78,-7.66,;7.78,-6.12,;9.12,-5.35,;6.45,-5.35,;5.11,-6.12,;-1.97,-9.34,;-3.51,-9.34,;-3.99,-7.87,;-5.45,-7.4,;-5.93,-5.93,;-7.47,-5.93,;-7.94,-7.4,;-6.7,-8.3,)|

BDBM456611

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccco1 |r,wD:16.17,(.57,6.64,;-.58,5.6,;-2.04,6.08,;-2.37,7.58,;-3.83,8.05,;-4.97,7.02,;-4.65,5.52,;-5.79,4.48,;-7.26,4.96,;-3.18,5.04,;-2.86,3.54,;-1.45,2.91,;-.12,3.69,;1.22,2.92,;2.55,2.15,;.45,1.59,;1.99,4.25,;1.22,5.59,;3.53,4.25,;4.3,5.59,;5.84,5.59,;6.61,6.92,;5.84,8.26,;6.61,9.59,;4.3,8.26,;3.53,6.92,;-1.61,1.38,;-3.12,1.06,;-3.89,2.39,;-5.42,2.55,;-6.19,3.88,;-7.7,3.56,;-7.86,2.02,;-6.45,1.4,)|

BDBM456612

CCc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:8.9,10.11,(10.12,-.96,;10.12,-2.5,;8.79,-3.27,;8.79,-4.81,;7.45,-5.58,;6.12,-4.81,;6.12,-3.27,;7.45,-2.5,;4.78,-5.58,;4.78,-7.12,;3.45,-4.81,;3.45,-3.27,;2.12,-5.58,;.78,-6.35,;2.89,-6.92,;1.35,-4.25,;-.19,-4.25,;-1.1,-5.49,;-2.56,-5.02,;-2.56,-3.48,;-3.81,-2.57,;-3.81,-1.03,;-5.27,-.56,;-6.18,-1.8,;-7.72,-1.8,;-5.27,-3.05,;-1.1,-3,;-.62,-1.54,;-1.65,-.39,;-3.16,-.71,;-4.19,.43,;-1.18,1.07,;.33,1.39,;1.36,.25,;.88,-1.22,;1.91,-2.36,;3.42,-2.03,)|

BDBM456613

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(.9,6.78,;-.43,6.01,;-1.77,6.78,;-1.77,8.32,;-3.1,9.09,;-4.44,8.32,;-4.43,6.78,;-5.77,6.01,;-7.1,6.78,;-3.1,6.01,;-3.1,4.47,;-1.85,3.57,;-.52,4.34,;.82,3.57,;2.15,2.8,;-.52,2.8,;2.15,4.34,;2.15,5.88,;3.48,3.57,;3.48,2.03,;4.82,4.34,;4.98,5.87,;6.48,6.19,;7.25,4.85,;8.79,4.69,;6.22,3.71,;-2.33,2.1,;-3.87,2.1,;-4.34,3.56,;-5.81,4.04,;-6.29,5.5,;-7.83,5.5,;-8.3,4.04,;-9.76,3.56,;-7.05,3.13,)|

BDBM456614

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(1.03,6.78,;-.3,6.01,;-1.64,6.78,;-1.64,8.32,;-2.98,9.09,;-4.31,8.32,;-4.31,6.78,;-5.64,6.01,;-6.97,6.78,;-2.97,6.01,;-2.97,4.47,;-1.72,3.57,;-.39,4.34,;.94,3.57,;2.28,2.8,;-.39,2.8,;2.28,4.34,;2.28,5.88,;3.61,3.57,;3.61,2.03,;4.94,4.34,;5.11,5.87,;6.61,6.19,;7.38,4.85,;8.91,4.69,;6.35,3.71,;-2.2,2.1,;-3.74,2.1,;-4.22,3.56,;-5.68,4.04,;-6.16,5.5,;-7.7,5.5,;-8.17,4.04,;-9.64,3.56,;-6.93,3.13,)|

BDBM456615

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(.86,1.22,;-.47,.45,;-1.81,1.22,;-1.81,2.76,;-3.14,3.53,;-4.48,2.76,;-4.48,1.22,;-5.81,.45,;-7.14,1.22,;-3.14,.45,;-3.14,-1.09,;-1.9,-1.99,;-.56,-1.22,;.77,-1.99,;0,-3.33,;1.54,-3.33,;2.11,-1.22,;2.11,.32,;3.44,-1.99,;3.44,-3.53,;4.77,-1.22,;6.11,-1.99,;7.44,-1.22,;7.44,.32,;8.77,1.09,;6.11,1.09,;4.77,.32,;-2.37,-3.46,;-3.91,-3.46,;-4.39,-1.99,;-5.85,-1.52,;-7.1,-2.42,;-8.34,-1.52,;-7.87,-.05,;-8.77,1.19,;-6.33,-.05,)|

BDBM456616

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(1.02,-16.24,;-.31,-17.01,;-1.64,-16.24,;-1.64,-14.7,;-2.98,-13.93,;-4.31,-14.7,;-4.31,-16.24,;-5.64,-17.01,;-6.98,-16.24,;-2.98,-17.01,;-2.98,-18.55,;-1.73,-19.45,;-.4,-18.68,;.94,-19.45,;.17,-20.79,;1.71,-20.79,;2.42,-19.06,;2.82,-17.57,;3.51,-20.15,;3.12,-21.63,;5,-19.75,;5.4,-18.26,;6.89,-17.86,;7.98,-18.95,;9.46,-18.55,;7.58,-20.44,;6.09,-20.84,;-2.21,-20.92,;-3.75,-20.92,;-4.22,-19.45,;-5.69,-18.98,;-6.16,-17.51,;-7.7,-17.51,;-8.18,-18.98,;-9.64,-19.45,;-6.93,-19.88,)|

BDBM456617

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ccc(Br)cn2)nnc1-c1ccc(C)o1 |r,wD:17.18,(1.11,-4.05,;-.22,-4.82,;-1.55,-4.05,;-1.55,-2.51,;-2.89,-1.74,;-4.22,-2.51,;-4.22,-4.05,;-5.55,-4.82,;-6.89,-4.05,;-2.89,-4.82,;-2.89,-6.36,;-1.64,-7.27,;-.31,-6.5,;1.03,-7.27,;.26,-8.6,;1.8,-8.6,;2.51,-6.87,;3.6,-7.96,;3.2,-9.45,;5.09,-7.56,;6.18,-8.65,;7.67,-8.25,;8.07,-6.76,;9.55,-6.36,;6.98,-5.67,;5.49,-6.07,;-2.12,-8.73,;-3.66,-8.73,;-4.13,-7.27,;-5.6,-6.79,;-6.07,-5.33,;-7.61,-5.33,;-8.09,-6.79,;-9.55,-7.27,;-6.84,-7.7,)|

BDBM456618

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(1.11,-16.24,;-.22,-17.01,;-1.55,-16.24,;-1.55,-14.7,;-2.89,-13.93,;-4.22,-14.7,;-4.22,-16.24,;-5.55,-17.01,;-6.89,-16.24,;-2.89,-17.01,;-2.89,-18.55,;-1.64,-19.45,;-.31,-18.68,;1.03,-19.45,;.26,-20.79,;1.8,-20.79,;2.51,-19.06,;2.91,-17.57,;3.6,-20.15,;3.2,-21.63,;5.09,-19.75,;5.49,-18.26,;6.98,-17.86,;8.07,-18.95,;9.55,-18.55,;7.67,-20.44,;6.18,-20.84,;-2.12,-20.92,;-3.66,-20.92,;-4.13,-19.45,;-5.6,-18.98,;-6.07,-17.51,;-7.61,-17.51,;-8.09,-18.98,;-9.55,-19.45,;-6.84,-19.88,)|

BDBM456619

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,(1.18,-4.05,;-.16,-4.82,;-1.49,-4.05,;-1.49,-2.51,;-2.83,-1.74,;-4.16,-2.51,;-4.16,-4.05,;-5.49,-4.82,;-6.83,-4.05,;-2.83,-4.82,;-2.83,-6.36,;-1.58,-7.27,;-.25,-6.5,;1.09,-7.27,;.32,-8.6,;1.86,-8.6,;2.58,-6.87,;3.66,-7.96,;3.27,-9.45,;5.15,-7.56,;6.24,-8.65,;7.73,-8.25,;8.13,-6.76,;9.61,-6.36,;7.04,-5.67,;5.55,-6.07,;-2.06,-8.73,;-3.6,-8.73,;-4.07,-7.27,;-5.54,-6.79,;-6.01,-5.33,;-7.55,-5.33,;-8.03,-6.79,;-9.49,-7.27,;-6.78,-7.7,)|

BDBM456620

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(cc2F)C#N)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(.66,-16.78,;-.67,-17.55,;-2,-16.78,;-2,-15.24,;-3.34,-14.47,;-4.67,-15.24,;-4.67,-16.78,;-6.01,-17.55,;-7.34,-16.78,;-3.34,-17.55,;-3.34,-19.09,;-2.09,-19.99,;-.76,-19.22,;.57,-19.99,;-.2,-21.33,;1.34,-21.33,;1.91,-19.22,;1.91,-17.68,;3.24,-19.99,;3.24,-21.53,;4.58,-19.22,;4.58,-17.68,;5.91,-16.91,;7.37,-17.61,;7.24,-19.22,;5.91,-19.99,;5.91,-21.53,;8.7,-16.84,;10.03,-16.07,;-2.57,-21.46,;-4.11,-21.46,;-4.58,-19.99,;-6.05,-19.52,;-6.52,-18.05,;-8.06,-18.05,;-8.54,-19.52,;-10.01,-19.99,;-7.29,-20.42,)|

BDBM456621

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](CCO)[C@H](C)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:20.21,wD:16.17,(-6.43,-13.21,;-5.1,-13.98,;-3.76,-13.21,;-3.76,-11.67,;-2.43,-10.9,;-1.1,-11.67,;-1.1,-13.21,;.24,-13.98,;1.57,-13.21,;-2.43,-13.98,;-2.43,-15.52,;-1.18,-16.43,;.28,-15.95,;1.61,-16.72,;.53,-17.81,;2.7,-17.81,;2.95,-15.95,;2.95,-14.41,;4.28,-13.64,;4.28,-12.1,;4.28,-16.72,;4.28,-18.26,;5.62,-15.95,;6.95,-16.72,;8.28,-15.95,;8.28,-14.41,;9.62,-13.64,;6.95,-13.64,;5.62,-14.41,;-1.66,-17.89,;-3.2,-17.89,;-3.68,-16.43,;-5.14,-15.95,;-5.62,-14.49,;-7.16,-14.49,;-7.63,-15.95,;-9.1,-16.43,;-6.39,-16.86,)|

BDBM456622

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.56,-13.62,;-5.23,-14.39,;-3.9,-13.62,;-3.9,-12.08,;-2.56,-11.31,;-1.23,-12.08,;-1.23,-13.62,;.1,-14.39,;1.44,-13.62,;-2.56,-14.39,;-2.56,-15.93,;-1.32,-16.83,;.15,-16.36,;1.29,-17.39,;2.06,-18.72,;.52,-18.72,;2.76,-16.91,;3.08,-15.41,;3.9,-17.94,;3.58,-19.45,;5.36,-17.47,;5.69,-15.96,;7.15,-15.49,;8.29,-16.52,;9.76,-16.04,;7.97,-18.02,;6.51,-18.5,;-1.79,-18.3,;-3.33,-18.3,;-3.81,-16.83,;-5.27,-16.36,;-5.75,-14.89,;-7.29,-14.89,;-7.77,-16.36,;-9.23,-16.83,;-6.52,-17.26,)|

BDBM456623

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,(-6.57,-3.3,;-5.23,-4.07,;-3.9,-3.3,;-3.9,-1.76,;-2.57,-.99,;-1.23,-1.76,;-1.23,-3.3,;.1,-4.07,;1.44,-3.3,;-2.57,-4.07,;-2.57,-5.61,;-1.32,-6.51,;.14,-6.03,;1.29,-7.06,;2.06,-8.4,;.52,-8.4,;2.75,-6.59,;3.9,-7.62,;3.58,-9.13,;5.36,-7.14,;6.51,-8.17,;7.97,-7.7,;8.29,-6.19,;9.76,-5.72,;7.15,-5.16,;5.68,-5.64,;-1.8,-7.97,;-3.34,-7.97,;-3.81,-6.51,;-5.28,-6.03,;-5.75,-4.57,;-7.29,-4.57,;-7.77,-6.03,;-9.23,-6.51,;-6.52,-6.94,)|

BDBM456624

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.46,-13.62,;-5.13,-14.39,;-3.79,-13.62,;-3.79,-12.08,;-2.46,-11.31,;-1.13,-12.08,;-1.13,-13.62,;.21,-14.39,;1.54,-13.62,;-2.46,-14.39,;-2.46,-15.93,;-1.21,-16.83,;.25,-16.36,;1.39,-17.39,;2.16,-18.72,;.62,-18.72,;2.86,-16.91,;3.18,-15.41,;4,-17.94,;3.68,-19.45,;5.47,-17.47,;5.79,-15.96,;7.25,-15.49,;8.4,-16.52,;9.86,-16.04,;8.08,-18.02,;6.61,-18.5,;-1.69,-18.3,;-3.23,-18.3,;-3.71,-16.83,;-5.17,-16.36,;-5.65,-14.89,;-7.19,-14.89,;-7.66,-16.36,;-9.13,-16.83,;-6.42,-17.26,)|

BDBM456625

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Br)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,(-7.53,7.48,;-6.2,6.71,;-4.86,7.48,;-4.86,9.02,;-3.53,9.79,;-2.19,9.02,;-2.19,7.48,;-.86,6.71,;.47,7.48,;-3.53,6.71,;-3.53,5.17,;-2.28,4.26,;-.82,4.74,;.33,3.71,;1.1,2.38,;-.44,2.38,;1.79,4.19,;2.94,3.16,;2.62,1.65,;4.4,3.63,;5.55,2.6,;7.01,3.08,;7.33,4.58,;8.79,5.06,;6.19,5.61,;4.72,5.14,;-2.76,2.8,;-4.3,2.8,;-4.77,4.26,;-6.24,4.74,;-6.71,6.2,;-8.25,6.2,;-8.73,4.74,;-10.19,4.26,;-7.48,3.83,)|

BDBM456626

COCC[C@H]([C@H](C)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:5.5,wD:4.3,(5.65,-11.75,;4.32,-12.52,;4.32,-14.06,;2.99,-14.83,;2.99,-16.37,;4.32,-17.14,;4.32,-18.68,;5.65,-16.37,;6.99,-17.14,;8.32,-16.37,;8.32,-14.83,;9.66,-14.06,;6.99,-14.06,;5.65,-14.83,;1.65,-17.14,;.56,-18.23,;2.74,-18.23,;.32,-16.37,;-1.15,-16.85,;-1.62,-18.32,;-3.16,-18.32,;-3.64,-16.85,;-5.1,-16.37,;-5.58,-14.91,;-7.12,-14.91,;-7.59,-16.37,;-9.06,-16.85,;-6.35,-17.28,;-2.39,-15.95,;-2.39,-14.41,;-3.72,-13.64,;-5.06,-14.41,;-6.39,-13.64,;-3.72,-12.1,;-2.39,-11.33,;-1.06,-12.1,;-1.06,-13.64,;.28,-14.41,;1.61,-13.64,)|

BDBM456627

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(cc2F)C#N)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-7.86,7.23,;-6.52,6.46,;-5.19,7.23,;-5.19,8.77,;-3.86,9.54,;-2.52,8.77,;-2.52,7.23,;-1.19,6.46,;.14,7.23,;-3.86,6.46,;-3.86,4.44,;-2.61,3.53,;-1.12,3.93,;.21,3.16,;-.88,2.07,;1.3,2.07,;1.54,3.93,;1.54,5.47,;2.88,3.16,;2.88,1.62,;4.21,3.93,;4.21,5.47,;5.54,6.24,;6.93,5.5,;6.88,3.93,;5.54,3.16,;5.54,1.62,;8.26,6.27,;9.59,7.04,;-3.09,2.07,;-4.63,2.07,;-5.1,3.53,;-6.44,4.3,;-6.91,5.77,;-8.45,5.77,;-8.93,4.3,;-10.26,3.53,;-7.68,3.4,)|

BDBM456628

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](CCO)Cc2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.20,(-7.23,6.89,;-5.9,6.12,;-4.56,6.89,;-4.56,8.43,;-3.23,9.2,;-1.9,8.43,;-1.9,6.89,;-.56,6.12,;.77,6.89,;-3.23,6.12,;-3.23,4.1,;-1.98,3.19,;-.5,3.59,;.84,2.82,;-.25,1.73,;1.93,1.73,;2.17,3.59,;2.17,5.13,;3.51,5.9,;3.51,7.44,;3.51,2.82,;4.84,3.59,;6.17,2.82,;7.51,3.59,;7.51,5.13,;8.84,5.9,;6.17,5.9,;4.84,5.13,;-2.46,1.73,;-4,1.73,;-4.47,3.19,;-5.81,3.96,;-6.28,5.43,;-7.82,5.43,;-8.3,3.96,;-9.63,3.19,;-7.05,3.06,)|

BDBM456630

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](CCO)Cc2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.20,(-7.33,6.89,;-6,6.12,;-4.67,6.89,;-4.67,8.43,;-3.33,9.2,;-2,8.43,;-2,6.89,;-.66,6.12,;.67,6.89,;-3.33,6.12,;-3.33,4.1,;-2.09,3.19,;-.6,3.59,;.73,2.82,;-.35,1.73,;1.82,1.73,;2.07,3.59,;2.07,5.13,;3.4,5.9,;3.4,7.44,;3.4,2.82,;4.74,3.59,;6.07,2.82,;7.4,3.59,;7.4,5.13,;8.74,5.9,;6.07,5.9,;4.74,5.13,;-2.56,1.73,;-4.1,1.73,;-4.58,3.19,;-5.91,3.96,;-6.39,5.43,;-7.93,5.43,;-8.4,3.96,;-9.74,3.19,;-7.16,3.06,)|

BDBM456631

COCC[C@H](Cc1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:4.4,(5.71,-1.99,;4.38,-2.76,;4.38,-4.3,;3.04,-5.07,;3.04,-6.61,;4.38,-7.38,;5.71,-6.61,;7.04,-7.38,;8.38,-6.61,;8.38,-5.07,;9.71,-4.3,;7.04,-4.3,;5.71,-5.07,;1.71,-7.38,;.62,-8.47,;2.8,-8.47,;.37,-6.61,;-1.11,-7.01,;-1.59,-8.48,;-3.13,-8.48,;-3.6,-7.01,;-5.09,-6.61,;-5.57,-5.15,;-7.11,-5.15,;-7.58,-6.61,;-9.05,-7.09,;-6.34,-7.52,;-2.36,-6.11,;-2.36,-4.57,;-3.69,-3.8,;-5.03,-4.57,;-6.36,-3.8,;-3.69,-2.26,;-2.36,-1.49,;-1.03,-2.26,;-1.03,-3.8,;.31,-4.57,;1.64,-3.8,)|

BDBM456632

COC[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:3.3,(4.34,-2.76,;4.34,-4.3,;3,-5.07,;3,-6.61,;4.34,-7.38,;5.67,-6.61,;7,-7.38,;8.34,-6.61,;8.34,-5.07,;9.67,-4.3,;7,-4.3,;5.67,-5.07,;1.67,-7.38,;.58,-8.47,;2.76,-8.47,;.33,-6.61,;-1.15,-7.01,;-1.63,-8.48,;-3.17,-8.48,;-3.64,-7.01,;-5.13,-6.61,;-5.61,-5.15,;-7.15,-5.15,;-7.62,-6.61,;-9.09,-7.09,;-6.38,-7.52,;-2.4,-6.11,;-2.4,-4.57,;-3.73,-3.8,;-5.07,-4.57,;-6.4,-3.8,;-3.73,-2.26,;-2.4,-1.49,;-1.07,-2.26,;-1.07,-3.8,;.27,-4.57,;1.6,-3.8,)|

BDBM456633

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2CO)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-6.42,-16.3,;-5.09,-17.07,;-3.76,-16.3,;-3.76,-14.76,;-2.42,-13.99,;-1.09,-14.76,;-1.09,-16.3,;.25,-17.07,;1.58,-16.3,;-2.42,-17.07,;-2.42,-18.61,;-1.18,-19.52,;.31,-19.12,;1.65,-19.89,;.56,-20.98,;2.73,-20.98,;2.98,-19.12,;2.98,-17.58,;4.31,-19.89,;4.31,-21.43,;5.65,-19.12,;5.65,-17.58,;6.98,-16.81,;8.31,-17.58,;9.65,-16.81,;8.31,-19.12,;6.98,-19.89,;6.98,-21.43,;8.31,-22.2,;-1.65,-20.98,;-3.19,-20.98,;-3.67,-19.52,;-5.15,-19.12,;-5.63,-17.66,;-7.17,-17.66,;-7.65,-19.12,;-8.89,-19.6,;-6.4,-20.03,)|

BDBM456634

COCC[C@H]([C@H](C)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:5.5,wD:4.3,(5.76,-11.75,;4.42,-12.52,;4.42,-14.06,;3.09,-14.83,;3.09,-16.37,;4.42,-17.14,;4.42,-18.68,;5.76,-16.37,;7.09,-17.14,;8.43,-16.37,;8.43,-14.83,;9.76,-14.06,;7.09,-14.06,;5.76,-14.83,;1.76,-17.14,;.67,-18.23,;2.85,-18.23,;.42,-16.37,;-1.04,-16.85,;-1.52,-18.32,;-3.06,-18.32,;-3.53,-16.85,;-5,-16.37,;-5.47,-14.91,;-7.01,-14.91,;-7.49,-16.37,;-8.95,-16.85,;-6.24,-17.28,;-2.29,-15.95,;-2.29,-14.41,;-3.62,-13.64,;-4.96,-14.41,;-6.29,-13.64,;-3.62,-12.1,;-2.29,-11.33,;-.95,-12.1,;-.95,-13.64,;.38,-14.41,;1.71,-13.64,)|

BDBM456635

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(Br)cc2F)nnc1-c1ccc(C)o1 |wU:18.19,wD:16.17,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;;.77,1.33,;-.77,-1.33,;-1.33,.77,;-2.67,,;-1.33,2.31,;,3.08,;-2.67,3.08,;-4,2.31,;-5.33,3.08,;-5.33,4.62,;-6.67,5.39,;-4,5.39,;-2.67,4.62,;-1.33,5.39,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;4.55,-5.93,;5.02,-7.39,;3.78,-8.3,;3.78,-9.84,;2.53,-7.39,)|

BDBM456636

COCC[C@H](Cc1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:4.4,(5.81,-1.98,;4.47,-2.75,;4.47,-4.29,;3.14,-5.06,;3.14,-6.6,;4.47,-7.37,;5.81,-6.6,;7.14,-7.37,;8.47,-6.6,;8.47,-5.06,;9.81,-4.29,;7.14,-4.29,;5.81,-5.06,;1.81,-7.37,;.72,-8.46,;2.89,-8.46,;.47,-6.6,;-1.02,-7,;-1.49,-8.46,;-3.03,-8.46,;-3.51,-7,;-4.99,-6.6,;-5.47,-5.14,;-7.01,-5.14,;-7.49,-6.6,;-8.95,-7.08,;-6.24,-7.51,;-2.26,-6.09,;-2.26,-4.55,;-3.6,-3.78,;-4.93,-4.55,;-6.26,-3.78,;-3.6,-2.24,;-2.26,-1.47,;-.93,-2.24,;-.93,-3.78,;.41,-4.55,;1.74,-3.78,)|

BDBM456637

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](CCO)[C@H](C)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |wU:20.21,wD:16.17,(1.24,-3.4,;-.08,-4.19,;-1.43,-3.45,;-1.46,-1.91,;-2.81,-1.16,;-4.13,-1.96,;-4.1,-3.5,;-5.41,-4.3,;-6.76,-3.55,;-2.75,-4.24,;-2.72,-5.78,;-1.46,-6.66,;,-6.16,;1.16,-7.17,;.16,-8.33,;2.17,-6,;2.33,-8.18,;3.78,-7.67,;4.07,-6.16,;5.53,-5.66,;2.04,-9.69,;.58,-10.19,;3.2,-10.7,;4.66,-10.19,;5.82,-11.2,;5.53,-12.71,;6.69,-13.72,;4.07,-13.22,;2.91,-12.21,;-1.9,-8.14,;-3.44,-8.17,;-3.95,-6.71,;-5.42,-6.26,;-6.65,-7.19,;-7.91,-6.31,;-7.46,-4.84,;-8.39,-3.61,;-5.92,-4.81,)|

BDBM456638

COC[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:3.3,(4.32,-2.76,;4.32,-4.3,;2.99,-5.07,;2.99,-6.61,;4.32,-7.38,;5.65,-6.61,;6.99,-7.38,;8.32,-6.61,;8.32,-5.07,;9.66,-4.3,;6.99,-4.3,;5.65,-5.07,;1.65,-7.38,;.56,-8.47,;2.74,-8.47,;.32,-6.61,;-1.17,-7.01,;-1.64,-8.48,;-3.18,-8.48,;-3.66,-7.01,;-5.15,-6.61,;-5.62,-5.15,;-7.16,-5.15,;-7.64,-6.61,;-9.1,-7.09,;-6.39,-7.52,;-2.41,-6.11,;-2.41,-4.57,;-3.75,-3.8,;-5.08,-4.57,;-6.42,-3.8,;-3.75,-2.26,;-2.41,-1.49,;-1.08,-2.26,;-1.08,-3.8,;.25,-4.57,;1.59,-3.8,)|

BDBM456639

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:18.19,16.17,(-6.35,-16.21,;-5.02,-16.98,;-3.69,-16.21,;-3.69,-14.67,;-2.35,-13.9,;-1.02,-14.67,;-1.02,-16.21,;.31,-16.98,;1.65,-16.21,;-2.35,-16.98,;-2.35,-18.52,;-1.11,-19.43,;.36,-18.95,;1.5,-19.98,;.73,-21.31,;2.27,-21.31,;2.97,-19.5,;3.29,-18,;4.11,-20.54,;3.79,-22.04,;5.57,-20.06,;5.9,-18.55,;7.36,-18.08,;8.5,-19.11,;9.97,-18.63,;8.18,-20.61,;6.72,-21.09,;-1.58,-20.89,;-3.12,-20.89,;-3.6,-19.43,;-5.06,-18.95,;-5.54,-17.49,;-7.08,-17.49,;-7.56,-18.95,;-9.02,-19.43,;-6.31,-19.86,)|

BDBM456640

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](CCO)Cc2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.20,(-6.36,-3.8,;-5.03,-4.57,;-3.69,-3.8,;-3.69,-2.26,;-2.36,-1.49,;-1.03,-2.26,;-1.03,-3.8,;.31,-4.57,;1.64,-3.8,;-2.36,-4.57,;-2.36,-6.11,;-1.11,-7.01,;.37,-6.61,;1.71,-7.38,;.62,-8.47,;2.8,-8.47,;3.04,-6.61,;3.04,-5.07,;4.38,-4.3,;4.38,-2.76,;4.38,-7.38,;5.71,-6.61,;7.04,-7.38,;8.38,-6.61,;8.38,-5.07,;9.71,-4.3,;7.04,-4.3,;5.71,-5.07,;-1.59,-8.48,;-3.13,-8.48,;-3.6,-7.01,;-5.09,-6.61,;-5.57,-5.15,;-7.11,-5.15,;-7.58,-6.61,;-9.05,-7.09,;-6.34,-7.52,)|

BDBM456641

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)c(c2)C#N)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-7.1,-17.26,;-5.76,-18.03,;-4.43,-17.26,;-4.43,-15.72,;-3.1,-14.95,;-1.76,-15.72,;-1.76,-17.26,;-.43,-18.03,;.91,-17.26,;-3.1,-18.03,;-3.1,-19.57,;-1.85,-20.48,;-.39,-20,;.95,-20.77,;-.14,-21.86,;2.04,-21.86,;2.28,-20,;2.28,-18.46,;3.62,-20.77,;3.62,-22.31,;4.95,-20,;4.95,-18.46,;6.28,-17.69,;7.62,-18.46,;8.95,-17.69,;7.66,-20.03,;6.28,-20.77,;9,-20.8,;10.33,-21.57,;-2.33,-21.94,;-3.87,-21.94,;-4.34,-20.48,;-5.81,-20,;-6.28,-18.54,;-7.82,-18.54,;-8.3,-20,;-9.76,-20.48,;-7.05,-20.91,)|

BDBM456642

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2oc(C)nc2C)nnc1-c1ccc(C)o1 |r,wD:18.19,16.17,(-5.17,-17.82,;-3.83,-18.59,;-2.5,-17.82,;-2.5,-16.28,;-1.17,-15.51,;.17,-16.28,;.17,-17.82,;1.5,-18.59,;2.83,-17.82,;-1.17,-18.59,;-1.17,-20.13,;.08,-21.03,;1.54,-20.56,;2.88,-21.33,;1.79,-22.42,;3.97,-22.42,;3.97,-20.24,;3.57,-18.75,;5.45,-20.64,;5.85,-22.12,;6.54,-19.55,;6.3,-18.03,;7.67,-17.33,;7.92,-15.81,;8.76,-18.42,;8.06,-19.79,;8.76,-21.16,;-.4,-22.5,;-1.94,-22.5,;-2.41,-21.03,;-3.88,-20.56,;-4.35,-19.09,;-5.89,-19.09,;-6.37,-20.56,;-7.83,-21.03,;-5.12,-21.46,)|

BDBM456643

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cccc(Cl)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.1,1.76,;-4.76,.99,;-3.43,1.76,;-3.43,3.3,;-2.1,4.07,;-.76,3.3,;-.76,1.76,;.57,.99,;1.91,1.76,;-2.1,.99,;-2.1,-.55,;-.85,-1.45,;.62,-.98,;1.76,-2.01,;2.53,-3.34,;.99,-3.34,;3.22,-1.53,;3.54,-.03,;4.37,-2.56,;4.05,-4.07,;5.83,-2.09,;6.98,-3.12,;8.44,-2.64,;8.76,-1.14,;7.62,-.11,;7.94,1.4,;6.15,-.58,;-1.33,-2.92,;-2.87,-2.92,;-3.34,-1.45,;-4.81,-.98,;-5.28,.49,;-6.82,.49,;-7.3,-.98,;-8.76,-1.45,;-6.05,-1.88,)|

BDBM456644

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(C#N)c(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(.15,-15.76,;-1,-16.79,;-2.46,-16.32,;-2.78,-14.81,;-4.25,-14.33,;-5.39,-15.36,;-5.07,-16.87,;-6.22,-17.9,;-7.68,-17.42,;-3.61,-17.35,;-3.29,-18.85,;-1.88,-19.48,;-.55,-18.71,;.79,-19.48,;1.56,-18.14,;.02,-20.81,;2.12,-20.25,;2.12,-21.79,;3.46,-19.48,;3.46,-17.94,;4.79,-20.25,;6.12,-19.48,;7.46,-20.25,;7.5,-21.82,;8.84,-22.59,;10.17,-23.36,;6.12,-22.56,;6.12,-24.1,;4.79,-21.79,;-2.04,-21.01,;-3.55,-21.33,;-4.32,-20,;-5.85,-19.84,;-6.62,-18.5,;-8.12,-18.82,;-8.29,-20.35,;-9.62,-21.12,;-6.88,-20.98,)|

BDBM456645

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cccc(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.1,1.76,;-4.76,.99,;-3.43,1.76,;-3.43,3.3,;-2.1,4.07,;-.76,3.3,;-.76,1.76,;.57,.99,;1.91,1.76,;-2.1,.99,;-2.1,-.55,;-.85,-1.45,;.62,-.98,;1.76,-2.01,;2.53,-3.34,;.99,-3.34,;3.22,-1.53,;3.54,-.03,;4.37,-2.56,;4.05,-4.07,;5.83,-2.09,;6.98,-3.12,;8.44,-2.64,;8.76,-1.14,;7.62,-.11,;7.94,1.4,;6.15,-.58,;-1.33,-2.92,;-2.87,-2.92,;-3.34,-1.45,;-4.81,-.98,;-5.28,.49,;-6.82,.49,;-7.3,-.98,;-8.76,-1.45,;-6.05,-1.88,)|

BDBM456646

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(C#N)c(C)n2)nnc1-c1ccc(C)o1 |wU:16.17,wD:18.19,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;;.77,1.33,;-.77,-1.33,;-1.33,.77,;-2.67,,;-1.33,2.31,;,3.08,;-2.67,3.08,;-2.67,4.62,;-4,5.39,;-5.33,4.62,;-6.67,5.39,;-8,6.16,;-5.33,3.08,;-6.67,2.31,;-4,2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;4.55,-5.93,;5.02,-7.39,;3.78,-8.3,;3.78,-9.84,;2.53,-7.39,)|

BDBM456647

COc1cccc(OC)c1NC(=S)NS(=O)(=O)[C@@H](C)Cc1ncc(F)cn1 |r|

BDBM456648

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccccn2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.1,1.76,;-4.76,.99,;-3.43,1.76,;-3.43,3.3,;-2.1,4.07,;-.76,3.3,;-.76,1.76,;.57,.99,;1.91,1.76,;-2.1,.99,;-2.1,-.55,;-.85,-1.45,;.62,-.98,;1.76,-2.01,;2.53,-3.34,;.99,-3.34,;3.22,-1.53,;3.54,-.03,;4.37,-2.56,;4.05,-4.07,;5.83,-2.09,;6.98,-3.12,;8.44,-2.64,;8.76,-1.14,;7.62,-.11,;6.15,-.58,;-1.33,-2.92,;-2.87,-2.92,;-3.34,-1.45,;-4.81,-.98,;-5.28,.49,;-6.82,.49,;-7.3,-.98,;-8.76,-1.45,;-6.05,-1.88,)|

BDBM456649

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)c(C)o1 |r,wD:16.17,(-6.43,-4.14,;-5.1,-4.91,;-3.76,-4.14,;-3.76,-2.6,;-2.43,-1.83,;-1.1,-2.6,;-1.1,-4.14,;.24,-4.91,;1.57,-4.14,;-2.43,-4.91,;-2.43,-6.45,;-1.18,-7.35,;.15,-6.58,;1.48,-7.35,;.15,-8.12,;2.82,-8.12,;2.82,-6.58,;2.82,-5.04,;4.15,-7.35,;5.48,-6.58,;6.82,-7.35,;8.15,-6.58,;8.15,-5.04,;9.49,-4.27,;6.82,-4.27,;5.48,-5.04,;-1.66,-8.82,;-3.2,-8.82,;-3.68,-7.35,;-5.22,-7.35,;-6.12,-6.11,;-7.59,-6.58,;-8.83,-5.68,;-7.59,-8.12,;-8.83,-9.03,;-6.12,-8.6,)|

BDBM456650

CCc1ccc(o1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:15.16,(-11.23,6.05,;-10.15,4.96,;-8.66,5.36,;-8.18,6.82,;-6.64,6.82,;-6.17,5.36,;-7.41,4.45,;-4.7,4.88,;-4.23,3.42,;-2.69,3.42,;-2.21,4.88,;-.74,5.36,;.4,4.33,;-.37,2.99,;1.17,2.99,;1.73,5.1,;1.73,6.64,;3.07,4.33,;4.4,5.1,;5.73,4.33,;7.07,5.1,;7.07,6.64,;8.4,7.41,;5.73,7.41,;4.4,6.64,;-3.46,5.79,;-3.46,7.33,;-4.79,8.1,;-6.12,7.33,;-7.46,8.1,;-4.79,9.64,;-3.46,10.41,;-2.12,9.64,;-2.12,8.1,;-.79,7.33,;.55,8.1,)|

BDBM456651

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-4.18,-2.39,;-3.41,-3.72,;-1.87,-3.72,;-1.1,-2.39,;.44,-2.39,;1.21,-3.72,;.44,-5.06,;1.21,-6.39,;2.75,-6.39,;-1.1,-5.06,;-1.87,-6.39,;-1.25,-7.8,;.26,-8.12,;.74,-9.58,;-.75,-9.98,;1.13,-11.07,;2.22,-9.18,;2.62,-7.7,;3.31,-10.27,;2.91,-11.76,;4.8,-9.87,;5.89,-10.96,;7.38,-10.56,;7.77,-9.08,;9.26,-8.68,;6.69,-7.99,;5.2,-8.39,;-2.39,-8.83,;-3.72,-8.06,;-3.4,-6.55,;-4.44,-5.41,;-4.12,-3.9,;-5.45,-3.13,;-6.59,-4.16,;-8.1,-3.84,;-5.97,-5.57,)|

BDBM456652

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,(-6.21,-4.66,;-4.87,-5.43,;-3.54,-4.66,;-3.54,-3.12,;-2.21,-2.35,;-.87,-3.12,;-.87,-4.66,;.46,-5.43,;1.8,-4.66,;-2.21,-5.43,;-2.21,-6.97,;-.96,-7.87,;.5,-7.4,;1.65,-8.43,;.88,-9.76,;2.42,-9.76,;2.98,-7.66,;2.98,-6.12,;4.32,-8.43,;5.65,-7.66,;6.98,-8.43,;8.32,-7.66,;8.32,-6.12,;9.65,-5.35,;6.98,-5.35,;5.65,-6.12,;-1.44,-9.34,;-2.98,-9.34,;-3.45,-7.87,;-4.92,-7.4,;-5.39,-5.93,;-6.93,-5.93,;-7.41,-7.4,;-8.9,-7.8,;-6.16,-8.3,)|

BDBM456653

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-4.18,-2.39,;-3.41,-3.72,;-1.87,-3.72,;-1.1,-2.39,;.44,-2.39,;1.21,-3.72,;.44,-5.06,;1.21,-6.39,;2.75,-6.39,;-1.1,-5.06,;-1.87,-6.39,;-1.25,-7.8,;.26,-8.12,;.74,-9.58,;-.75,-9.98,;1.13,-11.07,;2.22,-9.18,;2.62,-7.7,;3.31,-10.27,;2.91,-11.76,;4.8,-9.87,;5.89,-10.96,;7.38,-10.56,;7.77,-9.08,;9.26,-8.68,;6.69,-7.99,;5.2,-8.39,;-2.39,-8.83,;-3.72,-8.06,;-3.4,-6.55,;-4.44,-5.41,;-4.12,-3.9,;-5.45,-3.13,;-6.59,-4.16,;-8.1,-3.84,;-5.97,-5.57,)|

BDBM456655

CCc1ccc(o1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:15.16,(-9.73,-6.61,;-8.64,-7.69,;-7.15,-7.3,;-6.68,-5.83,;-5.14,-5.83,;-4.66,-7.3,;-5.91,-8.2,;-3.2,-7.77,;-2.72,-9.24,;-1.18,-9.24,;-.71,-7.77,;.76,-7.3,;1.9,-8.33,;1.13,-9.66,;2.67,-9.66,;3.24,-7.56,;3.24,-6.02,;4.57,-8.33,;5.9,-7.56,;7.24,-8.33,;8.57,-7.56,;8.57,-6.02,;9.9,-5.25,;7.24,-5.25,;5.9,-6.02,;-1.95,-6.87,;-1.95,-5.33,;-3.29,-4.56,;-4.62,-5.33,;-5.95,-4.56,;-3.29,-3.02,;-1.95,-2.25,;-.62,-3.02,;-.62,-4.56,;.71,-5.33,;2.05,-4.56,)|

BDBM456656

CCc1ccc(o1)-c1nnc(NS(=O)(=O)CCc2ncc(F)cn2)n1-c1c(OC)cccc1OC |(-9.82,-.65,;-8.73,-1.74,;-7.24,-1.34,;-6.77,.12,;-5.23,.12,;-4.75,-1.34,;-6,-2.25,;-3.28,-1.82,;-2.81,-3.28,;-1.27,-3.28,;-.79,-1.82,;.67,-1.34,;1.82,-2.37,;1.05,-3.71,;2.59,-3.71,;3.15,-1.6,;4.48,-2.37,;5.82,-1.6,;7.15,-2.37,;8.48,-1.6,;8.48,-.06,;9.82,.71,;7.15,.71,;5.82,-.06,;-2.04,-.91,;-2.04,.63,;-3.37,1.4,;-4.71,.63,;-6.04,1.4,;-3.37,2.94,;-2.04,3.71,;-.71,2.94,;-.71,1.4,;.63,.63,;1.96,1.4,)|

BDBM456658

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCC[C@@H]2c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.16,wD:20.22,(-3.79,-5.07,;-2.45,-5.84,;-1.12,-5.07,;-1.12,-3.53,;.22,-2.76,;1.55,-3.53,;1.55,-5.07,;2.88,-5.84,;4.22,-5.07,;.22,-5.84,;.22,-7.38,;1.46,-8.29,;2.93,-7.81,;4.07,-8.84,;3.3,-10.17,;4.84,-10.17,;5.53,-8.36,;6.01,-6.9,;7.55,-6.9,;8.03,-8.36,;6.78,-9.27,;6.78,-10.81,;5.45,-11.58,;5.45,-13.12,;6.78,-13.89,;6.78,-15.43,;8.11,-13.12,;8.11,-11.58,;.99,-9.75,;-.55,-9.75,;-1.03,-8.29,;-2.5,-7.81,;-2.97,-6.35,;-4.51,-6.35,;-4.99,-7.81,;-6.45,-8.29,;-3.74,-8.72,)|

BDBM456659

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCC[C@@H]2c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.16,wD:20.22,(-3.89,-5.07,;-2.56,-5.84,;-1.22,-5.07,;-1.22,-3.53,;.11,-2.76,;1.45,-3.53,;1.45,-5.07,;2.78,-5.84,;4.11,-5.07,;.11,-5.84,;.11,-7.38,;1.36,-8.29,;2.82,-7.81,;3.97,-8.84,;3.2,-10.17,;4.74,-10.17,;5.43,-8.36,;5.91,-6.9,;7.45,-6.9,;7.92,-8.36,;6.68,-9.27,;6.68,-10.81,;5.34,-11.58,;5.34,-13.12,;6.68,-13.89,;6.68,-15.43,;8.01,-13.12,;8.01,-11.58,;.88,-9.75,;-.66,-9.75,;-1.13,-8.29,;-2.6,-7.81,;-3.07,-6.35,;-4.61,-6.35,;-5.09,-7.81,;-6.55,-8.29,;-3.84,-8.72,)|

BDBM456661

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCC[C@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:16.16,21.23,(-4.79,-4.25,;-3.45,-5.02,;-2.12,-4.25,;-2.12,-2.71,;-.79,-1.94,;.55,-2.71,;.55,-4.25,;1.88,-5.02,;3.22,-4.25,;-.79,-5.02,;-.79,-6.56,;.46,-7.46,;1.95,-7.07,;3.04,-8.16,;2.27,-9.49,;3.81,-9.49,;4.52,-7.76,;4.92,-6.27,;6.41,-5.87,;7.5,-6.96,;7.1,-8.45,;5.61,-8.85,;5.61,-10.39,;4.28,-11.16,;4.28,-12.7,;5.61,-13.47,;5.61,-15.01,;6.95,-12.7,;6.95,-11.16,;-.02,-8.93,;-1.56,-8.93,;-2.03,-7.46,;-3.52,-7.07,;-3.99,-5.6,;-5.53,-5.6,;-6.01,-7.07,;-4.76,-7.97,)|

BDBM456662

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCC[C@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:20.22,wD:16.16,(-4.44,-3.79,;-3.11,-4.56,;-1.78,-3.79,;-1.78,-2.25,;-.44,-1.48,;.89,-2.25,;.89,-3.79,;2.22,-4.56,;3.56,-3.79,;-.44,-4.56,;-.44,-6.1,;.8,-7.01,;2.29,-6.61,;3.38,-7.7,;2.61,-9.03,;4.15,-9.03,;4.87,-7.3,;5.34,-5.83,;6.88,-5.83,;7.36,-7.3,;6.11,-8.2,;6.11,-9.74,;4.78,-10.51,;4.78,-12.05,;6.11,-12.82,;6.11,-14.36,;7.45,-12.05,;7.45,-10.51,;.33,-8.47,;-1.21,-8.47,;-1.69,-7.01,;-3.18,-6.61,;-3.65,-5.14,;-5.19,-5.14,;-5.67,-6.61,;-4.42,-7.51,)|

BDBM456663

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCC[C@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:21.23,wD:16.16,(-4.68,-4.25,;-3.35,-5.02,;-2.02,-4.25,;-2.02,-2.71,;-.68,-1.94,;.65,-2.71,;.65,-4.25,;1.99,-5.02,;3.32,-4.25,;-.68,-5.02,;-.68,-6.56,;.56,-7.46,;2.05,-7.07,;3.14,-8.16,;2.37,-9.49,;3.91,-9.49,;4.63,-7.76,;5.03,-6.27,;6.51,-5.87,;7.6,-6.96,;7.2,-8.45,;5.72,-8.85,;5.72,-10.39,;4.38,-11.16,;4.38,-12.7,;5.72,-13.47,;5.72,-15.01,;7.05,-12.7,;7.05,-11.16,;.09,-8.93,;-1.45,-8.93,;-1.93,-7.46,;-3.42,-7.07,;-3.89,-5.6,;-5.43,-5.6,;-5.91,-7.07,;-4.66,-7.97,)|

BDBM456664

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,(-7.67,8.31,;-6.34,7.54,;-5.01,8.31,;-5.01,9.85,;-3.67,10.62,;-2.34,9.85,;-2.34,8.31,;-1.01,7.54,;.33,8.31,;-3.67,7.54,;-3.67,6,;-2.43,5.1,;-.96,5.57,;.18,4.54,;-.59,3.21,;.95,3.21,;1.52,5.31,;1.52,6.85,;2.85,4.54,;4.18,5.31,;5.52,4.54,;6.85,5.31,;6.85,6.85,;8.18,7.62,;5.52,7.62,;4.18,6.85,;-2.9,3.63,;-4.44,3.63,;-4.92,5.1,;-6.38,5.57,;-6.86,7.04,;-8.4,7.04,;-8.88,5.57,;-10.36,5.17,;-7.63,4.67,)|

BDBM456665

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.69,1.37,;-5.36,.6,;-4.02,1.37,;-4.02,2.91,;-2.69,3.68,;-1.36,2.91,;-1.36,1.37,;-.02,.6,;1.31,1.37,;-2.69,.6,;-2.69,-.94,;-1.44,-1.85,;.02,-1.37,;1.35,-2.14,;.58,-3.47,;2.12,-3.47,;2.69,-1.37,;2.69,.17,;4.02,-2.14,;4.02,-3.68,;5.36,-1.37,;6.69,-2.14,;8.02,-1.37,;8.02,.17,;9.36,.94,;6.69,.94,;5.36,.17,;-1.92,-3.31,;-3.46,-3.31,;-3.94,-1.85,;-5.4,-1.37,;-5.88,.1,;-7.42,.1,;-7.89,-1.37,;-9.36,-1.85,;-6.65,-2.27,)|

BDBM456666

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |wU:16.17,wD:18.19,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;;.77,1.33,;-.77,-1.33,;-1.33,.77,;-2.67,,;-1.33,2.31,;,3.08,;-2.67,3.08,;-2.67,4.62,;-4,5.39,;-5.33,4.62,;-6.67,5.39,;-5.33,3.08,;-4,2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;4.55,-5.93,;5.02,-7.39,;3.78,-8.3,;3.78,-9.84,;2.53,-7.39,)|

BDBM456667

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccco1 |(-7.3,1.54,;-5.97,.77,;-4.63,1.54,;-4.63,3.08,;-3.3,3.85,;-1.97,3.08,;-1.97,1.54,;-.63,.77,;.7,1.54,;-3.3,.77,;-3.3,-.77,;-2.05,-1.67,;-.57,-1.28,;.52,-2.36,;-.57,-3.45,;.92,-3.85,;1.86,-1.59,;3.19,-2.36,;4.52,-1.59,;5.86,-2.36,;7.19,-1.59,;7.19,-.05,;8.52,.72,;5.86,.72,;4.52,-.05,;-2.53,-3.14,;-4.07,-3.14,;-4.55,-1.67,;-6.03,-1.28,;-6.51,.19,;-8.05,.19,;-8.52,-1.28,;-7.28,-2.18,)|

BDBM456668

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.15,-.2,;-4.66,-.6,;-3.57,.49,;-3.97,1.98,;-2.88,3.07,;-1.39,2.67,;-1,1.18,;.49,.78,;1.58,1.87,;-2.08,.09,;-1.57,-1.78,;-.16,-2.41,;1.17,-1.64,;2.51,-2.41,;3.84,-3.18,;1.74,-3.74,;3.28,-1.07,;2.51,.26,;4.82,-1.07,;5.59,-2.41,;5.59,.26,;7.13,.26,;7.9,1.59,;7.13,2.93,;7.9,4.26,;5.59,2.93,;4.82,1.59,;-.32,-3.94,;-1.83,-4.26,;-2.6,-2.93,;-4.13,-2.77,;-4.9,-1.43,;-6.4,-1.75,;-6.56,-3.28,;-7.9,-4.05,;-5.16,-3.91,)|

BDBM456669

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(5.36,-4.06,;4.02,-3.29,;4.02,-1.75,;2.69,-.98,;2.69,.56,;1.35,-1.75,;.58,-3.09,;2.12,-3.09,;.02,-.98,;-1.44,-1.46,;-1.92,-2.93,;-3.46,-2.93,;-3.94,-1.46,;-5.4,-.98,;-5.88,.48,;-7.42,.48,;-7.89,-.98,;-9.36,-1.46,;-6.65,-1.89,;-2.69,-.56,;-2.69,.98,;-4.02,1.75,;-5.36,.98,;-6.69,1.75,;-4.02,3.29,;-2.69,4.06,;-1.36,3.29,;-1.36,1.75,;-.02,.98,;1.31,1.75,;5.36,-.98,;6.69,-1.75,;8.02,-.98,;8.02,.56,;9.36,1.33,;6.69,1.33,;5.36,.56,)|

BDBM456670

CCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,wD:3.2,(5.36,-4.83,;5.36,-3.29,;4.02,-2.52,;4.02,-.98,;2.69,-.21,;2.69,1.33,;1.35,-.98,;.58,-2.32,;2.12,-2.32,;.02,-.21,;-1.44,-.69,;-1.92,-2.16,;-3.46,-2.16,;-3.94,-.69,;-5.4,-.21,;-5.88,1.25,;-7.42,1.25,;-7.89,-.21,;-9.36,-.69,;-6.65,-1.12,;-2.69,.21,;-2.69,1.75,;-4.02,2.52,;-5.36,1.75,;-6.69,2.52,;-4.02,4.06,;-2.69,4.83,;-1.36,4.06,;-1.36,2.52,;-.02,1.75,;1.31,2.52,;5.36,-.21,;6.69,-.98,;8.02,-.21,;8.02,1.33,;9.36,2.1,;6.69,2.1,;5.36,1.33,)|

BDBM456671

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:4.4,3.2,(5.36,-4.83,;5.36,-3.29,;4.02,-2.52,;4.02,-.98,;2.69,-.21,;2.69,1.33,;1.35,-.98,;.58,-2.32,;2.12,-2.32,;.02,-.21,;-1.44,-.69,;-1.92,-2.16,;-3.46,-2.16,;-3.94,-.69,;-5.4,-.21,;-5.88,1.25,;-7.42,1.25,;-7.89,-.21,;-9.36,-.69,;-6.65,-1.12,;-2.69,.21,;-2.69,1.75,;-4.02,2.52,;-5.36,1.75,;-6.69,2.52,;-4.02,4.06,;-2.69,4.83,;-1.36,4.06,;-1.36,2.52,;-.02,1.75,;1.31,2.52,;5.36,-.21,;6.69,-.98,;8.02,-.21,;8.02,1.33,;9.36,2.1,;6.69,2.1,;5.36,1.33,)|

BDBM456672

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1ccc(C)o1 |(-8.11,8.75,;-6.78,7.98,;-5.44,8.75,;-5.44,10.29,;-4.11,11.06,;-2.78,10.29,;-2.78,8.75,;-1.44,7.98,;-.11,8.75,;-4.11,7.98,;-4.11,6.44,;-2.86,5.53,;-1.38,5.93,;-.04,5.16,;-.81,3.83,;.73,3.83,;1.29,5.93,;2.62,5.16,;3.96,5.93,;3.96,7.47,;5.29,8.24,;6.63,7.47,;7.96,8.24,;6.63,5.93,;5.29,5.16,;5.29,3.62,;5.29,2.08,;-3.34,4.07,;-4.88,4.07,;-5.36,5.53,;-6.84,5.93,;-7.32,7.4,;-8.86,7.4,;-9.34,5.93,;-10.82,5.53,;-8.09,5.03,)|

BDBM456673

COCCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,5.4,(7.18,-20.36,;7.18,-18.82,;5.84,-18.05,;5.84,-16.51,;4.51,-15.74,;4.51,-14.2,;3.18,-13.43,;3.18,-11.89,;1.84,-14.2,;2.61,-15.53,;1.2,-15.53,;.51,-13.43,;-.96,-13.9,;-1.43,-15.37,;-2.97,-15.37,;-3.45,-13.9,;-4.91,-13.43,;-5.39,-11.96,;-6.93,-11.96,;-7.4,-13.43,;-8.87,-13.9,;-6.16,-14.33,;-2.2,-13,;-2.2,-11.46,;-.87,-10.69,;.47,-11.46,;1.8,-10.69,;-.87,-9.15,;-2.2,-8.38,;-3.54,-9.15,;-3.54,-10.69,;-4.87,-11.46,;-6.2,-10.69,;5.84,-13.43,;7.18,-14.2,;8.51,-13.43,;8.51,-11.89,;9.84,-11.12,;7.18,-11.12,;5.84,-11.89,)|

BDBM456674

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OCCO)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(.76,9.02,;-.58,8.25,;-1.91,9.02,;-1.91,10.56,;-3.24,11.33,;-4.58,10.56,;-4.58,9.02,;-5.91,8.25,;-7.25,9.02,;-3.24,8.25,;-3.24,6.71,;-2,5.8,;-.53,6.28,;.8,5.51,;.03,4.17,;1.57,4.17,;2.13,6.28,;2.13,7.82,;3.47,5.51,;3.47,4.11,;4.8,3.34,;4.8,2.02,;6.13,1.25,;4.8,6.28,;6.13,5.51,;7.47,6.28,;7.47,7.82,;8.51,8.41,;6.13,8.59,;4.8,7.82,;-2.47,4.34,;-4.01,4.34,;-4.49,5.8,;-5.96,6.28,;-6.43,7.74,;-7.97,7.74,;-8.45,6.28,;-9.62,5.91,;-7.2,5.37,)|

BDBM456675

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:2.1,wD:3.3,(5.36,-4.06,;4.02,-3.29,;4.02,-1.75,;2.69,-.98,;2.69,.56,;1.35,-1.75,;.58,-3.09,;2.12,-3.09,;.02,-.98,;-1.44,-1.46,;-1.92,-2.93,;-3.46,-2.93,;-3.94,-1.46,;-5.4,-.98,;-5.88,.48,;-7.42,.48,;-7.89,-.98,;-9.36,-1.46,;-6.65,-1.89,;-2.69,-.56,;-2.69,.98,;-4.02,1.75,;-5.36,.98,;-6.69,1.75,;-4.02,3.29,;-2.69,4.06,;-1.36,3.29,;-1.36,1.75,;-.02,.98,;1.31,1.75,;5.36,-.98,;6.69,-1.75,;8.02,-.98,;8.02,.56,;9.36,1.33,;6.69,1.33,;5.36,.56,)|

BDBM456676

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,(1.06,-4.29,;-.27,-5.06,;-1.6,-4.29,;-1.65,-2.72,;-2.98,-1.95,;-4.32,-2.72,;-4.32,-4.26,;-5.65,-5.03,;-6.99,-4.26,;-2.98,-5.03,;-2.98,-7.38,;-1.74,-8.29,;-.41,-7.52,;.93,-8.29,;1.7,-9.62,;.16,-9.62,;2.26,-7.52,;3.6,-8.29,;3.6,-9.83,;4.93,-7.52,;6.26,-8.29,;7.6,-7.52,;7.6,-5.98,;8.93,-5.21,;6.26,-5.21,;4.93,-5.98,;-2.21,-9.75,;-3.75,-9.75,;-4.23,-8.29,;-5.56,-7.52,;-6.81,-8.43,;-8.06,-7.52,;-7.58,-6.06,;-8.35,-4.72,;-6.04,-6.06,)|

BDBM456677

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(F)cn2)nnc1-c1ccc(C)o1 |(-6.76,1.59,;-5.42,.82,;-4.09,1.59,;-4.09,3.13,;-2.76,3.9,;-1.42,3.13,;-1.42,1.59,;-.09,.82,;1.25,1.59,;-2.76,.82,;-2.76,-1.53,;-1.51,-2.44,;-.18,-1.67,;1.16,-2.44,;1.93,-3.77,;.39,-3.77,;2.49,-1.67,;3.83,-2.44,;5.16,-1.67,;6.49,-2.44,;7.83,-1.67,;7.83,-.13,;9.16,.64,;6.49,.64,;5.16,-.13,;-1.99,-3.9,;-3.53,-3.9,;-4,-2.44,;-5.33,-1.67,;-5.81,-.2,;-7.35,-.2,;-7.83,-1.67,;-9.16,-2.44,;-6.58,-2.57,)|

BDBM456678

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,(1.06,-4.29,;-.27,-5.06,;-1.6,-4.29,;-1.65,-2.72,;-2.98,-1.95,;-4.32,-2.72,;-4.32,-4.26,;-5.65,-5.03,;-6.83,-4.04,;-2.98,-5.03,;-2.98,-7.38,;-1.74,-8.29,;-.41,-7.52,;.93,-8.29,;1.7,-9.62,;.16,-9.62,;2.26,-7.52,;3.6,-8.29,;3.6,-9.83,;4.93,-7.52,;6.26,-8.29,;7.6,-7.52,;7.6,-5.98,;8.93,-5.21,;6.26,-5.21,;4.93,-5.98,;-2.21,-9.75,;-3.75,-9.75,;-4.23,-8.29,;-5.56,-7.52,;-6.81,-8.43,;-8.06,-7.52,;-7.58,-6.06,;-8.35,-4.72,;-6.04,-6.06,)|

BDBM456679

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,(1.17,-4.29,;-.17,-5.06,;-1.5,-4.29,;-1.55,-2.72,;-2.88,-1.95,;-4.22,-2.72,;-4.22,-4.26,;-5.55,-5.03,;-6.73,-4.05,;-2.88,-5.03,;-2.88,-7.38,;-1.64,-8.29,;-.3,-7.52,;1.03,-8.29,;1.8,-9.62,;.26,-9.62,;2.37,-7.52,;3.7,-8.29,;3.7,-9.83,;5.03,-7.52,;6.37,-8.29,;7.7,-7.52,;7.7,-5.98,;9.03,-5.21,;6.37,-5.21,;5.03,-5.98,;-2.11,-9.75,;-3.65,-9.75,;-4.13,-8.29,;-5.46,-7.52,;-6.71,-8.43,;-7.95,-7.52,;-7.48,-6.06,;-8.25,-4.72,;-5.94,-6.06,)|

BDBM456680

CC[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:2.2,(4.02,.84,;2.69,.07,;2.69,-1.47,;4.02,-2.24,;5.36,-1.47,;6.69,-2.24,;8.02,-1.47,;8.02,.07,;9.36,.84,;6.69,.84,;5.36,.07,;1.35,-2.24,;.58,-3.58,;2.12,-3.58,;.02,-1.47,;-1.44,-1.95,;-1.92,-3.41,;-3.46,-3.41,;-3.94,-1.95,;-5.4,-1.47,;-5.88,-.01,;-7.42,-.01,;-7.89,-1.47,;-9.36,-1.95,;-6.65,-2.38,;-2.69,-1.04,;-2.69,.5,;-4.02,1.27,;-5.36,.5,;-6.69,1.27,;-4.02,2.81,;-2.69,3.58,;-1.36,2.81,;-1.36,1.27,;-.02,.5,;1.31,1.27,)|

BDBM456681

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](C)c2ncc(F)cn2)nnc1-c1ccco1 |r,wD:17.18,(-7.42,1.37,;-6.09,.6,;-4.76,1.37,;-4.76,2.91,;-3.42,3.68,;-2.09,2.91,;-2.09,1.37,;-.75,.6,;.58,1.37,;-3.42,.6,;-3.42,-.94,;-2.18,-1.85,;-.71,-1.37,;.62,-2.14,;-.15,-3.47,;1.39,-3.47,;1.96,-1.37,;3.29,-2.14,;3.29,-3.68,;4.62,-1.37,;5.96,-2.14,;7.29,-1.37,;7.29,.17,;8.62,.94,;5.96,.94,;4.62,.17,;-2.65,-3.31,;-4.19,-3.31,;-4.67,-1.85,;-6.13,-1.37,;-6.61,.1,;-8.15,.1,;-8.62,-1.37,;-7.38,-2.27,)|

BDBM456682

CCO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.2,wD:4.4,(5.36,-4.83,;5.36,-3.29,;4.02,-2.52,;4.02,-.98,;2.69,-.21,;2.69,1.33,;1.35,-.98,;.58,-2.32,;2.12,-2.32,;.02,-.21,;-1.44,-.69,;-1.92,-2.16,;-3.46,-2.16,;-3.94,-.69,;-5.4,-.21,;-5.88,1.25,;-7.42,1.25,;-7.89,-.21,;-9.36,-.69,;-6.65,-1.12,;-2.69,.21,;-2.69,1.75,;-4.02,2.52,;-5.36,1.75,;-6.69,2.52,;-4.02,4.06,;-2.69,4.83,;-1.36,4.06,;-1.36,2.52,;-.02,1.75,;1.31,2.52,;5.36,-.21,;6.69,-.98,;8.02,-.21,;8.02,1.33,;9.36,2.1,;6.69,2.1,;5.36,1.33,)|

BDBM456683

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1ccc(o1)C(F)(F)F |(-6.76,2.4,;-5.42,1.63,;-4.09,2.4,;-4.09,3.94,;-2.76,4.71,;-1.42,3.94,;-1.42,2.4,;-.09,1.63,;1.25,2.4,;-2.76,1.63,;-2.76,-.72,;-1.51,-1.63,;-.18,-.86,;1.16,-1.63,;1.93,-2.96,;.39,-2.96,;2.49,-.86,;3.83,-1.63,;5.16,-.86,;5.16,.68,;6.49,1.45,;7.83,.68,;9.16,1.45,;7.83,-.86,;6.49,-1.68,;6.49,-3.22,;6.49,-4.76,;-1.99,-3.09,;-3.53,-3.09,;-4,-1.63,;-5.33,-.86,;-5.81,.61,;-7.35,.61,;-7.83,-.86,;-6.58,-1.76,;-9.16,-1.63,;-10.49,-.86,;-9.16,-3.17,;-10.49,-2.4,)|

BDBM456684

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,wD:2.1,(5.36,-4.06,;4.02,-3.29,;4.02,-1.75,;2.69,-.98,;2.69,.56,;1.35,-1.75,;.58,-3.09,;2.12,-3.09,;.02,-.98,;-1.44,-1.46,;-1.92,-2.93,;-3.46,-2.93,;-3.94,-1.46,;-5.4,-.98,;-5.88,.48,;-7.42,.48,;-7.89,-.98,;-9.36,-1.46,;-6.65,-1.89,;-2.69,-.56,;-2.69,.98,;-4.02,1.75,;-5.36,.98,;-6.69,1.75,;-4.02,3.29,;-2.69,4.06,;-1.36,3.29,;-1.36,1.75,;-.02,.98,;1.31,1.75,;5.36,-.98,;6.69,-1.75,;8.02,-.98,;8.02,.56,;9.36,1.33,;6.69,1.33,;5.36,.56,)|

BDBM456685

CC[C@@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:2.2,(3.7,-5.25,;2.37,-6.02,;2.37,-7.56,;3.7,-8.33,;5.03,-7.56,;6.37,-8.33,;7.7,-7.56,;7.7,-6.02,;9.03,-5.25,;6.37,-5.25,;5.03,-6.02,;1.03,-8.33,;1.8,-9.66,;.26,-9.66,;-.3,-7.56,;-1.64,-8.33,;-2.11,-9.79,;-3.65,-9.79,;-4.13,-8.33,;-5.46,-7.56,;-6.71,-8.46,;-7.95,-7.56,;-7.48,-6.09,;-8.25,-4.76,;-5.94,-6.09,;-2.88,-7.42,;-2.88,-5.07,;-1.5,-4.33,;-.17,-5.1,;1.17,-4.33,;-1.55,-2.76,;-2.88,-1.99,;-4.22,-2.76,;-4.22,-4.3,;-5.55,-5.07,;-6.73,-4.08,)|

BDBM456686

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(1.76,-13.96,;.43,-14.73,;-.91,-13.96,;-.91,-12.42,;-2.24,-11.65,;-3.58,-12.42,;-3.58,-13.96,;-4.91,-14.73,;-6.24,-13.96,;-2.24,-14.73,;-2.24,-17.08,;-1,-17.98,;.34,-17.21,;1.67,-17.98,;2.44,-19.32,;.9,-19.32,;3.01,-17.21,;3.01,-15.67,;4.34,-17.98,;4.34,-19.52,;5.67,-17.21,;7.01,-17.98,;8.34,-17.21,;8.34,-15.67,;9.67,-14.9,;7.01,-14.9,;5.67,-15.67,;-1.47,-19.45,;-3.01,-19.45,;-3.49,-17.98,;-4.82,-17.21,;-5.3,-15.75,;-6.84,-15.75,;-7.31,-17.21,;-8.65,-17.98,;-6.07,-18.12,)|

BDBM456687

CC[C@@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wU:2.2,(3.55,-5.31,;2.22,-6.08,;2.22,-7.62,;3.55,-8.39,;4.89,-7.62,;6.22,-8.39,;7.55,-7.62,;7.55,-6.08,;8.89,-5.31,;6.22,-5.31,;4.89,-6.08,;.88,-8.39,;1.65,-9.72,;.11,-9.72,;-.45,-7.62,;-1.78,-8.39,;-2.26,-9.85,;-3.8,-9.85,;-4.27,-8.39,;-5.61,-7.62,;-6.85,-8.52,;-8.1,-7.62,;-7.62,-6.15,;-6.08,-6.15,;-3.03,-7.48,;-3.03,-5.13,;-1.65,-4.39,;-.31,-5.16,;1.02,-4.39,;-1.69,-2.82,;-3.03,-2.05,;-4.36,-2.82,;-4.36,-4.36,;-5.7,-5.13,;-6.88,-4.14,)|

BDBM456688

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wD:3.3,2.1,(1.31,3.49,;.4,4.74,;-1.13,4.58,;-2.04,5.82,;-3.57,5.66,;-1.41,7.23,;-2.82,7.86,;-0,6.6,;-.78,8.64,;-1.69,9.88,;-3.23,9.88,;-3.7,11.35,;-2.46,12.25,;-2.46,13.79,;-3.7,14.7,;-3.23,16.16,;-1.69,16.16,;-.78,17.41,;-1.21,14.7,;-1.21,11.35,;.25,11.82,;1.4,10.79,;1.08,9.29,;2.22,8.26,;2.86,11.27,;3.18,12.78,;2.04,13.81,;.57,13.33,;-.57,14.36,;-.25,15.87,;-1.76,3.17,;-3.29,3.01,;-3.91,1.6,;-3.01,.36,;-1.48,.52,;-.85,1.92,;.68,2.09,;2.21,2.25,;-3.64,-1.05,;-4.26,-2.46,)|

BDBM456689

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1ccc(C)o1 |r,wU:17.18,(-7.75,7.33,;-6.41,6.56,;-5.08,7.33,;-5.08,8.87,;-3.75,9.64,;-2.41,8.87,;-2.41,7.33,;-1.08,6.56,;.26,7.33,;-3.75,6.56,;-3.75,5.02,;-2.5,4.11,;-1.03,4.59,;.11,3.56,;-.66,2.22,;.88,2.22,;1.44,4.33,;2.78,3.56,;2.78,2.02,;4.11,4.33,;5.44,3.56,;6.78,4.33,;6.78,5.87,;8.11,6.64,;5.44,6.64,;4.11,5.87,;2.78,6.64,;1.44,5.87,;2.01,7.97,;3.55,7.97,;-2.98,2.65,;-4.52,2.65,;-4.99,4.11,;-6.46,4.59,;-6.93,6.05,;-8.47,6.05,;-8.95,4.59,;-10.41,4.11,;-7.7,3.68,)|

BDBM456690

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1ccc(C)o1 |r,wU:17.18,(-7.81,10.81,;-6.48,10.04,;-5.14,10.81,;-5.14,12.35,;-3.81,13.12,;-2.48,12.35,;-2.48,10.81,;-1.14,10.04,;.19,10.81,;-3.81,10.04,;-3.81,8.5,;-2.56,7.59,;-1.1,8.07,;.05,7.04,;-.72,5.7,;.82,5.7,;1.38,7.81,;2.71,7.04,;2.71,5.5,;4.05,7.81,;5.38,7.04,;6.71,7.81,;6.71,9.35,;8.05,10.12,;5.38,10.12,;4.05,9.35,;2.71,10.12,;1.38,9.35,;1.94,11.45,;3.48,11.45,;-3.04,6.13,;-4.58,6.13,;-5.06,7.59,;-6.52,8.07,;-7,9.53,;-8.54,9.53,;-9.01,8.07,;-10.48,7.59,;-7.77,7.16,)|

BDBM456691

COc1cnc(nc1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(10.07,-4.51,;8.74,-3.74,;7.4,-4.51,;7.4,-6.05,;6.07,-6.82,;4.73,-6.05,;4.73,-4.51,;6.07,-3.74,;3.4,-6.82,;3.4,-8.36,;2.07,-6.05,;2.07,-4.51,;.73,-6.82,;-.04,-8.15,;1.5,-8.15,;-.41,-5.79,;-1.88,-6.26,;-2.35,-7.73,;-3.89,-7.73,;-4.37,-6.26,;-5.83,-5.79,;-6.31,-4.32,;-7.85,-4.32,;-8.32,-5.79,;-9.79,-6.26,;-7.08,-6.69,;-3.12,-5.36,;-3.12,-3.71,;-4.45,-2.94,;-5.79,-3.71,;-7.12,-2.94,;-4.45,-1.4,;-3.12,-.63,;-1.79,-1.4,;-1.79,-2.94,;-.45,-3.71,;.88,-2.94,)|

BDBM456692

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)c[n+]2[O-])nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-7.47,10.15,;-6.14,9.38,;-4.8,10.15,;-4.8,11.69,;-3.47,12.46,;-2.14,11.69,;-2.14,10.15,;-.8,9.38,;.53,10.15,;-3.47,9.38,;-3.47,7.84,;-2.22,6.93,;-.76,7.41,;.39,6.38,;-.38,5.04,;1.16,5.04,;1.72,7.15,;1.72,8.69,;3.05,6.38,;3.05,4.84,;4.39,7.15,;4.39,8.69,;5.72,9.46,;7.05,8.69,;8.39,9.46,;7.05,7.15,;5.72,6.38,;5.72,4.84,;-2.7,5.47,;-4.24,5.47,;-4.72,6.93,;-6.18,7.41,;-6.66,8.87,;-8.2,8.87,;-8.67,7.41,;-10.14,6.93,;-7.43,6.5,)|

BDBM456693

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.6,1.5,;-5.26,.73,;-3.93,1.5,;-3.93,3.04,;-2.6,3.81,;-1.26,3.04,;-1.26,1.5,;.07,.73,;1.41,1.5,;-2.6,.73,;-2.6,-.81,;-1.35,-1.72,;.12,-1.24,;1.26,-2.27,;.49,-3.6,;2.03,-3.6,;2.59,-1.5,;2.59,.04,;3.93,-2.27,;3.93,-3.81,;5.26,-1.5,;5.26,.04,;6.59,.81,;7.93,.04,;9.26,.81,;7.93,-1.5,;6.59,-2.27,;-1.83,-3.18,;-3.37,-3.18,;-3.84,-1.72,;-5.31,-1.24,;-5.78,.23,;-7.32,.23,;-7.8,-1.24,;-9.26,-1.72,;-6.55,-2.14,)|

BDBM456694

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wD:3.3,2.1,(1.37,3.49,;.47,4.74,;-1.06,4.58,;-1.97,5.82,;-3.5,5.66,;-1.34,7.23,;-2.75,7.86,;.07,6.6,;-.71,8.64,;-1.62,9.88,;-3.16,9.88,;-3.64,11.35,;-2.39,12.25,;-2.39,13.79,;-3.64,14.7,;-3.16,16.16,;-1.62,16.16,;-.71,17.41,;-1.14,14.7,;-1.14,11.35,;.32,11.82,;1.46,10.79,;1.14,9.29,;2.29,8.26,;2.93,11.27,;3.25,12.78,;2.11,13.81,;.64,13.33,;-.5,14.36,;-.18,15.87,;-1.69,3.17,;-3.22,3.01,;-3.85,1.6,;-2.94,.36,;-1.41,.52,;-.78,1.93,;.75,2.09,;2.28,2.25,;-3.57,-1.05,;-4.19,-2.46,)|

BDBM456695

COC[C@@H]1CCCC(=O)N1C[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:3.2,wD:11.12,(4.7,-9.56,;6.04,-10.33,;7.37,-9.56,;7.37,-8.02,;8.71,-7.25,;8.71,-5.71,;7.37,-4.94,;6.04,-5.71,;4.7,-4.94,;6.04,-7.25,;4.7,-8.02,;3.37,-7.25,;3.37,-5.71,;2.04,-8.02,;1.27,-9.35,;2.81,-9.35,;.89,-6.99,;-.57,-7.47,;-1.05,-8.93,;-2.59,-8.93,;-3.06,-7.47,;-4.53,-6.99,;-5,-5.53,;-6.54,-5.53,;-7.02,-6.99,;-8.48,-7.47,;-5.77,-7.89,;-1.82,-6.56,;-1.82,-5.02,;-3.15,-4.25,;-4.49,-5.02,;-5.82,-4.25,;-3.15,-2.71,;-1.82,-1.94,;-.48,-2.71,;-.48,-4.25,;.85,-5.02,;2.18,-4.25,)|

BDBM456696

COC[C@@H]1CCCC(=O)N1C[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:3.2,wD:11.12,(3.84,-7.86,;5.18,-8.63,;6.51,-7.86,;6.51,-6.32,;7.84,-5.55,;7.84,-4.01,;6.51,-3.24,;5.18,-4.01,;3.84,-3.24,;5.18,-5.55,;3.84,-6.32,;2.51,-5.55,;2.51,-4.01,;1.17,-6.32,;.4,-7.66,;1.94,-7.66,;.03,-5.29,;-1.43,-5.77,;-1.91,-7.23,;-3.45,-7.23,;-3.93,-5.77,;-5.39,-5.29,;-5.87,-3.83,;-7.41,-3.83,;-7.88,-5.29,;-9.35,-5.77,;-6.64,-6.2,;-2.68,-4.86,;-2.68,-3.32,;-4.01,-2.55,;-5.35,-3.32,;-6.68,-2.55,;-4.01,-1.01,;-2.68,-.24,;-1.35,-1.01,;-1.35,-2.55,;-.01,-3.32,;1.32,-2.55,)|

BDBM456697

COc1cnc(cn1)[C@@H](O)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(8.45,5.35,;7.12,6.12,;5.78,5.35,;5.78,3.81,;4.45,3.04,;3.12,3.81,;3.12,5.35,;4.45,6.12,;1.78,3.04,;1.78,1.5,;.45,3.81,;.45,5.35,;-.89,3.04,;-1.66,1.7,;-.12,1.7,;-2.03,4.07,;-3.49,3.59,;-3.97,2.13,;-5.51,2.13,;-5.99,3.59,;-7.45,4.07,;-7.93,5.53,;-9.47,5.53,;-9.94,4.07,;-11.41,3.59,;-8.7,3.16,;-4.74,4.5,;-4.74,6.04,;-6.07,6.81,;-7.41,6.04,;-8.74,6.81,;-6.07,8.35,;-4.74,9.12,;-3.41,8.35,;-3.41,6.81,;-2.07,6.04,;-.74,6.81,)|

BDBM456698

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-6.37,-3.66,;-5.04,-4.43,;-3.7,-3.66,;-3.7,-2.12,;-2.37,-1.35,;-1.04,-2.12,;-1.04,-3.66,;.3,-4.43,;1.63,-3.66,;-2.37,-4.43,;-2.37,-5.97,;-1.12,-6.87,;.34,-6.4,;1.49,-7.43,;.72,-8.76,;2.26,-8.76,;2.82,-6.66,;2.82,-5.12,;4.15,-7.43,;4.15,-8.97,;5.49,-6.66,;5.49,-5.12,;6.82,-4.35,;8.15,-5.12,;9.49,-4.35,;8.15,-6.66,;6.82,-7.43,;6.82,-8.97,;8.31,-9.37,;7.59,-10.3,;5.73,-10.06,;-1.6,-8.34,;-3.14,-8.34,;-3.61,-6.87,;-5.08,-6.4,;-5.56,-4.93,;-7.1,-4.93,;-7.57,-6.4,;-9.04,-6.87,;-6.33,-7.3,)|

BDBM456699

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](CN(C2)c2ncc(F)cn2)C(=O)N2CCC2)nnc1-c1ccc(C)o1 |r,wU:18.31,wD:16.16,(-8.3,7.54,;-6.97,6.77,;-5.63,7.54,;-5.63,9.08,;-4.3,9.85,;-2.96,9.08,;-2.96,7.54,;-1.63,6.77,;-.3,7.54,;-4.3,6.77,;-4.3,5.23,;-3.05,4.32,;-1.59,4.8,;-.44,3.77,;-1.21,2.43,;.33,2.43,;.89,4.54,;.89,6.08,;2.22,6.85,;3.56,6.08,;3.56,4.54,;2.22,3.77,;4.89,3.77,;4.89,2.23,;6.22,1.46,;7.56,2.23,;8.89,1.46,;7.56,3.77,;6.22,4.54,;2.22,8.39,;.89,9.15,;3.56,9.15,;5.04,8.76,;5.44,10.24,;3.95,10.64,;-3.53,2.86,;-5.07,2.86,;-5.54,4.32,;-7.01,4.8,;-7.48,6.26,;-9.02,6.26,;-9.5,4.8,;-10.96,4.32,;-8.25,3.89,)|

BDBM456700

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@H](CN(C2)c2ncc(F)cn2)C(=O)N2CCC2)nnc1-c1ccc(C)o1 |r,wU:16.16,18.31,(-8.35,7.83,;-7.02,7.06,;-5.68,7.83,;-5.68,9.37,;-4.35,10.14,;-3.02,9.37,;-3.02,7.83,;-1.68,7.06,;-.35,7.83,;-4.35,7.06,;-4.35,5.52,;-3.1,4.62,;-1.64,5.09,;-.49,4.06,;-1.26,2.73,;.28,2.73,;.84,4.83,;.84,6.37,;2.17,7.14,;3.51,6.37,;3.51,4.83,;2.17,4.06,;4.84,4.06,;4.84,2.53,;6.17,1.76,;7.5,2.53,;8.84,1.76,;7.5,4.06,;6.17,4.83,;2.17,8.68,;.84,9.45,;3.51,9.45,;4.99,9.05,;5.39,10.54,;3.9,10.94,;-3.58,3.15,;-5.12,3.15,;-5.6,4.62,;-7.06,5.09,;-7.54,6.56,;-9.08,6.56,;-9.55,5.09,;-11.02,4.62,;-8.31,4.19,)|

BDBM456701

CCOC(=O)[C@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wD:7.19,5.4,(6.95,-1.99,;5.61,-2.76,;4.28,-1.99,;2.95,-2.76,;1.62,-1.99,;2.95,-4.3,;1.62,-5.07,;1.62,-6.61,;2.95,-7.38,;4.28,-6.61,;4.28,-5.07,;5.62,-7.38,;5.62,-8.92,;6.95,-9.69,;8.28,-8.92,;9.61,-9.69,;8.28,-7.38,;6.95,-6.61,;.28,-7.38,;-.49,-8.71,;1.05,-8.71,;-.86,-6.35,;-2.33,-6.82,;-2.8,-8.29,;-4.34,-8.29,;-4.82,-6.82,;-6.28,-6.35,;-6.76,-4.88,;-8.3,-4.88,;-8.78,-6.35,;-7.53,-7.25,;-3.57,-5.92,;-3.57,-4.38,;-4.91,-3.61,;-6.24,-4.38,;-7.57,-3.61,;-4.91,-2.07,;-3.57,-1.3,;-2.24,-2.07,;-2.24,-3.61,;-.91,-4.38,;.43,-3.61,)|

BDBM456702

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.2,-4.61,;-4.87,-5.38,;-3.53,-4.61,;-3.53,-3.07,;-2.2,-2.3,;-.86,-3.07,;-.86,-4.61,;.47,-5.38,;1.8,-4.61,;-2.2,-5.38,;-2.2,-6.92,;-.95,-7.82,;.51,-7.35,;1.66,-8.38,;.89,-9.71,;2.43,-9.71,;2.99,-7.61,;2.99,-6.07,;4.32,-8.38,;4.32,-9.92,;5.66,-7.61,;5.66,-6.07,;6.99,-5.3,;8.33,-6.07,;9.66,-5.3,;8.33,-7.61,;6.99,-8.38,;6.99,-9.92,;8.48,-10.32,;7.39,-11.41,;5.9,-11.01,;-1.43,-9.29,;-2.97,-9.29,;-3.44,-7.82,;-4.91,-7.35,;-5.38,-5.88,;-6.92,-5.88,;-7.4,-7.35,;-8.86,-7.82,;-6.15,-8.25,)|

BDBM456703

CCOC(=O)[C@@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wU:5.4,wD:7.19,(6.96,-4.5,;5.63,-5.27,;4.3,-4.5,;2.96,-5.27,;1.63,-4.5,;2.96,-6.8,;1.63,-7.57,;1.63,-9.11,;2.96,-9.88,;4.3,-9.11,;4.3,-7.57,;5.63,-9.88,;5.63,-11.42,;6.96,-12.19,;8.29,-11.42,;9.63,-12.19,;8.29,-9.88,;6.96,-9.11,;.3,-9.88,;-.47,-11.22,;1.07,-11.22,;-.85,-8.85,;-2.31,-9.33,;-2.79,-10.79,;-4.33,-10.79,;-4.81,-9.33,;-6.27,-8.85,;-6.75,-7.39,;-8.29,-7.39,;-8.76,-8.85,;-7.52,-9.76,;-3.56,-8.42,;-3.56,-6.88,;-4.89,-6.11,;-6.23,-6.88,;-7.56,-6.11,;-4.89,-4.57,;-3.56,-3.8,;-2.23,-4.57,;-2.23,-6.11,;-.89,-6.88,;.44,-6.11,)|

BDBM456704

COC[C@H]1CCCC(=O)N1C[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:3.2,11.12,(4.87,-19.35,;6.2,-20.12,;7.53,-19.35,;7.53,-17.81,;8.87,-17.04,;8.87,-15.5,;7.53,-14.73,;6.2,-15.5,;4.87,-14.73,;6.2,-17.04,;4.86,-17.81,;3.53,-17.04,;3.53,-15.5,;2.2,-17.81,;1.43,-19.14,;2.97,-19.14,;1.05,-16.78,;-.41,-17.25,;-.89,-18.72,;-2.43,-18.72,;-2.9,-17.25,;-4.37,-16.78,;-4.84,-15.31,;-6.38,-15.31,;-6.86,-16.78,;-8.32,-17.25,;-5.61,-17.68,;-1.66,-16.35,;-1.66,-14.81,;-2.99,-14.04,;-4.33,-14.81,;-5.66,-14.04,;-2.99,-12.5,;-1.66,-11.73,;-.32,-12.5,;-.32,-14.04,;1.01,-14.81,;2.34,-14.04,)|

BDBM456705

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)nnc1-c1ccc(C)o1 |(-6.97,1.4,;-5.63,.63,;-4.3,1.4,;-4.3,2.94,;-2.97,3.71,;-1.63,2.94,;-1.63,1.4,;-.3,.63,;1.03,1.4,;-2.97,.63,;-2.97,-.91,;-1.72,-1.81,;-.26,-1.34,;.89,-2.37,;.12,-3.7,;1.66,-3.7,;2.22,-1.6,;3.56,-2.37,;4.89,-1.6,;6.3,-2.22,;6.69,-3.71,;7.33,-1.08,;8.86,-1.08,;9.63,.25,;8.86,1.58,;7.33,1.58,;6.56,.25,;5.05,-.07,;3.91,.96,;-2.2,-3.28,;-3.74,-3.28,;-4.21,-1.81,;-5.68,-1.34,;-6.15,.13,;-7.69,.13,;-8.17,-1.34,;-9.63,-1.81,;-6.92,-2.24,)|

BDBM456706

COc1cc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:15.16,17.18,(.94,6.59,;-.39,5.82,;-1.73,6.59,;-1.73,8.13,;-3.06,8.9,;-4.39,8.13,;-4.39,6.59,;-5.73,5.82,;-3.06,5.82,;-3.06,4.03,;-1.81,3.12,;-.35,3.6,;.8,2.57,;-.29,1.48,;1.19,1.08,;2.13,3.34,;2.13,4.88,;3.46,2.57,;3.46,1.03,;4.8,3.34,;4.8,4.88,;6.13,5.65,;7.46,4.88,;8.8,5.65,;7.46,3.34,;6.13,2.57,;-2.29,1.66,;-3.83,1.66,;-4.3,3.12,;-5.77,3.6,;-6.25,5.06,;-7.79,5.06,;-8.26,3.6,;-9.73,3.12,;-7.02,2.69,)|

BDBM456707

CCOC(=O)[C@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wD:7.19,5.4,(6.96,-1.53,;5.62,-2.3,;4.29,-1.53,;2.96,-2.3,;1.62,-1.53,;2.96,-3.84,;1.62,-4.61,;1.62,-6.15,;2.96,-6.92,;4.29,-6.15,;4.29,-4.61,;5.62,-6.92,;5.62,-8.46,;6.96,-9.23,;8.29,-8.46,;9.63,-9.23,;8.29,-6.92,;6.96,-6.15,;.29,-6.92,;-.48,-8.25,;1.06,-8.25,;-.85,-5.89,;-2.32,-6.37,;-2.8,-7.83,;-4.34,-7.83,;-4.81,-6.37,;-6.28,-5.89,;-6.75,-4.43,;-8.29,-4.43,;-8.77,-5.89,;-7.52,-6.8,;-3.57,-5.46,;-3.57,-3.81,;-4.9,-3.04,;-6.23,-3.81,;-7.57,-3.04,;-4.9,-1.5,;-3.57,-.73,;-2.23,-1.5,;-2.23,-3.04,;-.9,-3.81,;.44,-3.04,)|

BDBM456708

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@H](C)CCN(C)C2=O)nnc1-c1ccco1 |r,wU:19.20,(-7.28,6.43,;-5.95,5.66,;-4.62,6.43,;-4.62,7.97,;-3.28,8.74,;-1.95,7.97,;-1.95,6.43,;-.62,5.66,;.72,6.43,;-3.28,5.66,;-3.28,3.86,;-2.04,2.96,;-.57,3.43,;.57,2.4,;-.2,1.07,;1.34,1.07,;1.91,3.17,;3.24,2.4,;4.57,3.17,;5.91,2.4,;5.91,.86,;7.24,3.17,;7.24,4.71,;5.91,5.48,;5.91,7.02,;4.57,4.71,;3.24,5.48,;-2.51,1.49,;-4.05,1.49,;-4.53,2.96,;-5.99,3.43,;-6.47,4.9,;-8.01,4.9,;-8.49,3.43,;-7.24,2.53,)|

BDBM456709

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@H](C)CCN(C)C2=O)nnc1-c1ccc(C)o1 |r,wU:19.20,(-6.42,6.43,;-5.09,5.66,;-3.76,6.43,;-3.76,7.97,;-2.42,8.74,;-1.09,7.97,;-1.09,6.43,;.24,5.66,;1.58,6.43,;-2.42,5.66,;-2.42,3.86,;-1.18,2.96,;.29,3.43,;1.43,2.4,;.66,1.07,;2.2,1.07,;2.77,3.17,;4.1,2.4,;5.43,3.17,;6.77,2.4,;6.77,.86,;8.1,3.17,;8.1,4.71,;6.77,5.48,;6.77,7.02,;5.43,4.71,;4.1,5.48,;-1.65,1.49,;-3.19,1.49,;-3.67,2.96,;-5.13,3.43,;-5.61,4.9,;-7.15,4.9,;-7.63,3.43,;-9.09,2.96,;-6.38,2.53,)|

BDBM456710

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](CN(C2)C(C)=O)c2ccc(F)cc2)nnc1-c1ccc(C)o1 |wU:18.26,wD:16.16,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;;.77,1.33,;-.77,-1.33,;-1.33,.77,;-2.67,,;-4,.77,;-4,2.31,;-2.67,3.08,;-1.33,2.31,;-2.67,4.62,;-4,5.39,;-1.33,5.39,;-5.33,,;-5.33,-1.54,;-6.67,-2.31,;-8,-1.54,;-9.34,-2.31,;-8,,;-6.67,.77,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;4.55,-5.93,;5.02,-7.39,;3.78,-8.3,;3.78,-9.84,;2.53,-7.39,)|

BDBM456711

COc1cc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:15.16,17.18,(.83,6.61,;-.51,5.84,;-1.84,6.61,;-1.84,8.15,;-3.17,8.92,;-4.51,8.15,;-4.51,6.61,;-5.84,5.84,;-3.17,5.84,;-3.17,4.3,;-1.93,3.4,;-.46,3.87,;.63,2.78,;-.46,1.69,;1.02,1.3,;1.96,3.55,;1.96,5.09,;3.29,2.78,;3.29,1.24,;4.63,3.55,;5.96,2.78,;7.29,3.55,;7.29,5.09,;8.63,5.86,;5.96,5.86,;4.63,5.09,;-2.4,1.93,;-3.94,1.93,;-4.42,3.4,;-5.88,3.87,;-6.36,5.34,;-7.9,5.34,;-8.38,3.87,;-9.84,3.4,;-7.13,2.97,)|

BDBM456713

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2C(=O)[C@H](C)C[C@]2(C)C#N)nnc1-c1ccco1 |r,wU:24.26,wD:21.22,24.27,(-6.7,-3.87,;-5.36,-4.64,;-4.03,-3.87,;-4.03,-2.33,;-2.7,-1.56,;-1.36,-2.33,;-1.36,-3.87,;-.03,-4.64,;1.31,-3.87,;-2.7,-4.64,;-2.7,-6.18,;-1.45,-7.09,;.02,-6.61,;1.1,-7.7,;.33,-9.03,;1.87,-9.03,;2.44,-6.93,;3.77,-7.7,;5.11,-6.93,;5.27,-5.4,;4.12,-4.37,;6.77,-5.08,;7.4,-3.67,;7.54,-6.41,;6.51,-7.56,;7.6,-8.64,;5.42,-8.64,;4.33,-9.73,;-1.93,-8.55,;-3.47,-8.55,;-3.94,-7.09,;-5.41,-6.61,;-5.88,-5.15,;-7.42,-5.15,;-7.9,-6.61,;-6.65,-7.52,)|

BDBM456714

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@@H](C)CCCC2=O)nnc1-c1ccco1 |r,wU:19.20,(.65,6.67,;-.68,5.9,;-2.01,6.67,;-2.01,8.21,;-3.35,8.98,;-4.68,8.21,;-4.68,6.67,;-6.01,5.9,;-7.35,6.67,;-3.35,5.9,;-3.35,4.36,;-2.1,3.46,;-.64,3.93,;.45,2.84,;-.37,1.42,;1.27,1.42,;1.79,3.61,;3.12,2.84,;4.45,3.61,;4.45,5.15,;3.12,5.92,;5.79,5.92,;7.12,5.15,;7.12,3.61,;5.79,2.84,;5.79,1.3,;-2.58,1.99,;-4.12,1.99,;-4.59,3.46,;-6.06,3.93,;-6.53,5.4,;-8.07,5.4,;-8.55,3.93,;-7.3,3.03,)|

BDBM456715

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@@H](CN(C2)C(C)=O)c2ccc(F)cc2)nnc1-c1ccc(C)o1 |r,wU:16.16,18.26,(.07,7.82,;-1.27,7.05,;-2.6,7.82,;-2.6,9.36,;-3.94,10.13,;-5.27,9.36,;-5.27,7.82,;-6.6,7.05,;-7.94,7.82,;-3.94,7.05,;-3.94,5.51,;-2.69,4.6,;-1.23,5.08,;-.14,3.99,;-.96,2.57,;.68,2.57,;1.2,4.76,;2.53,3.99,;3.86,4.76,;3.86,6.3,;2.53,7.07,;1.2,6.3,;2.53,8.61,;3.86,9.38,;1.2,9.38,;5.2,3.99,;5.2,2.45,;6.53,1.68,;7.87,2.45,;9.2,1.68,;7.87,3.99,;6.53,4.76,;-3.17,3.14,;-4.71,3.14,;-5.18,4.6,;-6.65,5.08,;-7.12,6.54,;-8.66,6.54,;-9.14,5.08,;-10.6,4.6,;-7.89,4.17,)|

BDBM456716

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](CN(C2)C(C)=O)c2ccc(F)cc2)nnc1-c1ccc(C)o1 |r,wU:16.16,wD:18.26,(.07,7.82,;-1.27,7.05,;-2.6,7.82,;-2.6,9.36,;-3.94,10.13,;-5.27,9.36,;-5.27,7.82,;-6.6,7.05,;-7.94,7.82,;-3.94,7.05,;-3.94,5.51,;-2.69,4.6,;-1.23,5.08,;-.14,3.99,;-.96,2.57,;.68,2.57,;1.2,4.76,;2.53,3.99,;3.86,4.76,;3.86,6.3,;2.53,7.07,;1.2,6.3,;2.53,8.61,;3.86,9.38,;1.2,9.38,;5.2,3.99,;5.2,2.45,;6.53,1.68,;7.87,2.45,;9.2,1.68,;7.87,3.99,;6.53,4.76,;-3.17,3.14,;-4.71,3.14,;-5.18,4.6,;-6.65,5.08,;-7.12,6.54,;-8.66,6.54,;-9.14,5.08,;-10.6,4.6,;-7.89,4.17,)|

BDBM456717

COc1ccccc1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,14.15,(-6.57,1.53,;-5.23,.76,;-3.9,1.53,;-3.9,3.07,;-2.57,3.84,;-1.23,3.07,;-1.23,1.53,;-2.57,.76,;-2.57,-.78,;-1.32,-1.69,;.14,-1.21,;1.23,-2.3,;.41,-3.72,;2.05,-3.72,;2.57,-1.53,;2.57,.01,;3.9,-2.3,;3.9,-3.84,;5.23,-1.53,;6.57,-2.3,;7.9,-1.53,;7.9,.01,;9.23,.78,;6.57,.78,;5.23,.01,;-1.8,-3.15,;-3.34,-3.15,;-3.81,-1.69,;-5.28,-1.21,;-5.75,.25,;-7.29,.25,;-7.77,-1.21,;-9.23,-1.69,;-6.52,-2.11,)|

BDBM456718

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CC[C@@H]3CCCC(=O)N3C2)nnc1-c1ccc(C)o1 |r,wU:16.16,wD:19.26,(1.74,-2.96,;.41,-3.73,;-.93,-2.96,;-.93,-1.42,;-2.26,-.65,;-3.59,-1.42,;-3.59,-2.96,;-4.93,-3.73,;-6.26,-2.96,;-2.26,-3.73,;-2.26,-5.27,;-1.01,-6.18,;.45,-5.7,;1.54,-6.79,;.72,-8.22,;2.36,-8.22,;2.87,-6.02,;2.87,-4.48,;4.21,-3.71,;5.54,-4.48,;6.87,-3.71,;8.21,-4.48,;8.21,-6.02,;6.87,-6.79,;6.87,-8.33,;5.54,-6.02,;4.21,-6.79,;-1.49,-7.64,;-3.03,-7.64,;-3.51,-6.18,;-4.97,-5.7,;-5.45,-4.24,;-6.99,-4.24,;-7.46,-5.7,;-8.93,-6.18,;-6.22,-6.61,)|

BDBM456719

CCOC(=O)N1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:7.19,(7.4,-1.8,;6.07,-2.57,;4.73,-1.8,;3.4,-2.57,;2.07,-1.8,;3.4,-4.11,;2.07,-4.88,;2.07,-6.42,;3.4,-7.19,;4.73,-6.42,;4.73,-4.88,;6.07,-7.19,;6.07,-8.73,;7.4,-9.5,;8.73,-8.73,;10.07,-9.5,;8.73,-7.19,;7.4,-6.42,;.73,-7.19,;-.09,-8.61,;1.55,-8.61,;-.36,-6.1,;-1.82,-6.57,;-2.3,-8.04,;-3.84,-8.04,;-4.31,-6.57,;-5.78,-6.1,;-6.25,-4.63,;-7.79,-4.63,;-8.27,-6.1,;-9.73,-6.57,;-7.02,-7,;-3.07,-5.67,;-3.07,-4.13,;-1.73,-3.36,;-.4,-4.13,;.93,-3.36,;-1.73,-1.82,;-3.07,-1.05,;-4.4,-1.82,;-4.4,-3.36,;-5.73,-4.13,;-7.07,-3.36,)|

BDBM456720

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@@H](C)C[C@@H](C)C2=O)nnc1-c1ccco1 |r,wD:19.20,22.23,(1.36,-3.46,;.03,-4.23,;-1.31,-3.46,;-1.31,-1.92,;-2.64,-1.15,;-3.98,-1.92,;-3.98,-3.46,;-5.31,-4.23,;-6.64,-3.46,;-2.64,-4.23,;-2.64,-5.77,;-1.4,-6.67,;.07,-6.2,;1.16,-7.28,;.34,-8.71,;1.98,-8.71,;2.49,-6.51,;3.83,-7.28,;5.16,-6.51,;6.57,-7.14,;6.89,-8.65,;7.6,-6,;6.83,-4.66,;7.45,-3.26,;5.32,-4.98,;4.18,-3.95,;-1.87,-8.14,;-3.41,-8.14,;-3.89,-6.67,;-5.35,-6.2,;-5.83,-4.73,;-7.37,-4.73,;-7.84,-6.2,;-6.6,-7.1,)|

BDBM456721

COC[C@@H]1CCCC(=O)N1CCS(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wU:3.2,(3.04,1.69,;4.38,.92,;5.71,1.69,;5.71,3.23,;7.04,4,;7.04,5.54,;5.71,6.31,;4.38,5.54,;3.04,6.31,;4.38,4,;3.04,3.23,;1.71,4,;.38,3.23,;-.45,1.8,;1.2,1.8,;-.67,4.4,;-2.14,3.93,;-2.62,2.46,;-4.16,2.46,;-4.63,3.93,;-6.1,4.4,;-6.57,5.87,;-8.11,5.87,;-8.59,4.4,;-7.34,3.5,;-3.39,4.83,;-3.39,6.37,;-2.05,7.14,;-.72,6.37,;.62,7.14,;-2.05,8.68,;-3.39,9.45,;-4.72,8.68,;-4.72,7.14,;-6.05,6.37,;-7.39,7.14,)|

BDBM456722

COc1cnc(cn1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(10.13,-4.51,;8.7,-3.69,;7.28,-4.51,;7.28,-6.15,;5.86,-6.97,;4.44,-6.15,;4.44,-4.51,;5.86,-3.69,;3.1,-6.92,;3.1,-8.56,;1.77,-6.15,;1.77,-4.51,;.44,-6.92,;-.39,-8.34,;1.26,-8.34,;-.65,-5.83,;-2.12,-6.31,;-2.59,-7.77,;-4.13,-7.77,;-4.61,-6.31,;-6.07,-5.83,;-6.55,-4.37,;-8.09,-4.37,;-8.57,-5.83,;-10.13,-6.34,;-7.32,-6.74,;-3.36,-5.4,;-3.36,-3.86,;-2.03,-3.09,;-.7,-3.86,;.64,-3.09,;-2.03,-1.55,;-3.36,-.78,;-4.7,-1.55,;-4.7,-3.09,;-6.03,-3.86,;-7.36,-3.09,)|

BDBM456723

CO[C@H]1C[C@H](CN(C1)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1c(OC)cccc1OC |r,wD:4.16,2.1,(4.3,-11.55,;2.96,-12.32,;2.96,-13.86,;1.63,-14.63,;1.63,-16.17,;2.96,-16.94,;4.3,-16.17,;4.3,-14.63,;5.63,-16.94,;5.63,-18.48,;6.96,-19.25,;8.3,-18.48,;9.63,-19.25,;8.3,-16.94,;6.96,-16.17,;.29,-16.94,;-.53,-18.36,;1.12,-18.36,;-1.08,-15.84,;-2.54,-16.32,;-3.02,-17.78,;-4.56,-17.78,;-5.04,-16.32,;-6.5,-15.84,;-6.98,-14.38,;-8.52,-14.38,;-8.99,-15.84,;-7.75,-16.75,;-3.79,-15.41,;-3.79,-13.87,;-2.46,-13.1,;-1.12,-13.87,;.21,-13.1,;-2.46,-11.56,;-3.79,-10.79,;-5.12,-11.56,;-5.12,-13.1,;-6.46,-13.87,;-7.79,-13.1,)|

BDBM456724

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.16,(.04,7.87,;-1.29,7.1,;-2.63,7.87,;-2.63,9.41,;-3.96,10.18,;-5.3,9.41,;-5.3,7.87,;-6.63,7.1,;-7.96,7.87,;-3.96,7.1,;-3.96,5.56,;-2.72,4.65,;-1.25,5.13,;-0,4.06,;-.82,2.64,;.82,2.64,;1.33,4.83,;1.33,6.37,;2.66,7.14,;4,6.37,;4,4.83,;2.66,4.06,;5.33,4.06,;5.33,2.52,;6.66,1.75,;8,2.52,;9.33,1.75,;8,4.06,;6.66,4.83,;-3.19,3.19,;-4.73,3.19,;-5.21,4.65,;-6.67,5.13,;-7.15,6.6,;-8.69,6.6,;-9.16,5.13,;-10.63,4.65,;-7.92,4.23,)|

BDBM456725

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2COC[C@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:20.22,wD:16.16,(-4.81,-4.88,;-3.48,-5.65,;-2.15,-4.88,;-2.15,-3.34,;-.81,-2.57,;.52,-3.34,;.52,-4.88,;1.85,-5.65,;3.19,-4.88,;-.81,-5.65,;-.81,-8.1,;.43,-9,;1.92,-8.6,;3.01,-9.69,;3.78,-11.03,;2.24,-11.03,;4.34,-8.92,;4.5,-7.39,;6.01,-7.07,;6.78,-8.4,;5.75,-9.55,;5.75,-11.09,;4.42,-11.86,;4.42,-13.4,;5.75,-14.17,;5.75,-15.71,;7.08,-13.4,;7.08,-11.86,;-.04,-10.47,;-1.58,-10.47,;-2.06,-9,;-3.55,-8.6,;-4.02,-7.14,;-5.56,-7.14,;-6.04,-8.6,;-4.79,-9.51,)|

BDBM456726

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2COc3cc(Cl)cnc3C2)nnc1-c1ccco1 |r,wD:16.16,(.36,-5.43,;-.97,-6.2,;-2.31,-5.43,;-2.31,-3.89,;-3.64,-3.12,;-4.97,-3.89,;-4.97,-5.43,;-6.31,-6.2,;-7.64,-5.43,;-3.64,-6.2,;-3.64,-8.66,;-2.39,-9.57,;-.91,-9.17,;.18,-10.26,;.95,-11.59,;-.59,-11.59,;1.52,-9.49,;1.52,-7.95,;2.85,-7.18,;4.18,-7.95,;5.52,-7.18,;6.85,-7.95,;8.18,-7.18,;6.85,-9.49,;5.52,-10.26,;4.18,-9.49,;2.85,-10.26,;-2.87,-11.03,;-4.41,-11.03,;-4.89,-9.57,;-6.22,-8.8,;-6.7,-7.33,;-8.24,-7.33,;-8.71,-8.8,;-7.47,-9.7,)|

BDBM456727

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1C1CCOCC1)c1ncc(C)cn1 |r|

BDBM456728

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2COC[C@@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:16.16,wD:20.22,(-6.08,12.58,;-4.75,11.81,;-3.42,12.58,;-3.42,14.12,;-2.08,14.89,;-.75,14.12,;-.75,12.58,;.59,11.81,;1.92,12.58,;-2.08,11.81,;-2.08,9.51,;-.84,8.6,;.65,9,;1.74,7.91,;2.51,6.58,;.97,6.58,;3.07,8.68,;3.24,10.21,;4.74,10.53,;5.51,9.2,;4.48,8.06,;4.48,6.52,;3.15,5.75,;3.15,4.21,;4.48,3.44,;4.48,1.9,;5.82,4.21,;5.82,5.75,;-1.31,7.14,;-2.85,7.14,;-3.33,8.6,;-4.82,9,;-5.29,10.47,;-6.83,10.47,;-7.31,9,;-6.06,8.1,)|

BDBM456729

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2COCC[C@@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:16.16,wD:21.23,(-5.48,-4.38,;-4.14,-5.15,;-2.81,-4.38,;-2.81,-2.84,;-1.48,-2.07,;-.14,-2.84,;-.14,-4.38,;1.19,-5.15,;2.53,-4.38,;-1.48,-5.15,;-1.48,-7.45,;-.23,-8.35,;1.26,-7.95,;2.35,-9.04,;3.12,-10.38,;1.58,-10.38,;3.68,-8.27,;3.68,-6.73,;5.01,-5.96,;6.35,-6.73,;6.35,-8.27,;5.01,-9.04,;5.01,-10.58,;3.68,-11.35,;3.68,-12.89,;5.01,-13.66,;5.01,-15.2,;6.35,-12.89,;6.35,-11.35,;-.71,-9.82,;-2.25,-9.82,;-2.72,-8.35,;-4.21,-7.95,;-4.68,-6.49,;-6.22,-6.49,;-6.7,-7.95,;-5.45,-8.86,)|

BDBM456730

COC[C@@H]1CCCC(=O)N1C[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wU:3.2,wD:11.12,(4.21,-10.8,;5.55,-11.57,;6.88,-10.8,;6.88,-9.26,;8.22,-8.49,;8.22,-6.95,;6.88,-6.18,;5.55,-6.95,;4.21,-6.18,;5.55,-8.49,;4.21,-9.26,;2.88,-8.49,;2.88,-6.95,;1.55,-9.26,;2.32,-10.6,;.78,-10.6,;.46,-8.17,;-1.03,-8.57,;-1.51,-10.04,;-3.05,-10.04,;-3.52,-8.57,;-5.01,-8.17,;-5.48,-6.71,;-7.02,-6.71,;-7.5,-8.17,;-8.99,-8.57,;-6.25,-9.08,;-2.28,-7.67,;-2.28,-5.37,;-3.61,-4.6,;-4.94,-5.37,;-6.28,-4.6,;-3.61,-3.06,;-2.28,-2.29,;-.94,-3.06,;-.94,-4.6,;.39,-5.37,;1.73,-4.6,)|

BDBM456731

COc1cc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:17.18,15.16,(-6.29,-4.33,;-4.96,-5.1,;-3.62,-4.33,;-3.62,-2.79,;-2.29,-2.02,;-.96,-2.79,;-.96,-4.33,;.38,-5.1,;-2.29,-5.1,;-2.29,-6.64,;-1.04,-7.55,;.42,-7.07,;1.51,-8.16,;.42,-9.25,;1.91,-9.65,;2.84,-7.39,;2.84,-5.85,;4.18,-8.16,;4.18,-9.7,;5.51,-7.39,;6.85,-8.16,;8.18,-7.39,;8.18,-5.85,;9.51,-5.08,;6.85,-5.08,;5.51,-5.85,;-1.52,-9.01,;-3.06,-9.01,;-3.53,-7.55,;-5,-7.07,;-5.48,-5.61,;-7.02,-5.61,;-7.49,-7.07,;-8.96,-7.55,;-6.25,-7.98,)|

BDBM456732

COc1cc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:15.16,17.18,(-6.32,-3.43,;-4.84,-3.83,;-3.5,-3.06,;-3.5,-1.52,;-2.17,-.75,;-.84,-1.52,;-.84,-3.06,;.5,-3.83,;-2.17,-3.83,;-2.17,-5.71,;-.92,-6.62,;.54,-6.14,;1.69,-7.17,;.6,-8.26,;2.08,-8.66,;3.02,-6.4,;3.02,-4.86,;4.35,-7.17,;4.35,-8.71,;5.69,-6.4,;7.02,-7.17,;8.35,-6.4,;8.35,-4.86,;9.69,-4.09,;7.02,-4.09,;5.69,-4.86,;-1.4,-8.08,;-2.94,-8.08,;-3.42,-6.62,;-4.88,-6.14,;-5.36,-4.67,;-6.9,-4.67,;-7.37,-6.14,;-8.84,-6.62,;-6.13,-7.04,)|

BDBM456733

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CNC[C@H](C2)c2ccc(F)cc2)nnc1-c1ccco1 |r,wU:20.23,wD:16.16,(-7.53,-2.94,;-6.19,-3.71,;-4.86,-2.94,;-4.86,-1.4,;-3.53,-.63,;-2.19,-1.4,;-2.19,-2.94,;-.86,-3.71,;.48,-2.94,;-3.53,-3.71,;-3.53,-5.36,;-2.28,-6.27,;-.81,-5.79,;.33,-6.82,;-.44,-8.16,;1.1,-8.16,;1.66,-6.05,;1.66,-4.51,;3,-3.74,;4.33,-4.51,;4.33,-6.05,;3,-6.82,;5.66,-6.82,;5.66,-8.36,;7,-9.13,;8.33,-8.36,;9.67,-9.13,;8.33,-6.82,;7,-6.05,;-2.76,-7.73,;-4.3,-7.73,;-4.77,-6.27,;-6.24,-5.79,;-6.71,-4.33,;-8.25,-4.33,;-8.73,-5.79,;-7.48,-6.7,)|

BDBM456734

COc1c(Br)cc(Br)c(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:20.21,18.19,(1.43,1.53,;.1,.76,;-1.23,1.53,;-1.23,3.07,;.1,3.84,;-2.57,3.84,;-3.9,3.07,;-5.23,3.84,;-3.9,1.53,;-5.23,.76,;-6.57,1.53,;-2.57,.76,;-2.57,-.78,;-1.32,-1.69,;.14,-1.21,;1.23,-2.3,;.14,-3.39,;1.63,-3.79,;2.57,-1.53,;2.57,.01,;3.9,-2.3,;3.9,-3.84,;5.23,-1.53,;6.57,-2.3,;7.9,-1.53,;7.9,.01,;9.23,.78,;6.57,.78,;5.23,.01,;-1.8,-3.15,;-3.34,-3.15,;-3.81,-1.69,;-5.28,-1.21,;-5.75,.25,;-7.29,.25,;-7.77,-1.21,;-9.23,-1.69,;-6.52,-2.12,)|

BDBM456735

COc1cccc(OC)c1-n1c(NS(=O)(=O)C2C[C@H]2c2ccc(Cl)cc2)nnc1-c1ccco1 |r,wU:18.20,(-.32,-4.54,;-1.65,-5.31,;-2.99,-4.54,;-2.99,-3,;-4.32,-2.23,;-5.65,-3,;-5.65,-4.54,;-6.99,-5.31,;-8.32,-4.54,;-4.32,-5.31,;-4.32,-6.85,;-3.07,-7.75,;-1.61,-7.27,;-.52,-8.36,;-1.29,-9.7,;.25,-9.7,;.81,-7.59,;2.15,-6.82,;2.15,-8.36,;3.63,-7.97,;4.97,-8.74,;6.3,-7.97,;6.3,-6.43,;7.64,-5.66,;4.97,-5.66,;3.63,-6.43,;-3.55,-9.22,;-5.09,-9.22,;-5.57,-7.75,;-7.03,-7.27,;-7.51,-5.81,;-9.05,-5.81,;-9.52,-7.27,;-8.28,-8.18,)|

BDBM456737

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@H](C)CCN(C)C2=O)nnc1-c1ccc(C)o1 |r,wU:19.20,(-5.4,-5.41,;-4.07,-6.18,;-2.73,-5.41,;-2.73,-3.87,;-1.4,-3.1,;-.07,-3.87,;-.07,-5.41,;1.27,-6.18,;2.6,-5.41,;-1.4,-6.18,;-1.4,-7.72,;-.15,-8.63,;1.31,-8.15,;2.46,-9.18,;3.23,-10.52,;1.69,-10.52,;3.79,-8.41,;5.12,-9.18,;6.46,-8.41,;7.79,-9.18,;7.79,-10.72,;9.12,-8.41,;9.12,-6.87,;7.79,-6.1,;7.79,-4.56,;6.46,-6.87,;5.12,-6.1,;-.63,-10.09,;-2.17,-10.09,;-2.64,-8.63,;-4.11,-8.15,;-4.59,-6.69,;-6.13,-6.69,;-6.6,-8.15,;-8.07,-8.63,;-5.36,-9.06,)|

BDBM456738

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ccc(Cl)cc2)nnc1-c1ccco1 |r,wD:16.17,(-6.94,-5.99,;-5.46,-6.39,;-4.12,-5.62,;-4.12,-4.08,;-2.79,-3.31,;-1.46,-4.08,;-1.46,-5.62,;-.12,-6.39,;1.21,-5.62,;-2.79,-6.39,;-2.79,-7.93,;-1.54,-8.83,;-.08,-8.36,;1.07,-9.39,;1.84,-10.72,;.3,-10.72,;2.4,-8.62,;2.4,-7.08,;3.73,-9.39,;5.07,-8.62,;6.4,-9.39,;7.73,-8.62,;7.73,-7.08,;9.07,-6.31,;6.4,-6.31,;5.07,-7.08,;-2.02,-10.3,;-3.56,-10.3,;-4.04,-8.83,;-5.5,-8.36,;-5.98,-6.89,;-7.52,-6.89,;-7.99,-8.36,;-6.75,-9.26,)|

BDBM456739

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccco1 |r,wD:16.16,(-7.57,-4.41,;-6.24,-5.18,;-4.9,-4.41,;-4.9,-2.87,;-3.57,-2.1,;-2.23,-2.87,;-2.23,-4.41,;-.9,-5.18,;.43,-4.41,;-3.57,-5.18,;-3.57,-6.72,;-2.32,-7.63,;-.86,-7.15,;.29,-8.18,;1.06,-9.51,;-.48,-9.51,;1.62,-7.41,;1.62,-5.87,;2.95,-5.1,;4.29,-5.87,;4.29,-7.41,;2.95,-8.18,;5.62,-8.18,;5.62,-9.72,;6.95,-10.49,;8.29,-9.72,;9.62,-10.49,;8.29,-8.18,;6.95,-7.41,;-2.8,-9.09,;-4.34,-9.09,;-4.81,-7.63,;-6.28,-7.15,;-6.76,-5.69,;-8.29,-5.69,;-8.77,-7.15,;-7.52,-8.06,)|

BDBM456740

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2Br)nnc1-c1ccco1 |(.67,1.4,;-.66,.63,;-1.99,1.4,;-1.99,2.94,;-3.33,3.71,;-4.66,2.94,;-4.66,1.4,;-5.99,.63,;-7.33,1.4,;-3.33,.63,;-3.33,-.91,;-2.08,-1.82,;-.62,-1.34,;.53,-2.37,;-.24,-3.71,;1.3,-3.71,;1.86,-1.6,;3.19,-2.37,;4.53,-1.6,;5.86,-2.37,;7.2,-1.6,;7.2,-.06,;8.53,.71,;5.86,.71,;4.53,-.06,;3.19,.71,;-2.56,-3.28,;-4.1,-3.28,;-4.57,-1.82,;-6.04,-1.34,;-6.51,.12,;-8.05,.12,;-8.53,-1.34,;-7.28,-2.25,)|

BDBM456741

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.15,-.2,;-4.66,-.6,;-3.57,.49,;-3.97,1.98,;-2.88,3.07,;-1.39,2.67,;-1,1.18,;.49,.78,;1.58,1.87,;-2.08,.09,;-1.57,-1.78,;-.16,-2.41,;1.17,-1.64,;2.51,-2.41,;3.84,-3.18,;1.74,-3.74,;3.28,-1.07,;2.51,.26,;4.82,-1.07,;5.59,-2.41,;5.59,.26,;7.13,.26,;7.9,1.59,;7.13,2.93,;7.9,4.26,;5.59,2.93,;4.82,1.59,;-.32,-3.94,;-1.83,-4.26,;-2.6,-2.93,;-4.13,-2.77,;-4.9,-1.43,;-6.4,-1.75,;-6.56,-3.28,;-7.9,-4.05,;-5.16,-3.91,)|

BDBM456742

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.15,5.2,;-4.66,4.8,;-3.57,5.89,;-3.97,7.38,;-2.88,8.47,;-1.39,8.07,;-1,6.58,;.49,6.18,;1.58,7.27,;-2.08,5.49,;-1.57,3.62,;-.16,2.99,;1.17,3.76,;2.51,2.99,;3.84,2.22,;1.74,1.66,;3.28,4.33,;2.51,5.66,;4.82,4.33,;5.59,2.99,;5.59,5.66,;7.13,5.66,;7.9,6.99,;7.13,8.33,;7.9,9.66,;5.59,8.33,;4.82,6.99,;-.32,1.46,;-1.83,1.14,;-2.6,2.48,;-4.13,2.64,;-4.9,3.97,;-6.4,3.65,;-6.56,2.12,;-7.9,1.35,;-5.16,1.49,)|

BDBM456743

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cnc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.15,5.08,;-4.66,4.68,;-3.57,5.77,;-3.97,7.26,;-2.88,8.35,;-1.39,7.95,;-1,6.46,;.49,6.06,;1.58,7.15,;-2.08,5.37,;-1.57,3.5,;-.16,2.87,;1.17,3.64,;2.51,2.87,;3.84,2.1,;1.74,1.54,;3.28,4.21,;2.51,5.54,;4.82,4.21,;5.59,2.87,;5.59,5.54,;7.13,5.54,;7.9,6.87,;7.13,8.21,;7.9,9.54,;5.59,8.21,;4.82,6.87,;-.32,1.34,;-1.83,1.02,;-2.6,2.36,;-4.13,2.52,;-4.9,3.85,;-6.4,3.53,;-6.56,2,;-7.9,1.23,;-5.16,1.37,)|

BDBM456744

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2C2=CCN(C)CC2)nnc1-c1ccco1 |t:27,(.7,3.88,;-.63,3.11,;-1.97,3.88,;-1.97,5.42,;-3.3,6.19,;-4.63,5.42,;-4.63,3.88,;-5.97,3.11,;-7.3,3.88,;-3.3,3.11,;-3.3,1.57,;-2.05,.66,;-.57,1.06,;.52,-.03,;-.25,-1.36,;1.29,-1.36,;1.86,.74,;3.19,-.03,;4.52,.74,;4.52,2.28,;5.86,3.05,;7.19,2.28,;8.52,3.05,;7.19,.74,;5.86,-.03,;5.86,-1.57,;4.52,-2.34,;4.52,-3.88,;5.86,-4.65,;5.86,-6.19,;7.19,-3.88,;7.19,-2.34,;-2.53,-.8,;-4.07,-.8,;-4.55,.66,;-6.03,1.06,;-6.51,2.53,;-8.05,2.53,;-8.52,1.06,;-7.28,.16,)|

BDBM456745

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2C2=CCOCC2)nnc1-c1ccco1 |t:27,(.7,3.11,;-.63,2.34,;-1.97,3.11,;-1.97,4.65,;-3.3,5.42,;-4.63,4.65,;-4.63,3.11,;-5.97,2.34,;-7.3,3.11,;-3.3,2.34,;-3.3,.8,;-2.05,-.11,;-.57,.29,;.52,-.8,;-.25,-2.13,;1.29,-2.13,;1.86,-.03,;3.19,-.8,;4.52,-.03,;4.52,1.51,;5.86,2.28,;7.19,1.51,;8.52,2.28,;7.19,-.03,;5.86,-.8,;5.86,-2.34,;4.52,-3.11,;4.52,-4.65,;5.86,-5.42,;7.19,-4.65,;7.19,-3.11,;-2.53,-1.57,;-4.07,-1.57,;-4.55,-.11,;-6.03,.29,;-6.51,1.76,;-8.05,1.76,;-8.52,.29,;-7.28,-.61,)|

BDBM456747

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@](C)(O)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,wD:18.20,(-6.15,5.08,;-4.66,4.68,;-3.57,5.77,;-3.97,7.26,;-2.88,8.35,;-1.39,7.95,;-1,6.46,;.49,6.06,;1.58,7.15,;-2.08,5.37,;-1.57,3.5,;-.16,2.87,;1.17,3.64,;2.51,2.87,;3.84,2.1,;1.74,1.54,;3.28,4.21,;2.51,5.54,;4.82,4.21,;4.82,2.67,;6.15,3.44,;5.59,5.54,;7.13,5.54,;7.9,6.87,;7.13,8.21,;7.9,9.54,;5.59,8.21,;4.82,6.87,;-.32,1.34,;-1.83,1.02,;-2.6,2.36,;-4.13,2.52,;-4.9,3.85,;-6.4,3.53,;-6.56,2,;-7.9,1.23,;-5.16,1.37,)|

BDBM456748

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:16.17,wD:18.19,(.34,-3.54,;-.8,-4.57,;-2.27,-4.1,;-2.59,-2.59,;-4.05,-2.12,;-5.2,-3.15,;-4.88,-4.65,;-6.02,-5.68,;-7.48,-5.21,;-3.41,-5.13,;-3.09,-6.64,;-1.68,-7.26,;-.35,-6.49,;.98,-7.26,;.21,-8.6,;1.75,-5.93,;2.32,-8.03,;2.32,-9.57,;3.65,-7.26,;3.65,-5.72,;4.98,-8.03,;4.98,-9.57,;6.32,-10.34,;7.65,-9.57,;8.99,-10.34,;7.65,-8.03,;6.32,-7.26,;-1.84,-8.79,;-3.35,-9.11,;-4.12,-7.78,;-5.65,-7.62,;-6.42,-6.29,;-7.93,-6.61,;-8.09,-8.14,;-6.68,-8.76,)|

BDBM456749

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2CN2CCOCC2)nnc1-c1ccco1 |(.03,3.11,;-1.3,2.34,;-2.63,3.11,;-2.63,4.65,;-3.97,5.42,;-5.3,4.65,;-5.3,3.11,;-6.63,2.34,;-7.97,3.11,;-3.97,2.34,;-3.97,.8,;-2.72,-.11,;-1.23,.29,;-.14,-.8,;-1.23,-1.89,;.94,-1.89,;1.19,-.03,;2.52,-.8,;3.86,-.03,;3.86,1.51,;5.19,2.28,;6.52,1.51,;7.86,2.28,;6.52,-.03,;5.19,-.8,;5.19,-2.34,;6.52,-3.11,;6.52,-4.65,;7.86,-5.42,;9.19,-4.65,;9.19,-3.11,;7.86,-2.34,;-3.2,-1.57,;-4.74,-1.57,;-5.21,-.11,;-6.7,.29,;-7.18,1.76,;-8.72,1.76,;-9.19,.29,;-7.95,-.61,)|

BDBM456750

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2C2=CCNCC2)nnc1-c1ccco1 |t:27,(.7,3.11,;-.63,2.34,;-1.97,3.11,;-1.97,4.65,;-3.3,5.42,;-4.63,4.65,;-4.63,3.11,;-5.97,2.34,;-7.3,3.11,;-3.3,2.34,;-3.3,.8,;-2.05,-.11,;-.57,.29,;.52,-.8,;-.25,-2.13,;1.29,-2.13,;1.86,-.03,;3.19,-.8,;4.52,-.03,;4.52,1.51,;5.86,2.28,;7.19,1.51,;8.52,2.28,;7.19,-.03,;5.86,-.8,;5.86,-2.34,;4.52,-3.11,;4.52,-4.65,;5.86,-5.42,;7.19,-4.65,;7.19,-3.11,;-2.53,-1.57,;-4.07,-1.57,;-4.55,-.11,;-6.03,.29,;-6.51,1.76,;-8.05,1.76,;-8.52,.29,;-7.28,-.61,)|

BDBM456751

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2-c2cccnc2)nnc1-c1ccco1 |(.5,3.28,;-.83,2.51,;-2.17,3.28,;-2.17,4.82,;-3.5,5.59,;-4.83,4.82,;-4.83,3.28,;-6.17,2.51,;-7.5,3.28,;-3.5,2.51,;-3.5,.3,;-2.25,-.6,;-.77,-.2,;.57,-.97,;-.2,-2.31,;1.34,-2.31,;1.9,-.2,;3.24,-.97,;4.57,-.2,;4.57,1.34,;5.9,2.11,;7.24,1.34,;8.57,2.11,;7.24,-.2,;5.9,-.97,;5.9,-2.51,;7.24,-3.28,;7.24,-4.82,;5.9,-5.59,;4.57,-4.82,;4.57,-3.28,;-2.73,-2.07,;-4.27,-2.07,;-4.74,-.6,;-6.08,.17,;-6.55,1.63,;-8.09,1.63,;-8.57,.17,;-7.32,-.74,)|

BDBM456752

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2-c2ccncc2)nnc1-c1ccco1 |(-7.3,3.16,;-5.97,2.39,;-4.63,3.16,;-4.63,4.7,;-3.3,5.47,;-1.97,4.7,;-1.97,3.16,;-.63,2.39,;.7,3.16,;-3.3,2.39,;-3.3,.37,;-2.05,-.53,;-.72,.24,;.37,-.85,;-.4,-2.19,;1.14,-2.19,;1.7,-.08,;3.04,-.85,;4.37,-.08,;4.37,1.46,;5.7,2.23,;7.04,1.46,;8.37,2.23,;7.04,-.08,;5.7,-.85,;5.7,-2.39,;4.37,-3.16,;4.37,-4.7,;5.7,-5.47,;7.04,-4.7,;7.04,-3.16,;-2.53,-2,;-4.07,-2,;-4.55,-.53,;-5.88,.24,;-6.36,1.7,;-7.9,1.7,;-8.37,.24,;-7.13,-.67,)|

BDBM456753

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2-c2cc[nH]n2)nnc1-c1ccco1 |(-7.3,2.81,;-5.97,2.04,;-4.63,2.81,;-4.63,4.35,;-3.3,5.12,;-1.97,4.35,;-1.97,2.81,;-.63,2.04,;.7,2.81,;-3.3,2.04,;-3.3,.02,;-2.05,-.89,;-.72,-.12,;.37,-1.21,;-.4,-2.54,;1.14,-2.54,;1.7,-.44,;3.04,-1.21,;4.37,-.44,;4.37,1.1,;5.7,1.87,;7.04,1.1,;8.37,1.87,;7.04,-.44,;5.7,-1.21,;5.7,-2.75,;6.95,-3.65,;6.47,-5.12,;4.93,-5.12,;4.46,-3.65,;-2.53,-2.35,;-4.07,-2.35,;-4.55,-.89,;-5.88,-.12,;-6.36,1.35,;-7.9,1.35,;-8.37,-.12,;-7.13,-1.02,)|

BDBM456754

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2C2=CCN(CC2)C(C)=O)nnc1-c1ccco1 |t:27,(.5,4.44,;-.83,3.67,;-2.17,4.44,;-2.17,5.98,;-3.5,6.75,;-4.83,5.98,;-4.83,4.44,;-6.17,3.67,;-7.5,4.44,;-3.5,3.67,;-3.5,1.46,;-2.25,.55,;-.77,.95,;.57,.18,;-.2,-1.15,;1.34,-1.15,;1.9,.95,;3.24,.18,;4.57,.95,;4.57,2.49,;5.9,3.26,;7.24,2.49,;8.57,3.26,;7.24,.95,;5.9,.18,;5.9,-1.36,;4.57,-2.13,;4.57,-3.67,;5.9,-4.44,;7.24,-3.67,;7.24,-2.13,;5.9,-5.98,;7.24,-6.75,;4.57,-6.75,;-2.73,-.91,;-4.27,-.91,;-4.74,.55,;-6.08,1.32,;-6.55,2.79,;-8.09,2.79,;-8.57,1.32,;-7.32,.42,)|

BDBM456755

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@](C)(O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:18.20,wD:16.17,18.19,(-6.15,5.08,;-4.66,4.68,;-3.57,5.77,;-3.97,7.26,;-2.88,8.35,;-1.39,7.95,;-1,6.46,;.49,6.06,;1.58,7.15,;-2.08,5.37,;-1.57,3.5,;-.16,2.87,;1.17,3.64,;2.51,2.87,;3.84,2.1,;1.74,1.54,;3.28,4.21,;2.51,5.54,;4.82,4.21,;4.82,2.67,;6.15,3.44,;5.59,5.54,;7.13,5.54,;7.9,6.87,;7.13,8.21,;7.9,9.54,;5.59,8.21,;4.82,6.87,;-.32,1.34,;-1.83,1.02,;-2.6,2.36,;-4.13,2.52,;-4.9,3.85,;-6.4,3.53,;-6.56,2,;-7.9,1.23,;-5.16,1.37,)|

BDBM456756

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(4.82,1.56,;5.59,2.9,;4.82,4.23,;3.28,4.23,;2.51,5.56,;2.51,2.9,;3.84,2.13,;1.74,1.56,;1.17,3.67,;-.16,2.9,;-.32,1.37,;-1.83,1.05,;-2.6,2.38,;-4.13,2.54,;-4.9,3.87,;-6.4,3.55,;-6.56,2.02,;-7.9,1.25,;-5.16,1.4,;-1.57,3.52,;-2.08,5.4,;-3.57,5.79,;-4.66,4.71,;-6.15,5.1,;-3.97,7.28,;-2.88,8.37,;-1.39,7.97,;-1,6.49,;.49,6.09,;1.58,7.18,;5.59,5.56,;7.13,5.56,;7.9,6.9,;7.13,8.23,;7.9,9.57,;5.59,8.23,;4.82,6.9,)|

BDBM456757

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@](C)(O)c2ccc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,wD:18.20,(-6.53,4.52,;-5.05,4.12,;-3.96,5.21,;-4.36,6.7,;-3.27,7.79,;-1.78,7.39,;-1.38,5.9,;.11,5.5,;1.2,6.59,;-2.47,4.81,;-1.95,2.94,;-.54,2.31,;.79,3.08,;2.12,2.31,;3.46,1.54,;1.35,.98,;2.89,3.65,;2.12,4.98,;4.43,3.65,;4.43,2.11,;5.77,2.88,;5.2,4.98,;6.74,4.98,;7.51,6.32,;6.77,7.7,;5.2,7.65,;4.43,6.32,;7.54,9.03,;8.31,10.36,;-.7,.78,;-2.21,.46,;-2.98,1.8,;-4.51,1.96,;-5.28,3.29,;-6.79,2.97,;-6.95,1.44,;-8.28,.67,;-5.54,.81,)|

BDBM456758

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@](C)(O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:18.20,wD:16.17,18.19,(-6.15,5.19,;-4.66,4.79,;-3.57,5.88,;-3.97,7.37,;-2.88,8.46,;-1.39,8.06,;-1,6.57,;.49,6.17,;1.58,7.26,;-2.08,5.48,;-1.57,3.61,;-.16,2.98,;1.17,3.75,;2.51,2.98,;3.84,2.21,;1.74,1.65,;3.28,4.32,;2.51,5.65,;4.82,4.32,;4.82,2.78,;6.15,3.55,;5.59,5.65,;7.13,5.65,;7.9,6.98,;7.13,8.32,;7.9,9.65,;5.59,8.32,;4.82,6.98,;-.32,1.45,;-1.83,1.13,;-2.6,2.46,;-4.13,2.62,;-4.9,3.96,;-6.4,3.64,;-6.56,2.11,;-7.9,1.34,;-5.16,1.48,)|

BDBM456759

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@](C)(F)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:17.19,wD:17.18,(-7.18,-4.67,;-5.85,-5.44,;-4.52,-4.67,;-4.52,-3.13,;-3.18,-2.36,;-1.85,-3.13,;-1.85,-4.67,;-.52,-5.44,;.82,-4.67,;-3.18,-5.44,;-3.18,-6.98,;-1.94,-7.89,;-.6,-7.12,;.73,-7.89,;-.04,-9.22,;1.5,-9.22,;2.06,-7.12,;3.4,-7.89,;3.4,-9.43,;4.73,-8.66,;4.73,-7.12,;6.07,-7.89,;7.4,-7.12,;7.45,-5.55,;6.07,-4.81,;4.73,-5.58,;8.78,-4.78,;10.11,-4.01,;-2.41,-9.35,;-3.95,-9.35,;-4.43,-7.89,;-5.92,-7.49,;-6.39,-6.03,;-7.93,-6.03,;-8.41,-7.49,;-9.74,-8.26,;-7.16,-8.4,)|

BDBM456760

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@](C)(F)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.17,18.20,wD:18.19,(-7.77,18.17,;-6.44,17.4,;-5.1,18.17,;-5.1,19.71,;-3.77,20.48,;-2.44,19.71,;-2.44,18.17,;-1.1,17.4,;.23,18.17,;-3.77,17.4,;-3.77,15.86,;-2.52,14.95,;-1.19,15.72,;-.1,14.63,;-1.19,13.54,;.3,13.15,;1.39,15.03,;1.78,16.52,;2.48,13.94,;1.39,12.85,;2.87,12.46,;3.96,14.34,;5.05,13.25,;6.54,13.65,;7.04,15.17,;5.85,16.23,;4.36,15.83,;8.55,15.57,;10.06,15.98,;-3,13.49,;-4.54,13.49,;-5.02,14.95,;-6.5,15.35,;-6.98,16.82,;-8.52,16.82,;-9,15.35,;-10.33,14.58,;-7.75,14.45,)|

BDBM456761

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@](C)(F)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:17.19,wD:17.18,(-7.3,-4.76,;-5.97,-5.53,;-4.64,-4.76,;-4.64,-3.22,;-3.3,-2.45,;-1.97,-3.22,;-1.97,-4.76,;-.63,-5.53,;.7,-4.76,;-3.3,-5.53,;-3.3,-7.07,;-2.06,-7.98,;-.72,-7.21,;.61,-7.98,;-.16,-9.31,;1.38,-9.31,;1.95,-7.21,;3.28,-7.98,;3.28,-9.52,;4.61,-8.75,;4.61,-7.21,;5.95,-7.98,;7.28,-7.21,;7.33,-5.64,;5.95,-4.9,;4.61,-5.67,;8.66,-4.87,;9.99,-4.1,;-2.53,-9.44,;-4.07,-9.44,;-4.55,-7.98,;-6.04,-7.58,;-6.51,-6.12,;-8.05,-6.12,;-8.53,-7.58,;-9.86,-8.35,;-7.28,-8.49,)|

BDBM456762

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2CCN2CCCC2)nnc1-c1ccco1 |(-8.53,1.61,;-7.2,.84,;-5.86,1.61,;-5.86,3.15,;-4.53,3.92,;-3.2,3.15,;-3.2,1.61,;-1.86,.84,;-.53,1.61,;-4.53,.84,;-4.53,-.7,;-3.28,-1.61,;-1.95,-.84,;-.62,-1.61,;-1.39,-2.94,;.15,-2.94,;.72,-.84,;2.05,-1.61,;3.38,-.84,;3.38,.7,;4.72,1.47,;6.05,.7,;7.39,1.47,;6.05,-.84,;4.72,-1.61,;4.72,-3.15,;6.05,-3.92,;7.39,-3.15,;8.85,-3.62,;9.76,-2.38,;8.85,-1.13,;7.39,-1.61,;-3.76,-3.07,;-5.3,-3.07,;-5.78,-1.61,;-7.26,-1.21,;-7.74,.26,;-9.28,.26,;-9.76,-1.21,;-8.51,-2.11,)|

BDBM456763

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@](C)(O)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:17.18,wD:17.19,(-7.2,-5.23,;-5.87,-6,;-4.54,-5.23,;-4.54,-3.69,;-3.2,-2.92,;-1.87,-3.69,;-1.87,-5.23,;-.53,-6,;.8,-5.23,;-3.2,-6,;-3.2,-7.54,;-1.96,-8.44,;-.62,-7.67,;.71,-8.44,;-.06,-9.78,;1.48,-9.78,;2.05,-7.67,;3.38,-8.44,;2.98,-9.93,;4.15,-9.78,;4.71,-7.67,;6.05,-8.44,;7.38,-7.67,;7.38,-6.13,;6.05,-5.36,;4.71,-6.13,;8.71,-5.36,;10.05,-4.59,;-2.43,-9.91,;-3.97,-9.91,;-4.45,-8.44,;-5.93,-8.04,;-6.41,-6.58,;-7.95,-6.58,;-8.43,-8.04,;-9.76,-8.81,;-7.18,-8.95,)|

BDBM456764

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)c(C)n2)nnc1-c1ccco1 |r,wD:16.17,(-6.74,-4.39,;-5.4,-5.16,;-4.07,-4.39,;-4.07,-2.85,;-2.74,-2.08,;-1.4,-2.85,;-1.4,-4.39,;-.07,-5.16,;1.27,-4.39,;-2.74,-5.16,;-2.74,-6.7,;-1.49,-7.6,;-.02,-7.13,;1.06,-8.21,;.29,-9.55,;1.83,-9.55,;2.4,-7.44,;2.4,-5.9,;3.73,-8.21,;5.07,-7.44,;5.07,-5.9,;6.4,-5.13,;7.73,-5.9,;9.07,-5.13,;7.73,-7.44,;9.07,-8.21,;6.4,-8.21,;-1.97,-9.07,;-3.51,-9.07,;-3.98,-7.6,;-5.45,-7.13,;-5.92,-5.66,;-7.46,-5.66,;-7.94,-7.13,;-6.69,-8.03,)|

BDBM456765

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2CCN2CCC2)nnc1-c1ccco1 |(-8.24,1.91,;-6.91,1.14,;-5.58,1.91,;-5.58,3.45,;-4.24,4.22,;-2.91,3.45,;-2.91,1.91,;-1.58,1.14,;-.24,1.91,;-4.24,1.14,;-4.24,-.4,;-3,-1.3,;-1.53,-.83,;-.44,-1.91,;-1.21,-3.25,;.33,-3.25,;.89,-1.14,;2.22,-1.91,;3.56,-1.14,;3.56,.4,;4.89,1.17,;6.23,.4,;7.56,1.17,;6.23,-1.14,;4.89,-1.91,;4.89,-3.45,;6.23,-4.22,;7.56,-3.45,;9.05,-3.85,;9.44,-2.37,;7.96,-1.97,;-3.47,-2.77,;-5.01,-2.77,;-5.49,-1.3,;-6.95,-.83,;-7.43,.64,;-8.97,.64,;-9.44,-.83,;-8.2,-1.73,)|

BDBM456767

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@](C)(F)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.19,wD:17.18,(-6.13,-4.57,;-4.8,-5.34,;-3.46,-4.57,;-3.46,-3.03,;-2.13,-2.26,;-.8,-3.03,;-.8,-4.57,;.54,-5.34,;1.87,-4.57,;-2.13,-5.34,;-2.13,-6.88,;-.88,-7.79,;.58,-7.31,;1.67,-8.4,;.9,-9.73,;2.44,-9.73,;3,-7.63,;4.34,-8.4,;4.34,-9.94,;5.67,-9.17,;5.67,-7.63,;7,-8.4,;8.34,-7.63,;8.34,-6.09,;9.67,-5.32,;7,-5.32,;5.67,-6.09,;-1.36,-9.25,;-2.9,-9.25,;-3.38,-7.79,;-4.84,-7.31,;-5.32,-5.85,;-6.86,-5.85,;-7.33,-7.31,;-8.8,-7.79,;-6.09,-8.22,)|

BDBM456768

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2CCN2CC[C@H](O)C2)nnc1-c1ccco1 |r,wD:30.32,(-9.29,1.91,;-7.95,1.14,;-6.62,1.91,;-6.62,3.45,;-5.28,4.22,;-3.95,3.45,;-3.95,1.91,;-2.62,1.14,;-1.28,1.91,;-5.28,1.14,;-5.28,-.4,;-4.04,-1.3,;-2.57,-.83,;-1.48,-1.91,;-2.25,-3.25,;-.71,-3.25,;-.15,-1.14,;1.18,-1.91,;2.52,-1.14,;2.52,.4,;3.85,1.17,;5.18,.4,;6.52,1.17,;5.18,-1.14,;3.85,-1.91,;3.85,-3.45,;5.18,-4.22,;6.52,-3.45,;6.68,-1.92,;8.18,-1.6,;8.95,-2.94,;10.49,-3.1,;7.92,-4.08,;-4.51,-2.77,;-6.05,-2.77,;-6.53,-1.3,;-7.99,-.83,;-8.47,.64,;-10.01,.64,;-10.49,-.83,;-9.24,-1.73,)|

BDBM456769

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cc2CCN2CCOCC2)nnc1-c1ccco1 |(-8.63,1.91,;-7.3,1.14,;-5.97,1.91,;-5.97,3.45,;-4.63,4.22,;-3.3,3.45,;-3.3,1.91,;-1.97,1.14,;-.63,1.91,;-4.63,1.14,;-4.63,-.4,;-3.39,-1.3,;-1.92,-.83,;-.83,-1.91,;-1.6,-3.25,;-.06,-3.25,;.5,-1.14,;1.83,-1.91,;3.17,-1.14,;3.17,.4,;4.5,1.17,;5.83,.4,;7.17,1.17,;5.83,-1.14,;4.5,-1.91,;4.5,-3.45,;5.83,-4.22,;7.17,-3.45,;8.5,-4.22,;9.84,-3.45,;9.84,-1.91,;8.5,-1.14,;7.17,-1.91,;-3.86,-2.77,;-5.4,-2.77,;-5.88,-1.3,;-7.34,-.83,;-7.82,.64,;-9.36,.64,;-9.84,-.83,;-8.59,-1.73,)|

BDBM456770

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cc2N2C[C@H](O)CC2=O)nnc1-c1ccco1 |r,wU:16.17,28.30,(-7.81,10.16,;-6.48,9.39,;-5.14,10.16,;-5.14,11.7,;-3.81,12.47,;-2.48,11.7,;-2.48,10.16,;-1.14,9.39,;.19,10.16,;-3.81,9.39,;-3.81,7.85,;-2.56,6.94,;-1.1,7.42,;-.01,6.33,;-.78,5,;.76,5,;1.32,7.1,;1.32,8.64,;2.66,6.33,;3.99,7.1,;3.99,8.64,;5.33,9.41,;6.66,8.64,;7.99,9.41,;6.66,7.1,;5.33,6.33,;5.33,4.79,;4.08,3.89,;4.56,2.42,;3.65,1.17,;6.1,2.42,;6.57,3.89,;8.04,4.36,;-3.04,5.48,;-4.58,5.48,;-5.05,6.94,;-6.52,7.42,;-7,8.88,;-8.54,8.88,;-9.01,7.42,;-7.77,6.51,)|

BDBM456771

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@](C)(O)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:17.18,wD:17.19,(-7.89,7.18,;-6.55,6.41,;-5.22,7.18,;-5.22,8.72,;-3.89,9.49,;-2.55,8.72,;-2.55,7.18,;-1.22,6.41,;.12,7.18,;-3.89,6.41,;-3.89,4.87,;-2.64,3.97,;-1.17,4.45,;-.09,3.36,;-.86,2.02,;.68,2.02,;1.25,4.13,;2.58,3.36,;2.58,1.82,;3.91,2.59,;3.91,4.13,;5.25,3.36,;6.58,4.13,;6.71,5.74,;5.25,6.44,;3.91,5.67,;8.08,6.53,;9.46,7.33,;-3.12,2.5,;-4.66,2.5,;-5.13,3.97,;-6.6,4.45,;-7.07,5.91,;-8.61,5.91,;-9.09,4.45,;-10.55,3.97,;-7.84,3.54,)|

BDBM456772

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@](C)(O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:18.20,wD:18.19,16.17,(-6.62,-4.7,;-5.28,-5.47,;-3.74,-5.47,;-3.74,-3.93,;-2.41,-3.16,;-1.08,-3.93,;-1.08,-5.47,;.46,-5.47,;1.23,-4.14,;-2.41,-6.24,;-2.41,-7.78,;-1.19,-8.59,;.1,-8.11,;1.27,-9.12,;.26,-10.28,;1.77,-10.57,;2.72,-8.61,;3.01,-7.1,;3.89,-9.62,;3.6,-11.13,;5.05,-10.63,;5.34,-9.11,;6.51,-10.12,;7.96,-9.62,;8.25,-8.1,;9.71,-7.6,;7.09,-7.1,;5.63,-7.6,;-1.64,-10.15,;-3.18,-10.15,;-3.66,-8.69,;-5.12,-8.21,;-5.6,-6.75,;-7.14,-6.75,;-7.61,-8.21,;-9.08,-8.69,;-6.37,-9.12,)|

BDBM456773

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@](C)(N)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:18.20,wD:18.19,16.17,(-6.62,-15.7,;-5.28,-16.47,;-3.74,-16.47,;-3.74,-14.93,;-2.41,-14.16,;-1.08,-14.93,;-1.08,-16.47,;.46,-16.47,;1.23,-15.14,;-2.41,-17.24,;-2.41,-18.78,;-1.19,-19.59,;.1,-19.11,;1.27,-20.11,;.26,-21.28,;1.77,-21.57,;2.72,-19.61,;3.01,-18.1,;3.89,-20.62,;3.6,-22.13,;5.05,-21.62,;5.34,-20.11,;6.51,-21.12,;7.96,-20.61,;8.25,-19.1,;9.71,-18.6,;7.09,-18.09,;5.63,-18.6,;-1.64,-21.15,;-3.18,-21.15,;-3.66,-19.69,;-5.12,-19.21,;-5.6,-17.75,;-7.14,-17.75,;-7.61,-19.21,;-9.08,-19.69,;-6.37,-20.12,)|

BDBM456774

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(.67,8.47,;-.1,7.13,;-1.64,7.13,;-1.64,8.67,;-2.97,9.44,;-4.31,8.67,;-4.31,7.13,;-5.85,7.13,;-7.05,7.88,;-2.97,6.36,;-2.97,4.82,;-1.73,3.92,;-.24,4.32,;.85,3.23,;-.24,2.14,;1.51,1.88,;2.34,3.63,;2.74,5.11,;3.43,2.54,;3.03,1.05,;4.91,2.93,;6,1.85,;7.49,2.24,;7.89,3.73,;9.38,4.13,;6.8,4.82,;5.31,4.42,;-2.2,2.45,;-3.74,2.45,;-4.22,3.92,;-5.55,4.69,;-6.03,6.15,;-7.57,6.15,;-8.04,4.69,;-9.38,3.92,;-6.8,3.78,)|

BDBM456775

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@](C)(F)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:17.18,wD:17.19,(1.89,-5.75,;.75,-6.78,;-.72,-6.3,;-1.04,-4.79,;-2.5,-4.32,;-3.65,-5.35,;-3.33,-6.86,;-4.47,-7.89,;-5.94,-7.41,;-1.86,-7.33,;-1.54,-8.84,;-.14,-9.46,;1.2,-8.69,;2.53,-9.46,;1.76,-10.8,;3.87,-10.23,;3.3,-8.13,;4.84,-8.13,;6.18,-8.9,;4.84,-9.67,;5.61,-6.8,;7.15,-6.8,;7.92,-5.46,;7.18,-4.08,;5.61,-4.13,;4.84,-5.46,;7.95,-2.75,;8.72,-1.41,;-.3,-11,;-1.8,-11.32,;-2.57,-9.98,;-4.1,-9.82,;-4.87,-8.49,;-6.38,-8.81,;-6.54,-10.34,;-7.88,-11.11,;-5.14,-10.97,)|

BDBM456777

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cnc(C)cn2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-6.15,5.1,;-4.66,4.71,;-3.57,5.79,;-3.97,7.28,;-2.88,8.37,;-1.39,7.97,;-1,6.49,;.49,6.09,;1.58,7.18,;-2.08,5.4,;-1.57,3.52,;-.16,2.9,;1.17,3.67,;2.51,2.9,;3.84,2.13,;1.74,1.56,;3.28,4.23,;2.51,5.56,;4.82,4.23,;5.59,2.9,;5.59,5.56,;7.13,5.56,;7.9,6.9,;7.13,8.23,;7.9,9.57,;5.59,8.23,;4.82,6.9,;-.32,1.37,;-1.83,1.05,;-2.6,2.38,;-4.13,2.54,;-4.9,3.87,;-6.4,3.55,;-6.56,2.02,;-7.9,1.25,;-5.16,1.4,)|

BDBM456778

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@](C)(O)c2ncc(cn2)C#N)nnc1-c1ccc(C)o1 |r,wU:17.19,wD:17.18,(-6.84,-3.86,;-5.51,-4.63,;-4.17,-3.86,;-4.17,-2.32,;-2.84,-1.55,;-1.51,-2.32,;-1.51,-3.86,;-.17,-4.63,;1.16,-3.86,;-2.84,-4.63,;-2.84,-6.17,;-1.59,-7.08,;-.42,-6.36,;.92,-7.13,;.15,-8.47,;1.69,-8.47,;2.25,-6.36,;3.58,-7.13,;3.58,-8.67,;4.92,-7.9,;4.92,-6.36,;6.25,-7.13,;7.58,-6.36,;7.63,-4.8,;6.25,-4.05,;4.92,-4.82,;8.97,-4.03,;10.3,-3.26,;-2.07,-8.54,;-3.61,-8.54,;-4.09,-7.08,;-5.55,-6.6,;-6.03,-5.14,;-7.57,-5.14,;-8.04,-6.6,;-9.51,-7.08,;-6.8,-7.51,)|

BDBM456779

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@](C)(O)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:17.19,wD:17.18,(-6.27,-4.1,;-4.94,-4.87,;-3.61,-4.1,;-3.61,-2.56,;-2.27,-1.79,;-.94,-2.56,;-.94,-4.1,;.4,-4.87,;1.73,-4.1,;-2.27,-4.87,;-2.27,-6.41,;-1.03,-7.31,;.15,-6.6,;1.48,-7.37,;.71,-8.7,;2.25,-8.7,;2.82,-6.6,;4.15,-7.37,;4.15,-8.91,;5.48,-8.14,;5.48,-6.6,;6.82,-7.37,;8.15,-6.6,;8.15,-5.06,;9.49,-4.29,;6.82,-4.29,;5.48,-5.06,;-1.5,-8.78,;-3.04,-8.78,;-3.52,-7.31,;-4.98,-6.84,;-5.46,-5.37,;-7,-5.37,;-7.47,-6.84,;-8.94,-7.31,;-6.23,-7.74,)|

BDBM456781

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](C)c2ncc(C)cn2)nnc1-c1ccco1 |wD:17.18,(1.53,-3.96,;.2,-4.73,;-1.13,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,;-2.47,-4.73,;-2.47,-6.27,;-3.71,-7.18,;-5.18,-6.7,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-7.47,-8.77,;-8.93,-8.29,;-9.25,-6.78,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;1.49,-7.61,;2.73,-6.7,;2.26,-5.24,;.72,-5.24,)|

BDBM456782

COc1ncnc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1ccco1 |(-7.28,1.22,;-5.94,.45,;-4.61,1.22,;-4.61,2.76,;-3.28,3.53,;-1.94,2.76,;-1.94,1.22,;-.61,.45,;.72,1.22,;-3.28,.45,;-3.28,-1.09,;-2.03,-1.99,;-.86,-1.28,;.48,-2.05,;-.61,-3.13,;.88,-3.53,;1.81,-1.28,;3.15,-2.05,;4.48,-1.28,;5.81,-2.05,;7.15,-1.28,;7.15,.26,;8.48,1.03,;5.81,1.03,;4.4,.35,;3.08,1.14,;1.76,1.92,;-2.51,-3.46,;-4.05,-3.46,;-4.52,-1.99,;-5.99,-1.52,;-6.46,-.05,;-8,-.05,;-8.48,-1.52,;-7.23,-2.42,)|

BDBM456783

COc1ncnc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccco1 |(-7.42,1.49,;-6.09,.72,;-4.76,1.49,;-4.76,3.03,;-3.42,3.8,;-2.09,3.03,;-2.09,1.49,;-.75,.72,;.58,1.49,;-3.42,.72,;-3.42,-.82,;-2.18,-1.73,;-.71,-1.25,;.62,-2.31,;1.02,-3.8,;-.47,-3.4,;1.96,-1.54,;3.29,-2.31,;4.62,-1.54,;5.96,-2.31,;7.29,-1.54,;7.29,-0,;8.62,.77,;5.96,.77,;4.62,-0,;-2.65,-3.19,;-4.19,-3.19,;-4.67,-1.73,;-6.13,-1.25,;-6.61,.21,;-8.15,.21,;-8.62,-1.25,;-7.38,-2.16,)|

BDBM456784

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.82,-3.74,;5.59,-2.41,;4.82,-1.07,;3.28,-1.07,;2.51,.26,;2.51,-2.41,;3.84,-3.18,;1.74,-3.74,;1.17,-1.64,;-.16,-2.41,;-.32,-3.94,;-1.83,-4.26,;-2.6,-2.93,;-4.13,-2.77,;-4.9,-1.43,;-6.4,-1.75,;-6.56,-3.28,;-7.9,-4.05,;-5.16,-3.91,;-1.57,-1.78,;-2.08,.09,;-3.57,.49,;-4.66,-.6,;-6.15,-.2,;-3.97,1.98,;-2.88,3.07,;-1.39,2.67,;-1,1.18,;.49,.78,;1.58,1.87,;5.59,.26,;7.13,.26,;7.9,1.59,;7.13,2.93,;7.9,4.26,;5.59,2.93,;4.82,1.59,)|

BDBM456785

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.63,1.29,;-5.29,.52,;-3.96,1.29,;-3.96,2.83,;-2.62,3.6,;-1.29,2.83,;-1.29,1.29,;.04,.52,;1.38,1.29,;-2.62,.52,;-2.62,-1.16,;-1.38,-2.06,;-.04,-1.29,;1.29,-2.06,;-.04,-2.83,;2.62,-2.83,;2.62,-1.29,;2.62,.25,;3.96,-2.06,;3.96,-3.6,;5.29,-1.29,;6.62,-2.06,;7.96,-1.29,;7.96,.25,;9.29,1.02,;6.62,1.02,;5.29,.25,;-1.85,-3.53,;-3.39,-3.53,;-3.87,-2.06,;-5.33,-1.59,;-5.81,-.12,;-7.35,-.12,;-7.83,-1.59,;-9.29,-2.06,;-6.58,-2.49,)|

BDBM456786

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1cn2ccccc2n1 |r,wU:3.3,2.1,(5.03,-8.8,;3.7,-8.03,;3.7,-6.49,;2.37,-5.72,;2.37,-4.18,;1.03,-6.49,;-.3,-7.26,;2.37,-7.26,;-.3,-5.72,;-1.76,-6.2,;-2.24,-7.66,;-3.78,-7.66,;-4.26,-6.2,;-5.72,-5.72,;-6.2,-4.26,;-7.74,-4.26,;-8.21,-5.72,;-9.68,-6.2,;-6.97,-6.63,;-3.01,-5.29,;-3.01,-3.75,;-1.68,-2.98,;-.34,-3.75,;.99,-2.98,;-1.68,-1.44,;-3.01,-.67,;-4.34,-1.44,;-4.34,-2.98,;-5.68,-3.75,;-7.01,-2.98,;5.03,-5.72,;5.2,-4.19,;6.7,-3.87,;7.47,-2.53,;9.01,-2.53,;9.78,-3.87,;9.01,-5.2,;7.47,-5.2,;6.44,-6.35,)|

BDBM456787

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1cn2ccccc2n1 |r,wU:3.3,2.1,(5.07,-8.95,;3.74,-8.18,;3.74,-6.64,;2.41,-5.87,;2.41,-4.33,;1.07,-6.64,;-.26,-7.41,;2.41,-7.41,;-.26,-5.87,;-1.72,-6.35,;-2.2,-7.81,;-3.74,-7.81,;-4.22,-6.35,;-5.68,-5.87,;-6.16,-4.41,;-7.7,-4.41,;-8.17,-5.87,;-9.64,-6.35,;-6.93,-6.78,;-2.97,-5.44,;-2.97,-3.9,;-1.64,-3.13,;-.3,-3.9,;1.03,-3.13,;-1.64,-1.59,;-2.97,-.82,;-4.3,-1.59,;-4.3,-3.13,;-5.64,-3.9,;-6.97,-3.13,;5.07,-5.87,;5.24,-4.34,;6.74,-4.02,;7.51,-2.69,;9.05,-2.69,;9.82,-4.02,;9.05,-5.35,;7.51,-5.35,;6.48,-6.5,)|

BDBM456788

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1cn2ccccc2n1 |r,wU:3.3,2.1,(5.24,-8.8,;3.91,-8.03,;3.91,-6.49,;2.58,-5.72,;2.58,-4.18,;1.24,-6.49,;-.09,-7.26,;2.58,-7.26,;-.09,-5.72,;-1.55,-6.2,;-2.03,-7.66,;-3.57,-7.66,;-4.05,-6.2,;-5.51,-5.72,;-5.99,-4.26,;-7.53,-4.26,;-8,-5.72,;-9.47,-6.2,;-6.76,-6.63,;-2.8,-5.29,;-2.8,-3.75,;-1.47,-2.98,;-.13,-3.75,;1.2,-2.98,;-1.47,-1.44,;-2.8,-.67,;-4.13,-1.44,;-4.13,-2.98,;-5.47,-3.75,;-6.8,-2.98,;5.24,-5.72,;5.41,-4.19,;6.91,-3.87,;7.68,-2.53,;9.22,-2.53,;9.99,-3.87,;9.22,-5.2,;7.68,-5.2,;6.65,-6.35,)|

BDBM456789

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cc3ccccn3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(1.2,-3.37,;-.13,-4.14,;-1.47,-3.37,;-1.47,-1.83,;-2.8,-1.06,;-4.13,-1.83,;-4.13,-3.37,;-5.47,-4.14,;-6.8,-3.37,;-2.8,-4.14,;-2.8,-5.68,;-1.55,-6.58,;-.09,-6.11,;1.24,-6.88,;-.09,-7.65,;2.58,-7.65,;2.58,-6.11,;2.58,-4.57,;3.91,-6.88,;3.91,-8.42,;5.24,-6.11,;5.41,-4.57,;6.91,-4.25,;7.68,-2.92,;9.22,-2.92,;9.99,-4.25,;9.22,-5.59,;7.68,-5.59,;6.65,-6.73,;-2.03,-8.05,;-3.57,-8.05,;-4.05,-6.58,;-5.51,-6.11,;-5.99,-4.64,;-7.53,-4.64,;-8,-6.11,;-9.47,-6.58,;-6.76,-7.01,)|

BDBM456790

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cccc3ccnn23)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(.64,6.22,;-.69,5.45,;-2.02,6.22,;-2.02,7.76,;-3.36,8.53,;-4.69,7.76,;-4.69,6.22,;-6.02,5.45,;-7.36,6.22,;-3.36,5.45,;-3.36,3.91,;-2.11,3,;-.65,3.48,;.69,2.71,;-.65,1.94,;2.02,1.94,;2.02,3.48,;2.02,5.02,;3.35,2.71,;3.35,1.17,;4.69,3.48,;4.69,5.02,;6.02,5.79,;7.36,5.02,;7.36,3.48,;8.5,2.45,;7.87,1.04,;6.34,1.2,;6.02,2.71,;-2.59,1.54,;-4.13,1.54,;-4.6,3,;-6.07,3.48,;-6.54,4.94,;-8.08,4.94,;-8.56,3.48,;-10.02,3,;-7.31,2.57,)|

BDBM456791

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1cn2ccccc2n1 |r,wU:3.3,wD:2.1,(5.03,-8.8,;3.7,-8.03,;3.7,-6.49,;2.37,-5.72,;2.37,-4.18,;1.03,-6.49,;-.3,-7.26,;2.37,-7.26,;-.3,-5.72,;-1.76,-6.2,;-2.24,-7.66,;-3.78,-7.66,;-4.26,-6.2,;-5.72,-5.72,;-6.2,-4.26,;-7.74,-4.26,;-8.21,-5.72,;-9.68,-6.2,;-6.97,-6.63,;-3.01,-5.29,;-3.01,-3.75,;-1.68,-2.98,;-.34,-3.75,;.99,-2.98,;-1.68,-1.44,;-3.01,-.67,;-4.34,-1.44,;-4.34,-2.98,;-5.68,-3.75,;-7.01,-2.98,;5.03,-5.72,;5.2,-4.19,;6.7,-3.87,;7.47,-2.53,;9.01,-2.53,;9.78,-3.87,;9.01,-5.2,;7.47,-5.2,;6.44,-6.35,)|

BDBM456792

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cn3ccccc3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(1,-3.37,;-.33,-4.14,;-1.66,-3.37,;-1.66,-1.83,;-3,-1.06,;-4.33,-1.83,;-4.33,-3.37,;-5.66,-4.14,;-7,-3.37,;-3,-4.14,;-3,-5.68,;-1.75,-6.58,;-.29,-6.1,;1.05,-6.87,;-.29,-7.64,;2.38,-7.64,;2.38,-6.1,;2.38,-4.56,;3.72,-6.87,;3.72,-8.41,;5.05,-6.1,;5.21,-4.57,;6.72,-4.25,;7.49,-2.92,;9.03,-2.92,;9.8,-4.25,;9.03,-5.59,;7.49,-5.59,;6.46,-6.73,;-2.23,-8.05,;-3.77,-8.05,;-4.24,-6.58,;-5.71,-6.1,;-6.18,-4.64,;-7.72,-4.64,;-8.2,-6.1,;-9.66,-6.58,;-6.95,-7.01,)|

BDBM456793

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncn3ccccc23)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(2.45,-3.87,;1.12,-4.64,;-.21,-3.87,;-.21,-2.33,;-1.55,-1.56,;-2.88,-2.33,;-2.88,-3.87,;-4.21,-4.64,;-5.55,-3.87,;-1.55,-4.64,;-1.55,-6.18,;-.3,-7.09,;1.16,-6.61,;2.5,-7.38,;1.16,-8.15,;3.83,-8.15,;3.83,-6.61,;3.83,-5.07,;5.16,-7.38,;5.16,-8.92,;6.5,-6.61,;7.9,-7.24,;8.94,-6.09,;8.17,-4.76,;8.64,-3.3,;7.61,-2.15,;6.1,-2.47,;5.63,-3.94,;6.66,-5.08,;-.78,-8.55,;-2.32,-8.55,;-2.79,-7.09,;-4.26,-6.61,;-4.73,-5.15,;-6.27,-5.15,;-6.75,-6.61,;-8.21,-7.09,;-5.5,-7.52,)|

BDBM456794

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2cc3ccccn3n2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-7.01,7.7,;-5.67,6.93,;-4.34,7.7,;-4.34,9.24,;-3.01,10.01,;-1.67,9.24,;-1.67,7.7,;-.34,6.93,;.99,7.7,;-3.01,6.93,;-3.01,5.39,;-1.76,4.48,;-.3,4.96,;1.04,4.19,;-.3,3.42,;2.37,3.42,;2.37,4.96,;2.37,6.5,;3.7,4.19,;3.7,2.65,;5.04,4.96,;5.2,6.49,;6.71,6.81,;7.48,8.14,;9.02,8.14,;9.79,6.81,;9.02,5.47,;7.48,5.47,;6.44,4.33,;-2.24,3.02,;-3.78,3.02,;-4.25,4.48,;-5.72,4.96,;-6.19,6.42,;-7.73,6.42,;-8.21,4.96,;-9.67,4.48,;-6.96,4.05,)|

BDBM456795

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cc3ccccn3n2)nnc1-c1ccc(C)o1 |r,wD:18.19,16.17,(-7.01,7.7,;-5.67,6.93,;-4.34,7.7,;-4.34,9.24,;-3.01,10.01,;-1.67,9.24,;-1.67,7.7,;-.34,6.93,;.99,7.7,;-3.01,6.93,;-3.01,5.39,;-1.76,4.48,;-.3,4.96,;1.04,4.19,;-.3,3.42,;2.37,3.42,;2.37,4.96,;2.37,6.5,;3.7,4.19,;3.7,2.65,;5.04,4.96,;5.2,6.49,;6.71,6.81,;7.48,8.14,;9.02,8.14,;9.79,6.81,;9.02,5.47,;7.48,5.47,;6.44,4.33,;-2.24,3.02,;-3.78,3.02,;-4.25,4.48,;-5.72,4.96,;-6.19,6.42,;-7.73,6.42,;-8.21,4.96,;-9.67,4.48,;-6.96,4.05,)|

BDBM456796

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cn(C)cn2)nnc1-c1ccc(C)o1 |r,wD:18.19,16.17,(-5.69,7.81,;-4.35,7.04,;-3.02,7.81,;-3.02,9.35,;-1.69,10.12,;-.35,9.35,;-.35,7.81,;.98,7.04,;2.32,7.81,;-1.69,7.04,;-1.69,5.5,;-.44,4.59,;1.02,5.07,;2.36,4.3,;1.02,3.53,;3.69,3.53,;3.69,5.07,;3.69,6.61,;5.03,4.3,;5.03,2.76,;6.36,5.07,;6.52,6.6,;8.03,6.92,;8.65,8.33,;8.8,5.59,;7.77,4.44,;-.92,3.13,;-2.46,3.13,;-2.93,4.59,;-4.4,5.07,;-4.87,6.53,;-6.41,6.53,;-6.89,5.07,;-8.35,4.59,;-5.64,4.16,)|

BDBM456797

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cccc3ccnn23)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.48,8.2,;-5.15,7.43,;-3.82,8.2,;-3.82,9.74,;-2.48,10.51,;-1.15,9.74,;-1.15,8.2,;.18,7.43,;1.52,8.2,;-2.48,7.43,;-2.48,5.89,;-1.24,4.98,;.23,5.46,;1.56,4.69,;.23,3.92,;2.89,3.92,;2.89,5.46,;2.89,7,;4.23,4.69,;4.23,3.15,;5.56,5.46,;5.56,7,;6.9,7.77,;8.23,7,;8.23,5.46,;9.37,4.43,;8.75,3.02,;7.22,3.18,;6.9,4.69,;-1.71,3.52,;-3.25,3.52,;-3.73,4.98,;-5.19,5.46,;-5.67,6.92,;-7.21,6.92,;-7.69,5.46,;-9.15,4.98,;-6.44,4.55,)|

BDBM456798

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wD:18.19,16.17,(-6.66,8.5,;-5.32,7.73,;-3.99,8.5,;-3.99,10.04,;-2.65,10.81,;-1.32,10.04,;-1.32,8.5,;.01,7.73,;1.35,8.5,;-2.65,7.73,;-2.65,6.19,;-1.41,5.28,;.06,5.76,;1.39,4.99,;.06,4.22,;2.72,4.22,;2.72,5.76,;2.72,7.3,;4.06,4.99,;4.06,3.45,;5.39,5.76,;5.55,7.29,;7.06,7.61,;7.83,6.28,;9.36,6.12,;6.8,5.13,;-1.88,3.82,;-3.42,3.82,;-3.9,5.28,;-5.37,5.76,;-5.84,7.22,;-7.38,7.22,;-7.86,5.76,;-9.32,5.28,;-6.61,4.85,)|

BDBM456800

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cnc3ccccn23)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.78,8.06,;-5.44,7.29,;-4.11,8.06,;-4.11,9.6,;-2.78,10.37,;-1.44,9.6,;-1.44,8.06,;-.11,7.29,;1.22,8.06,;-2.78,7.29,;-2.78,5.75,;-1.53,4.85,;-.07,5.32,;1.27,4.55,;-.07,3.78,;2.6,3.78,;2.6,5.32,;2.6,6.86,;3.94,4.55,;3.94,3.01,;5.27,5.32,;5.43,6.85,;6.94,7.17,;7.71,5.84,;9.21,5.52,;9.69,4.06,;8.66,2.91,;7.15,3.23,;6.68,4.7,;-2.01,3.38,;-3.55,3.38,;-4.02,4.85,;-5.49,5.32,;-5.96,6.79,;-7.5,6.79,;-7.98,5.32,;-9.44,4.85,;-6.73,4.42,)|

BDBM456801

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1cn2ccccc2n1 |r,wU:3.3,wD:2.1,(4.76,3.75,;3.43,4.52,;3.43,6.06,;2.09,6.83,;2.09,8.37,;.76,6.06,;-.58,5.29,;2.09,5.29,;-.58,6.83,;-2.04,6.36,;-2.52,4.89,;-4.06,4.89,;-4.53,6.36,;-6,6.83,;-6.47,8.3,;-8.01,8.3,;-8.49,6.83,;-9.95,6.36,;-7.24,5.93,;-3.29,7.26,;-3.29,8.8,;-4.62,9.57,;-5.95,8.8,;-7.29,9.57,;-4.62,11.11,;-3.29,11.88,;-1.95,11.11,;-1.95,9.57,;-.62,8.8,;.72,9.57,;4.76,6.83,;4.92,8.36,;6.43,8.68,;7.2,10.02,;8.74,10.02,;9.51,8.68,;8.74,7.35,;7.2,7.35,;6.17,6.2,)|

BDBM456802

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cn3ccccc3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-7,9.41,;-5.67,8.64,;-4.34,9.41,;-4.34,10.95,;-3,11.72,;-1.67,10.95,;-1.67,9.41,;-.33,8.64,;1,9.41,;-3,8.64,;-3,7.1,;-1.76,6.19,;-.29,6.67,;1.04,5.9,;-.29,5.13,;2.38,5.13,;2.38,6.67,;2.38,8.21,;3.71,5.9,;3.71,4.36,;5.04,6.67,;5.2,8.2,;6.71,8.52,;7.48,9.85,;9.02,9.85,;9.79,8.52,;9.02,7.19,;7.48,7.19,;6.45,6.04,;-2.23,4.73,;-3.77,4.73,;-4.25,6.19,;-5.71,6.67,;-6.19,8.13,;-7.73,8.13,;-8.2,6.67,;-9.67,6.19,;-6.96,5.76,)|

BDBM456803

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cc3OCCCn3n2)nnc1-c1ccc(C)o1 |r,wU:18.19,16.17,(-6.94,8.74,;-5.61,7.97,;-4.28,8.74,;-4.28,10.28,;-2.94,11.05,;-1.61,10.28,;-1.61,8.74,;-.27,7.97,;1.06,8.74,;-2.94,7.97,;-2.94,6.43,;-1.7,5.52,;-.23,6,;1.1,5.23,;-.23,4.46,;2.44,4.46,;2.44,6,;2.44,7.54,;3.77,5.23,;3.77,3.69,;5.1,6,;5.26,7.53,;6.77,7.85,;7.54,9.19,;9.08,9.19,;9.85,7.85,;9.08,6.52,;7.54,6.52,;6.51,5.37,;-2.17,4.06,;-3.71,4.06,;-4.19,5.52,;-5.65,6,;-6.13,7.47,;-7.67,7.47,;-8.14,6,;-9.61,5.52,;-6.9,5.1,)|

BDBM456804

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cscn2)nnc1-c1ccc(C)o1 |r,wU:18.19,16.17,(-5.91,8.15,;-4.58,7.38,;-3.24,8.15,;-3.24,9.69,;-1.91,10.46,;-.57,9.69,;-.57,8.15,;.76,7.38,;2.09,8.15,;-1.91,7.38,;-1.91,5.84,;-.66,4.94,;.8,5.41,;2.14,4.64,;.8,3.87,;3.47,3.87,;3.47,5.41,;3.47,6.95,;4.8,4.64,;4.8,3.1,;6.14,5.41,;6.3,6.95,;7.8,7.27,;8.57,5.93,;7.54,4.79,;-1.14,3.47,;-2.68,3.47,;-3.15,4.94,;-4.62,5.41,;-5.09,6.88,;-6.63,6.88,;-7.11,5.41,;-8.57,4.94,;-5.86,4.51,)|

BDBM456805

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncn3ccccc23)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-5.91,8.31,;-4.58,7.54,;-3.24,8.31,;-3.24,9.85,;-1.91,10.62,;-.57,9.85,;-.57,8.31,;.76,7.54,;2.09,8.31,;-1.91,7.54,;-1.91,6,;-.66,5.1,;.8,5.58,;2.14,4.81,;.8,4.04,;3.47,4.04,;3.47,5.58,;3.47,7.12,;4.8,4.81,;4.8,3.27,;6.14,5.58,;7.54,4.95,;8.57,6.09,;7.8,7.43,;8.28,8.89,;7.25,10.04,;5.74,9.72,;5.27,8.25,;6.3,7.11,;-1.14,3.64,;-2.68,3.64,;-3.15,5.1,;-4.62,5.58,;-5.09,7.04,;-6.63,7.04,;-7.11,5.58,;-8.57,5.1,;-5.86,4.67,)|

BDBM456806

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cn(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-5.84,-3.01,;-4.51,-3.78,;-3.17,-3.01,;-3.17,-1.47,;-1.84,-.7,;-.51,-1.47,;-.51,-3.01,;.83,-3.78,;2.16,-3.01,;-1.84,-3.78,;-1.84,-5.32,;-.59,-6.23,;.87,-5.75,;2.21,-6.52,;.87,-7.29,;3.54,-7.29,;3.54,-5.75,;3.54,-4.21,;4.87,-6.52,;4.87,-8.06,;6.21,-5.75,;6.37,-4.22,;7.87,-3.9,;8.5,-2.5,;8.64,-5.24,;7.61,-6.38,;-1.07,-7.69,;-2.61,-7.69,;-3.09,-6.23,;-4.55,-5.75,;-5.03,-4.29,;-6.57,-4.29,;-7.04,-5.75,;-8.51,-6.23,;-5.8,-6.66,)|

BDBM456807

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.67,-3.08,;-5.34,-3.85,;-4.01,-3.08,;-4.01,-1.54,;-2.67,-.77,;-1.34,-1.54,;-1.34,-3.08,;-.01,-3.85,;1.33,-3.08,;-2.67,-3.85,;-2.67,-5.39,;-1.43,-6.3,;.04,-5.82,;1.37,-6.59,;.04,-7.36,;2.7,-7.36,;2.7,-5.82,;2.7,-4.28,;4.04,-6.59,;4.04,-8.13,;5.37,-5.82,;5.53,-4.29,;7.04,-3.97,;7.81,-5.3,;9.34,-5.46,;6.78,-6.45,;-1.9,-7.76,;-3.44,-7.76,;-3.92,-6.3,;-5.38,-5.82,;-5.86,-4.36,;-7.4,-4.36,;-7.88,-5.82,;-9.34,-6.3,;-6.63,-6.73,)|

BDBM456808

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cn3ccccc3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-7.01,-2.83,;-5.68,-3.6,;-4.35,-2.83,;-4.35,-1.29,;-3.01,-.52,;-1.68,-1.29,;-1.68,-2.83,;-.34,-3.6,;.99,-2.83,;-3.01,-3.6,;-3.01,-5.14,;-1.77,-6.04,;-.3,-5.57,;1.03,-6.34,;-.3,-7.11,;2.37,-7.11,;2.37,-5.57,;2.37,-4.03,;3.7,-6.34,;3.7,-7.88,;5.03,-5.57,;5.19,-4.04,;6.7,-3.72,;7.47,-2.38,;9.01,-2.38,;9.78,-3.72,;9.01,-5.05,;7.47,-5.05,;6.44,-6.19,;-2.24,-7.51,;-3.78,-7.51,;-4.26,-6.04,;-5.72,-5.57,;-6.2,-4.1,;-7.74,-4.1,;-8.21,-5.57,;-9.68,-6.04,;-6.97,-6.47,)|

BDBM456809

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cc3ccccn3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-7.06,-2.83,;-5.73,-3.6,;-4.4,-2.83,;-4.4,-1.29,;-3.06,-.52,;-1.73,-1.29,;-1.73,-2.83,;-.4,-3.6,;.94,-2.83,;-3.06,-3.6,;-3.06,-5.14,;-1.82,-6.04,;-.35,-5.57,;.98,-6.34,;-.35,-7.11,;2.32,-7.11,;2.32,-5.57,;2.32,-4.03,;3.65,-6.34,;3.65,-7.88,;4.98,-5.57,;5.14,-4.04,;6.65,-3.72,;7.42,-2.38,;8.96,-2.38,;9.73,-3.72,;8.96,-5.05,;7.42,-5.05,;6.39,-6.19,;-2.29,-7.51,;-3.83,-7.51,;-4.31,-6.04,;-5.77,-5.57,;-6.25,-4.1,;-7.79,-4.1,;-8.27,-5.57,;-9.73,-6.04,;-7.02,-6.47,)|

BDBM456810

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC)c1cn2ccccc2n1 |r,wU:3.3,2.1,(4.98,-8.26,;3.65,-7.49,;3.65,-5.95,;2.32,-5.18,;2.32,-3.64,;.98,-5.95,;-.35,-6.72,;2.32,-6.72,;-.35,-5.18,;-1.82,-5.66,;-2.29,-7.12,;-3.83,-7.12,;-4.31,-5.66,;-5.77,-5.18,;-6.25,-3.72,;-7.79,-3.72,;-8.26,-5.18,;-9.73,-5.66,;-7.02,-6.09,;-3.06,-4.75,;-3.06,-3.21,;-4.4,-2.44,;-5.73,-3.21,;-7.06,-2.44,;-4.4,-.9,;-3.06,-.13,;-1.73,-.9,;-1.73,-2.44,;-.4,-3.21,;.94,-2.44,;4.98,-5.18,;5.14,-3.65,;6.65,-3.33,;7.42,-2,;8.96,-2,;9.73,-3.33,;8.96,-4.66,;7.42,-4.66,;6.39,-5.81,)|

BDBM456811

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncn3ccccc23)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-5.97,-3.01,;-4.63,-3.78,;-3.3,-3.01,;-3.3,-1.47,;-1.97,-.7,;-.63,-1.47,;-.63,-3.01,;.7,-3.78,;2.03,-3.01,;-1.97,-3.78,;-1.97,-5.32,;-.72,-6.23,;.74,-5.75,;2.08,-6.52,;.74,-7.29,;3.41,-7.29,;3.41,-5.75,;3.41,-4.21,;4.74,-6.52,;4.74,-8.06,;6.08,-5.75,;7.49,-6.38,;8.52,-5.24,;7.75,-3.9,;8.22,-2.44,;7.19,-1.29,;5.68,-1.61,;5.21,-3.08,;6.24,-4.22,;-1.2,-7.69,;-2.74,-7.69,;-3.21,-6.23,;-4.68,-5.75,;-5.15,-4.29,;-6.69,-4.29,;-7.17,-5.75,;-8.63,-6.23,;-5.92,-6.66,)|

BDBM456812

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cn3ccccc3n2)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-7.06,-2.83,;-5.73,-3.6,;-4.4,-2.83,;-4.4,-1.29,;-3.06,-.52,;-1.73,-1.29,;-1.73,-2.83,;-.4,-3.6,;.94,-2.83,;-3.06,-3.6,;-3.06,-5.14,;-1.82,-6.04,;-.35,-5.57,;.98,-6.34,;-.35,-7.11,;2.32,-7.11,;2.32,-5.57,;2.32,-4.03,;3.65,-6.34,;3.65,-7.88,;4.98,-5.57,;5.14,-4.04,;6.65,-3.72,;7.42,-2.38,;8.96,-2.38,;9.73,-3.72,;8.96,-5.05,;7.42,-5.05,;6.39,-6.19,;-2.29,-7.51,;-3.83,-7.51,;-4.31,-6.04,;-5.77,-5.57,;-6.25,-4.1,;-7.79,-4.1,;-8.27,-5.57,;-9.73,-6.04,;-7.02,-6.47,)|

BDBM456813

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cc3OCCCn3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-7.02,-12.56,;-5.68,-13.33,;-4.35,-12.56,;-4.35,-11.02,;-3.02,-10.25,;-1.68,-11.02,;-1.68,-12.56,;-.35,-13.33,;.98,-12.56,;-3.02,-13.33,;-3.02,-14.87,;-1.77,-15.78,;-.31,-15.3,;1.03,-16.07,;-.31,-16.84,;2.36,-16.84,;2.36,-15.3,;2.36,-13.76,;3.7,-16.07,;3.7,-17.61,;5.03,-15.3,;5.19,-13.77,;6.7,-13.45,;7.47,-12.12,;9.01,-12.12,;9.78,-13.45,;9.01,-14.78,;7.47,-14.78,;6.44,-15.93,;-2.25,-17.24,;-3.79,-17.24,;-4.26,-15.78,;-5.73,-15.3,;-6.2,-13.84,;-7.74,-13.84,;-8.22,-15.3,;-9.68,-15.78,;-6.97,-16.21,)|

BDBM456814

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccnc3CCCOc23)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.69,-3.13,;-5.36,-3.9,;-4.02,-3.13,;-4.02,-1.59,;-2.69,-.82,;-1.36,-1.59,;-1.36,-3.13,;-.02,-3.9,;1.31,-3.13,;-2.69,-3.9,;-2.69,-5.44,;-1.44,-6.34,;.02,-5.87,;1.35,-6.64,;.02,-7.41,;2.69,-7.41,;2.69,-5.87,;2.69,-4.33,;4.02,-6.64,;4.02,-8.18,;5.36,-5.87,;5.36,-4.33,;6.69,-3.56,;8.02,-4.33,;8.02,-5.87,;9.36,-6.64,;9.36,-8.18,;8.02,-8.95,;6.69,-8.18,;6.69,-6.64,;-1.92,-7.81,;-3.46,-7.81,;-3.94,-6.34,;-5.4,-5.87,;-5.88,-4.4,;-7.42,-4.4,;-7.89,-5.87,;-9.36,-6.34,;-6.65,-6.77,)|

BDBM456815

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cc3OCCCn3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-7.06,-2.83,;-5.73,-3.6,;-4.4,-2.83,;-4.4,-1.29,;-3.06,-.52,;-1.73,-1.29,;-1.73,-2.83,;-.4,-3.6,;.94,-2.83,;-3.06,-3.6,;-3.06,-5.14,;-1.82,-6.04,;-.35,-5.57,;.98,-6.34,;-.35,-7.11,;2.32,-7.11,;2.32,-5.57,;2.32,-4.03,;3.65,-6.34,;3.65,-7.88,;4.98,-5.57,;5.14,-4.04,;6.65,-3.72,;7.42,-2.38,;8.96,-2.38,;9.73,-3.72,;8.96,-5.05,;7.42,-5.05,;6.39,-6.19,;-2.29,-7.51,;-3.83,-7.51,;-4.31,-6.04,;-5.77,-5.57,;-6.25,-4.1,;-7.79,-4.1,;-8.27,-5.57,;-9.73,-6.04,;-7.02,-6.47,)|

BDBM456816

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccnc3CCCOc23)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.69,-3.13,;-5.36,-3.9,;-4.02,-3.13,;-4.02,-1.59,;-2.69,-.82,;-1.36,-1.59,;-1.36,-3.13,;-.02,-3.9,;1.31,-3.13,;-2.69,-3.9,;-2.69,-5.44,;-1.44,-6.34,;.02,-5.87,;1.35,-6.64,;.02,-7.41,;2.69,-7.41,;2.69,-5.87,;2.69,-4.33,;4.02,-6.64,;4.02,-8.18,;5.36,-5.87,;5.36,-4.33,;6.69,-3.56,;8.02,-4.33,;8.02,-5.87,;9.36,-6.64,;9.36,-8.18,;8.02,-8.95,;6.69,-8.18,;6.69,-6.64,;-1.92,-7.81,;-3.46,-7.81,;-3.94,-6.34,;-5.4,-5.87,;-5.88,-4.4,;-7.42,-4.4,;-7.89,-5.87,;-9.36,-6.34,;-6.65,-6.77,)|

BDBM456817

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cnc3ccccn23)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.9,-3.09,;-5.57,-3.86,;-4.23,-3.09,;-4.23,-1.55,;-2.9,-.78,;-1.57,-1.55,;-1.57,-3.09,;-.23,-3.86,;1.1,-3.09,;-2.9,-3.86,;-2.9,-5.4,;-1.65,-6.31,;-.19,-5.83,;1.15,-6.6,;-.19,-7.37,;2.48,-7.37,;2.48,-5.83,;2.48,-4.29,;3.81,-6.6,;3.81,-8.14,;5.15,-5.83,;5.31,-4.3,;6.81,-3.98,;7.58,-5.31,;9.09,-5.63,;9.57,-7.1,;8.54,-8.24,;7.03,-7.92,;6.55,-6.46,;-2.13,-7.77,;-3.67,-7.77,;-4.14,-6.31,;-5.61,-5.83,;-6.09,-4.37,;-7.63,-4.37,;-8.1,-5.83,;-9.57,-6.31,;-6.86,-6.74,)|

BDBM456818

COc1ccccc1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:14.15,(1.75,-2.66,;.41,-3.43,;-.92,-2.66,;-.92,-1.12,;-2.26,-.35,;-3.59,-1.12,;-3.59,-2.66,;-2.26,-3.43,;-2.26,-5.11,;-1.01,-6.02,;.32,-5.25,;1.66,-6.02,;.89,-7.35,;2.43,-7.35,;2.99,-5.25,;2.99,-3.71,;4.33,-6.02,;5.66,-5.25,;6.99,-6.02,;8.33,-5.25,;8.33,-3.71,;9.66,-2.94,;6.99,-2.94,;5.66,-3.71,;-1.49,-7.48,;-3.03,-7.48,;-3.5,-6.02,;-4.87,-5.43,;-5.35,-3.96,;-6.89,-3.96,;-7.36,-5.43,;-8.83,-5.91,;-6.12,-6.33,)|

BDBM456819

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cccc3ccnn23)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.16,-2.68,;-4.83,-3.45,;-3.5,-2.68,;-3.5,-1.14,;-2.16,-.37,;-.83,-1.14,;-.83,-2.68,;.5,-3.45,;1.84,-2.68,;-2.16,-3.45,;-2.16,-5.13,;-.92,-6.03,;.42,-5.26,;1.75,-6.03,;.42,-6.8,;3.08,-6.8,;3.08,-5.26,;3.08,-3.72,;4.42,-6.03,;4.42,-7.57,;5.75,-5.26,;5.75,-3.72,;7.09,-2.95,;8.42,-3.72,;8.42,-5.26,;9.56,-6.3,;8.94,-7.7,;7.41,-7.54,;7.09,-6.03,;-1.39,-7.5,;-2.93,-7.5,;-3.41,-6.03,;-4.78,-5.45,;-5.25,-3.98,;-6.79,-3.98,;-7.27,-5.45,;-8.73,-5.92,;-6.02,-6.35,)|

BDBM456820

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2nccn2C)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-5.43,-2.76,;-4.1,-3.53,;-2.77,-2.76,;-2.77,-1.22,;-1.43,-.45,;-.1,-1.22,;-.1,-2.76,;1.23,-3.53,;2.57,-2.76,;-1.43,-3.53,;-1.43,-5.21,;-.19,-6.12,;1.15,-5.35,;2.48,-6.12,;1.15,-6.89,;3.81,-6.89,;3.81,-5.35,;3.81,-3.81,;5.15,-6.12,;5.15,-7.66,;6.48,-5.35,;7.95,-5.82,;8.85,-4.58,;7.95,-3.33,;6.48,-3.81,;5.15,-3.04,;-.66,-7.58,;-2.2,-7.58,;-2.68,-6.12,;-4.05,-5.53,;-4.52,-4.06,;-6.06,-4.06,;-6.54,-5.53,;-8.01,-6,;-5.29,-6.43,)|

BDBM456821

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cscn2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-5.53,-2.77,;-4.2,-3.54,;-2.86,-2.77,;-2.86,-1.23,;-1.53,-.46,;-.2,-1.23,;-.2,-2.77,;1.14,-3.54,;2.47,-2.77,;-1.53,-3.54,;-1.53,-5.22,;-.28,-6.13,;1.05,-5.36,;2.38,-6.13,;1.05,-6.9,;3.72,-6.9,;3.72,-5.36,;3.72,-3.82,;5.05,-6.13,;5.05,-7.67,;6.38,-5.36,;6.38,-3.82,;7.85,-3.34,;8.75,-4.59,;7.85,-5.83,;-.76,-7.59,;-2.3,-7.59,;-2.78,-6.13,;-4.15,-5.54,;-4.62,-4.07,;-6.16,-4.07,;-6.64,-5.54,;-8.1,-6.01,;-5.39,-6.44,)|

BDBM456822

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cccc3nccn23)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.16,-2.74,;-4.82,-3.51,;-3.49,-2.74,;-3.49,-1.2,;-2.16,-.43,;-.82,-1.2,;-.82,-2.74,;.51,-3.51,;1.84,-2.74,;-2.16,-3.51,;-2.16,-5.19,;-.91,-6.1,;.42,-5.33,;1.76,-6.1,;.42,-6.87,;3.09,-6.87,;3.09,-5.33,;3.09,-3.79,;4.42,-6.1,;4.42,-7.64,;5.76,-5.33,;5.76,-3.79,;7.09,-3.02,;8.42,-3.79,;8.42,-5.33,;9.57,-6.36,;8.94,-7.77,;7.41,-7.6,;7.09,-6.1,;-1.39,-7.56,;-2.93,-7.56,;-3.4,-6.1,;-4.77,-5.51,;-5.25,-4.04,;-6.79,-4.04,;-7.26,-5.51,;-8.73,-5.98,;-6.02,-6.41,)|

BDBM456823

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-6.12,-2.78,;-4.79,-3.55,;-3.45,-2.78,;-3.45,-1.24,;-2.12,-.47,;-.79,-1.24,;-.79,-2.78,;.55,-3.55,;1.88,-2.78,;-2.12,-3.55,;-2.12,-5.24,;-.87,-6.14,;.46,-5.37,;1.79,-6.14,;.46,-6.91,;3.13,-6.91,;3.13,-5.37,;3.13,-3.83,;4.46,-6.14,;4.46,-7.68,;5.79,-5.37,;5.79,-3.83,;7.26,-3.36,;8.16,-4.6,;9.7,-4.6,;7.26,-5.85,;-1.35,-7.61,;-2.89,-7.61,;-3.37,-6.14,;-4.74,-5.55,;-5.21,-4.09,;-6.75,-4.09,;-7.23,-5.55,;-8.69,-6.03,;-5.98,-6.46,)|

BDBM456824

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2cn(C)cn2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-6.41,5.36,;-5.08,4.59,;-3.74,5.36,;-3.74,6.9,;-2.41,7.67,;-1.08,6.9,;-1.08,5.36,;.26,4.59,;1.59,5.36,;-2.41,4.59,;-2.41,2.91,;-1.16,2,;.17,2.77,;1.5,2,;.17,1.23,;2.84,1.23,;2.84,2.77,;2.84,4.31,;4.17,2,;4.17,.46,;5.5,2.77,;5.5,4.31,;6.97,4.79,;7.45,6.26,;7.87,3.54,;6.97,2.3,;-1.64,.54,;-3.18,.54,;-3.66,2,;-5.03,2.59,;-5.5,4.06,;-7.04,4.06,;-7.52,2.59,;-8.98,2.12,;-6.27,1.69,)|

BDBM456825

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccnc3CCCOc23)nnc1-c1ccc(C)o1 |r,wD:16.17,18.19,(-7.15,5.98,;-5.82,5.21,;-4.49,5.98,;-4.49,7.52,;-3.15,8.29,;-1.82,7.52,;-1.82,5.98,;-.49,5.21,;.85,5.98,;-3.15,5.21,;-3.15,3.53,;-1.91,2.62,;-.57,3.39,;.76,2.62,;-.57,1.85,;2.09,1.85,;2.09,3.39,;2.09,4.93,;3.43,2.62,;3.43,1.08,;4.76,3.39,;4.76,4.93,;6.1,5.7,;7.43,4.93,;7.43,3.39,;8.76,2.62,;8.76,1.08,;7.43,.31,;6.1,1.08,;6.1,2.62,;-2.38,1.16,;-3.92,1.16,;-4.4,2.62,;-5.77,3.21,;-6.24,4.68,;-7.78,4.68,;-8.26,3.21,;-9.72,2.74,;-7.01,2.31,)|

BDBM456826

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.25,-2.79,;-4.91,-3.56,;-3.58,-2.79,;-3.58,-1.25,;-2.25,-.48,;-.91,-1.25,;-.91,-2.79,;.42,-3.56,;1.75,-2.79,;-2.25,-3.56,;-2.25,-5.24,;-1,-6.15,;.33,-5.38,;1.67,-6.15,;.33,-6.92,;3,-6.92,;3,-5.38,;3,-3.84,;4.33,-6.15,;4.33,-7.69,;5.67,-5.38,;5.67,-3.84,;7.13,-3.36,;8.04,-4.61,;9.58,-4.61,;7.13,-5.86,;-1.48,-7.61,;-3.02,-7.61,;-3.49,-6.15,;-4.86,-5.56,;-5.34,-4.1,;-6.88,-4.1,;-7.36,-5.56,;-8.82,-6.04,;-6.11,-6.47,)|

BDBM456827

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cc3ccccn3n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.8,-2.62,;-5.46,-3.39,;-4.13,-2.62,;-4.13,-1.08,;-2.8,-.31,;-1.46,-1.08,;-1.46,-2.62,;-.13,-3.39,;1.2,-2.62,;-2.8,-3.39,;-2.8,-5.08,;-1.55,-5.98,;-.22,-5.21,;1.12,-5.98,;-.22,-6.75,;2.45,-6.75,;2.45,-5.21,;2.45,-3.67,;3.78,-5.98,;3.78,-7.52,;5.12,-5.21,;5.28,-3.68,;6.78,-3.36,;7.55,-2.03,;9.09,-2.03,;9.86,-3.36,;9.09,-4.69,;7.55,-4.69,;6.52,-5.84,;-2.03,-7.45,;-3.57,-7.45,;-4.04,-5.98,;-5.41,-5.39,;-5.89,-3.93,;-7.43,-3.93,;-7.9,-5.39,;-9.37,-5.87,;-6.66,-6.3,)|

BDBM456828

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2cscn2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(3.03,-1.9,;1.94,-2.99,;.45,-2.59,;.05,-1.1,;-1.44,-.7,;-2.53,-1.79,;-2.13,-3.28,;-3.22,-4.37,;-4.7,-3.97,;-.64,-3.68,;-.24,-5.17,;1.22,-5.64,;2.56,-4.87,;3.89,-5.64,;5.22,-6.41,;3.12,-6.98,;4.66,-4.31,;3.89,-2.98,;6.2,-4.31,;6.97,-5.64,;6.97,-2.98,;6.5,-1.51,;7.74,-.61,;8.99,-1.51,;8.51,-2.98,;1.22,-7.18,;-.24,-7.66,;-1.15,-6.41,;-2.63,-6.01,;-3.54,-4.77,;-5,-5.24,;-5,-6.78,;-6.34,-7.55,;-3.54,-7.26,)|

BDBM456829

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cccc3nccn23)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.09,-2.75,;-4.76,-3.52,;-3.43,-2.75,;-3.43,-1.21,;-2.09,-.44,;-.76,-1.21,;-.76,-2.75,;.58,-3.52,;1.91,-2.75,;-2.09,-3.52,;-2.09,-5.2,;-.85,-6.11,;.49,-5.34,;1.82,-6.11,;.49,-6.88,;3.15,-6.88,;3.15,-5.34,;3.15,-3.8,;4.49,-6.11,;4.49,-7.65,;5.82,-5.34,;5.82,-3.8,;7.16,-3.03,;8.49,-3.8,;8.49,-5.34,;9.63,-6.37,;9.01,-7.77,;7.48,-7.61,;7.16,-6.11,;-1.32,-7.57,;-2.86,-7.57,;-3.34,-6.11,;-4.71,-5.52,;-5.18,-4.05,;-6.72,-4.05,;-7.2,-5.52,;-8.66,-5.99,;-5.95,-6.42,)|

BDBM456830

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cscn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-5.53,-2.77,;-4.2,-3.54,;-2.86,-2.77,;-2.86,-1.23,;-1.53,-.46,;-.2,-1.23,;-.2,-2.77,;1.14,-3.54,;2.47,-2.77,;-1.53,-3.54,;-1.53,-5.22,;-.28,-6.13,;1.05,-5.36,;2.38,-6.13,;1.05,-6.9,;3.72,-6.9,;3.72,-5.36,;3.72,-3.82,;5.05,-6.13,;5.05,-7.67,;6.38,-5.36,;6.38,-3.82,;7.85,-3.34,;8.75,-4.59,;7.85,-5.83,;-.76,-7.59,;-2.3,-7.59,;-2.78,-6.13,;-4.15,-5.54,;-4.62,-4.07,;-6.16,-4.07,;-6.64,-5.54,;-8.1,-6.01,;-5.39,-6.44,)|

BDBM456831

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2cn3ccccc3n2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.17,(-6.8,-2.62,;-5.46,-3.39,;-4.13,-2.62,;-4.13,-1.08,;-2.8,-.31,;-1.46,-1.08,;-1.46,-2.62,;-.13,-3.39,;1.2,-2.62,;-2.8,-3.39,;-2.8,-5.08,;-1.55,-5.98,;-.22,-5.21,;1.12,-5.98,;-.22,-6.75,;2.45,-6.75,;2.45,-5.21,;2.45,-3.67,;3.78,-5.98,;3.78,-7.52,;5.12,-5.21,;5.28,-3.68,;6.78,-3.36,;7.55,-2.03,;9.09,-2.03,;9.86,-3.36,;9.09,-4.69,;7.55,-4.69,;6.52,-5.84,;-2.03,-7.45,;-3.57,-7.45,;-4.04,-5.98,;-5.41,-5.39,;-5.89,-3.93,;-7.43,-3.93,;-7.9,-5.39,;-9.37,-5.87,;-6.66,-6.3,)|

BDBM456833

COc1ccccc1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccco1 |r,wD:14.15,(1.25,-4.49,;-.08,-5.26,;-1.42,-4.49,;-1.42,-2.95,;-2.75,-2.18,;-4.08,-2.95,;-4.08,-4.49,;-2.75,-5.26,;-2.75,-6.8,;-1.5,-7.7,;-.04,-7.23,;1.11,-8.26,;.34,-9.59,;1.88,-9.59,;2.44,-7.49,;2.44,-5.95,;3.77,-8.26,;5.11,-7.49,;6.44,-8.26,;7.77,-7.49,;7.77,-5.95,;9.11,-5.18,;6.44,-5.18,;5.11,-5.95,;-1.98,-9.17,;-3.52,-9.17,;-4,-7.7,;-5.46,-7.23,;-5.94,-5.76,;-7.48,-5.76,;-7.95,-7.23,;-6.71,-8.13,)|

BDBM456834

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)C2(O)COC2)nnc1-c1ccc(C)o1 |wU:16.17,(-17,6.72,;-15.47,6.8,;-14.63,5.51,;-15.33,4.14,;-14.49,2.85,;-12.95,2.93,;-12.25,4.3,;-10.71,4.38,;-9.87,3.09,;-13.09,5.59,;-12.39,6.96,;-10.87,7.2,;-9.78,6.11,;-8.29,6.51,;-8.69,8,;-7.89,5.03,;-6.81,6.91,;-6.41,8.4,;-5.72,5.82,;-4.63,6.91,;-4.63,4.73,;-5.72,3.65,;-6.81,4.73,;-10.63,8.72,;-12,9.42,;-13.09,8.34,;-14.61,8.58,;-15.7,7.49,;-17.07,8.19,;-16.83,9.71,;-17.92,10.8,;-15.31,9.95,)|

BDBM456835

C[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccco2)n1-c1ccccc1F |r,wD:1.0,(2.86,-7.7,;3.63,-9.03,;5.17,-9.03,;5.94,-7.7,;5.17,-6.36,;5.94,-5.03,;7.48,-5.03,;8.25,-3.7,;8.25,-6.36,;7.48,-7.7,;2.86,-10.36,;4.19,-11.13,;2.09,-11.7,;1.52,-9.59,;.19,-10.36,;.03,-11.9,;-1.48,-12.22,;-2.25,-10.88,;-3.78,-10.72,;-4.55,-9.39,;-6.06,-9.71,;-6.22,-11.24,;-4.81,-11.87,;-1.22,-9.74,;-1.54,-8.23,;-3,-7.76,;-3.32,-6.25,;-2.18,-5.22,;-.71,-5.69,;-.39,-7.2,;1.07,-7.68,)|

BDBM456836

C[C@H](Cc1ncc(F)cn1)S(=O)(=O)N\C(NNC(=O)c1ccco1)=N/C1CCCCC1 |r|

BDBM456837

C[C@H](Cc1ncc(F)cn1)S(=O)(=O)N\C(NNC(=O)c1ccco1)=N/c1cccc2ccccc12 |r|

BDBM456838

COc1ccc(\N=C(\NNC(=O)c2ccco2)NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)c(OC)c1 |r|

BDBM456839

C[C@@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1C1CCCC1 |r|

BDBM456840

C[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1C1CCOCC1 |r|

BDBM456841

C[C@H](Cc1ncc(F)cn1)S(=O)(=O)N\C(NNC(=O)c1ccco1)=N/c1ccccc1C(F)(F)F |r|

BDBM456842

C[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1C1CC1 |r|

BDBM456843

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2cc(ccn2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.16,18.19,(-8.93,7.76,;-7.59,6.99,;-6.26,7.76,;-6.26,9.3,;-4.93,10.07,;-3.59,9.3,;-3.59,7.76,;-2.26,6.99,;-.93,7.76,;-4.93,6.99,;-4.93,5.09,;-3.68,4.18,;-2.35,4.95,;-1.01,4.18,;-1.78,2.85,;-.24,2.85,;.32,4.95,;.32,6.49,;1.65,7.26,;1.65,8.8,;2.99,6.49,;2.99,4.95,;1.65,4.18,;4.32,4.18,;5.65,4.95,;7.26,4.3,;6.99,2.64,;5.65,1.87,;4.32,2.64,;8.7,5.11,;10.14,5.92,;-4.16,2.72,;-5.7,2.72,;-6.17,4.18,;-7.51,4.95,;-7.98,6.42,;-9.52,6.42,;-10,4.95,;-11.33,4.18,;-8.75,4.05,)|

BDBM456844

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2cncc(n2)C#N)nnc1-c1ccc(C)o1 |r,wU:16.16,18.19,(-8.97,8.21,;-7.64,7.44,;-6.31,8.21,;-6.31,9.75,;-4.97,10.52,;-3.64,9.75,;-3.64,8.21,;-2.3,7.44,;-.97,8.21,;-4.97,7.44,;-4.97,5.53,;-3.73,4.63,;-2.39,5.4,;-1.06,4.63,;-1.83,3.3,;-.29,3.3,;.27,5.4,;.27,6.94,;1.61,7.71,;1.61,9.25,;2.94,6.94,;2.94,5.4,;1.61,4.63,;4.28,4.63,;4.28,3.09,;5.61,2.32,;6.94,3.09,;7.21,4.75,;5.61,5.4,;8.66,5.56,;10.1,6.36,;-4.2,3.16,;-5.74,3.16,;-6.22,4.63,;-7.55,5.4,;-8.03,6.86,;-9.57,6.86,;-10.04,5.4,;-11.38,4.63,;-8.8,4.49,)|

BDBM456845

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2cnc(Cl)c(c2)C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-8.1,-3.9,;-6.77,-4.67,;-5.43,-3.9,;-5.43,-2.36,;-4.1,-1.59,;-2.76,-2.36,;-2.76,-3.9,;-1.43,-4.67,;-.1,-3.9,;-4.1,-4.67,;-4.1,-6.57,;-2.85,-7.47,;-1.52,-6.7,;-.19,-7.47,;-.95,-8.81,;.58,-8.81,;1.15,-6.7,;1.15,-5.16,;2.48,-4.39,;2.48,-2.85,;3.82,-5.16,;3.82,-6.7,;2.48,-7.47,;5.15,-7.47,;5.15,-9.01,;6.48,-9.78,;7.82,-9.01,;9.15,-9.78,;7.88,-7.4,;6.48,-6.7,;9.2,-6.61,;10.53,-5.83,;-3.33,-8.94,;-4.87,-8.94,;-5.34,-7.47,;-6.68,-6.7,;-7.15,-5.24,;-8.69,-5.24,;-9.17,-6.7,;-10.5,-7.47,;-7.92,-7.61,)|

BDBM456846

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.24,-4.31,;-5.9,-5.08,;-4.57,-4.31,;-4.57,-2.77,;-3.23,-2,;-1.9,-2.77,;-1.9,-4.31,;-.57,-5.08,;.77,-4.31,;-3.23,-5.08,;-3.23,-6.98,;-1.99,-7.88,;-.66,-7.11,;.68,-7.88,;-.09,-9.22,;1.45,-9.22,;2.01,-7.11,;2.01,-5.57,;3.35,-4.8,;3.35,-3.26,;4.68,-5.57,;4.68,-7.11,;3.35,-7.88,;6.01,-7.88,;6.01,-9.42,;7.35,-10.19,;8.68,-9.42,;10.02,-10.19,;8.68,-7.88,;7.35,-7.11,;-2.46,-9.35,;-4.01,-9.35,;-4.48,-7.88,;-5.81,-7.11,;-6.29,-5.65,;-7.83,-5.65,;-8.31,-7.11,;-9.64,-7.88,;-7.06,-8.02,)|

BDBM456847

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CNC[C@@H](O)C2)nnc1-c1ccc(C)o1 |r,wD:16.16,20.21,(-3.8,-4.73,;-2.46,-5.5,;-1.13,-4.73,;-1.13,-3.19,;.2,-2.42,;1.54,-3.19,;1.54,-4.73,;2.87,-5.5,;4.21,-4.73,;.2,-5.5,;.2,-7.4,;1.45,-8.31,;2.78,-7.54,;4.12,-8.31,;3.35,-9.64,;4.89,-9.64,;5.45,-7.54,;6.79,-8.31,;8.12,-7.54,;8.12,-6,;6.79,-5.23,;6.79,-3.69,;5.45,-6,;.97,-9.77,;-.57,-9.77,;-1.04,-8.31,;-2.37,-7.54,;-2.85,-6.07,;-4.39,-6.07,;-4.87,-7.54,;-6.2,-8.31,;-3.62,-8.44,)|

BDBM456848

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2cncc(c2)C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.88,-4.07,;-6.55,-4.84,;-5.21,-4.07,;-5.21,-2.53,;-3.88,-1.76,;-2.54,-2.53,;-2.54,-4.07,;-1.21,-4.84,;.12,-4.07,;-3.88,-4.84,;-3.88,-6.38,;-2.63,-7.29,;-1.14,-6.89,;-.06,-7.98,;-.83,-9.31,;.71,-9.31,;1.28,-7.21,;1.28,-5.67,;2.61,-4.9,;2.61,-3.36,;3.95,-5.67,;3.95,-7.21,;2.61,-7.98,;5.28,-7.98,;5.28,-9.52,;6.61,-10.29,;7.95,-9.52,;7.99,-7.95,;6.61,-7.21,;9.33,-7.18,;10.66,-6.41,;-3.11,-8.75,;-4.65,-8.75,;-5.12,-7.29,;-6.61,-6.89,;-7.09,-5.42,;-8.63,-5.42,;-9.1,-6.89,;-10.59,-7.29,;-7.86,-7.79,)|

BDBM456849

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2nc(C)cc(C)n2)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.06,-3.34,;-5.73,-4.11,;-4.4,-3.34,;-4.4,-1.8,;-3.06,-1.03,;-1.73,-1.8,;-1.73,-3.34,;-.4,-4.11,;.94,-3.34,;-3.06,-4.11,;-3.06,-5.65,;-1.82,-6.55,;-.33,-6.15,;.76,-7.24,;-.01,-8.58,;1.53,-8.58,;2.09,-6.47,;2.09,-4.93,;3.43,-4.16,;3.43,-2.62,;4.76,-4.93,;4.76,-6.47,;3.43,-7.24,;6.09,-7.24,;7.43,-6.47,;8.76,-7.24,;10.09,-6.47,;8.76,-8.78,;7.43,-9.55,;7.43,-11.09,;6.09,-8.78,;-2.29,-8.02,;-3.83,-8.02,;-4.31,-6.55,;-5.8,-6.15,;-6.27,-4.69,;-7.81,-4.69,;-8.29,-6.15,;-9.78,-6.55,;-7.04,-7.06,)|

BDBM456850

COc1ccnc(n1)N1C[C@@H](O)C[C@H](C1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:13.16,10.11,(10.64,-8.19,;9.31,-7.42,;7.97,-8.19,;7.97,-9.73,;6.64,-10.5,;5.3,-9.73,;5.3,-8.19,;6.64,-7.42,;3.97,-7.42,;3.97,-5.88,;2.64,-5.11,;2.64,-3.57,;1.3,-5.88,;1.3,-7.42,;2.64,-8.19,;-.03,-8.19,;-.8,-9.52,;.74,-9.52,;-1.12,-7.1,;-2.61,-7.5,;-3.08,-8.97,;-4.62,-8.97,;-5.1,-7.5,;-6.59,-7.1,;-7.06,-5.64,;-8.6,-5.64,;-9.08,-7.1,;-10.57,-7.5,;-7.83,-8.01,;-3.85,-6.6,;-3.85,-5.06,;-5.19,-4.29,;-6.52,-5.06,;-7.85,-4.29,;-5.19,-2.75,;-3.85,-1.98,;-2.52,-2.75,;-2.52,-4.29,;-1.19,-5.06,;.15,-4.29,)|

BDBM456851

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.17,-4.07,;-5.83,-4.84,;-4.5,-4.07,;-4.5,-2.53,;-3.17,-1.76,;-1.83,-2.53,;-1.83,-4.07,;-.5,-4.84,;.83,-4.07,;-3.17,-4.84,;-3.17,-6.38,;-1.92,-7.29,;-.43,-6.89,;.66,-7.98,;-.11,-9.31,;1.43,-9.31,;1.99,-7.21,;1.99,-5.67,;3.32,-4.9,;3.32,-3.36,;4.66,-5.67,;4.66,-7.21,;3.32,-7.98,;5.99,-7.98,;5.99,-9.52,;7.32,-10.29,;8.66,-9.52,;9.99,-10.29,;8.66,-7.98,;7.32,-7.21,;-2.4,-8.75,;-3.94,-8.75,;-4.41,-7.29,;-5.9,-6.89,;-6.38,-5.42,;-7.92,-5.42,;-8.39,-6.89,;-9.88,-7.29,;-7.15,-7.79,)|

BDBM456852

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ccc(F)c(c2)C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.11,-2.53,;-5.78,-3.3,;-4.45,-2.53,;-4.45,-.99,;-3.11,-.22,;-1.78,-.99,;-1.78,-2.53,;-.45,-3.3,;.89,-2.53,;-3.11,-3.3,;-3.11,-4.84,;-1.87,-5.75,;-.38,-5.35,;.71,-6.44,;-.06,-7.77,;1.48,-7.77,;2.04,-5.67,;2.04,-4.13,;3.38,-3.36,;3.38,-1.82,;4.71,-4.13,;4.71,-5.67,;3.38,-6.44,;6.04,-6.44,;7.38,-5.67,;8.71,-6.44,;8.71,-7.98,;10.04,-8.75,;7.38,-8.8,;6.04,-7.98,;7.38,-10.34,;7.38,-11.88,;-2.34,-7.21,;-3.88,-7.21,;-4.36,-5.75,;-5.85,-5.35,;-6.32,-3.88,;-7.86,-3.88,;-8.34,-5.35,;-9.83,-5.75,;-7.09,-6.25,)|

BDBM456853

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cc2C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.12,-4.07,;-5.78,-4.84,;-4.45,-4.07,;-4.45,-2.53,;-3.12,-1.76,;-1.78,-2.53,;-1.78,-4.07,;-.45,-4.84,;.89,-4.07,;-3.12,-4.84,;-3.12,-6.38,;-1.87,-7.29,;-.38,-6.89,;.71,-7.98,;-.06,-9.31,;1.48,-9.31,;2.04,-7.21,;2.04,-5.67,;3.38,-4.9,;3.38,-3.36,;4.71,-5.67,;4.71,-7.21,;3.38,-7.98,;6.04,-7.98,;6.04,-9.52,;7.38,-10.29,;8.71,-9.52,;10.04,-10.29,;8.71,-7.98,;7.38,-7.15,;7.38,-5.61,;7.38,-4.07,;-2.35,-8.75,;-3.89,-8.75,;-4.36,-7.29,;-5.85,-6.89,;-6.32,-5.42,;-7.86,-5.42,;-8.34,-6.89,;-9.83,-7.29,;-7.09,-7.79,)|

BDBM456854

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2ncc(F)cc2C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-4.99,-2.43,;-3.9,-3.52,;-2.42,-3.12,;-2.02,-1.64,;-.53,-1.24,;.56,-2.33,;.16,-3.81,;1.25,-4.9,;2.58,-4.13,;-1.33,-4.21,;-1.73,-5.7,;-.82,-6.95,;.72,-6.95,;1.49,-8.28,;1.49,-9.82,;.15,-9.05,;3.03,-8.28,;3.8,-6.95,;5.34,-6.95,;6.11,-5.61,;6.11,-8.28,;5.34,-9.61,;3.8,-9.61,;6.11,-10.95,;5.34,-12.28,;6.11,-13.61,;7.65,-13.61,;8.42,-14.95,;8.42,-12.28,;7.73,-10.83,;8.5,-9.5,;9.28,-8.17,;-1.73,-8.19,;-3.19,-7.72,;-3.19,-6.18,;-4.52,-5.41,;-5.43,-4.16,;-6.89,-4.64,;-6.89,-6.18,;-8.23,-6.95,;-5.43,-6.65,)|

BDBM456855

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:18.19,wD:16.16,(-7.14,-14.92,;-5.8,-15.69,;-4.47,-14.92,;-4.47,-13.38,;-3.14,-12.61,;-1.8,-13.38,;-1.8,-14.92,;-.47,-15.69,;.86,-14.92,;-3.14,-15.69,;-3.14,-17.23,;-1.89,-18.14,;-.4,-17.74,;.69,-18.83,;-.08,-20.16,;1.46,-20.16,;2.02,-18.06,;2.02,-16.52,;3.35,-15.75,;3.35,-14.21,;4.69,-16.52,;4.69,-18.06,;3.35,-18.83,;6.02,-18.83,;6.02,-20.37,;7.35,-21.14,;8.69,-20.37,;10.02,-21.14,;8.69,-18.83,;7.35,-18.06,;-2.37,-19.6,;-3.91,-19.6,;-4.38,-18.14,;-5.87,-17.74,;-6.35,-16.27,;-7.89,-16.27,;-8.36,-17.74,;-9.85,-18.14,;-7.12,-18.64,)|

BDBM456856

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2cc(ccn2)C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.88,-4.07,;-6.54,-4.84,;-5.21,-4.07,;-5.21,-2.53,;-3.88,-1.76,;-2.54,-2.53,;-2.54,-4.07,;-1.21,-4.84,;.12,-4.07,;-3.88,-4.84,;-3.88,-6.38,;-2.63,-7.29,;-1.14,-6.89,;-.05,-7.98,;-.82,-9.31,;.72,-9.31,;1.28,-7.21,;1.28,-5.67,;2.61,-4.9,;2.61,-3.36,;3.95,-5.67,;3.95,-7.21,;2.61,-7.98,;5.28,-7.98,;6.61,-7.21,;7.96,-7.97,;7.95,-9.52,;6.61,-10.29,;5.28,-9.52,;9.28,-7.21,;10.6,-6.45,;-3.11,-8.75,;-4.65,-8.75,;-5.12,-7.29,;-6.61,-6.89,;-7.09,-5.42,;-8.63,-5.42,;-9.1,-6.89,;-10.59,-7.29,;-7.86,-7.79,)|

BDBM456857

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2cncc(c2)C#N)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.88,-4.07,;-6.54,-4.84,;-5.21,-4.07,;-5.21,-2.53,;-3.88,-1.76,;-2.54,-2.53,;-2.54,-4.07,;-1.21,-4.84,;.12,-4.07,;-3.88,-4.84,;-3.88,-6.38,;-2.63,-7.29,;-1.14,-6.89,;-.05,-7.98,;-.82,-9.31,;.72,-9.31,;1.28,-7.21,;1.28,-5.67,;2.61,-4.9,;2.61,-3.36,;3.95,-5.67,;3.95,-7.21,;2.61,-7.98,;5.28,-7.98,;5.28,-9.52,;6.61,-10.29,;7.95,-9.52,;7.96,-7.97,;6.61,-7.21,;9.28,-7.21,;10.6,-6.45,;-3.11,-8.75,;-4.65,-8.75,;-5.12,-7.29,;-6.61,-6.89,;-7.09,-5.42,;-8.63,-5.42,;-9.1,-6.89,;-10.59,-7.29,;-7.86,-7.79,)|

BDBM456858

COc1cnc(nc1)N1C[C@@H](O)C[C@H](C1)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)cccc1OC |r,wD:13.16,10.11,(10.61,-9.73,;9.27,-10.5,;7.94,-9.73,;6.61,-10.5,;5.27,-9.73,;5.27,-8.19,;6.61,-7.42,;7.94,-8.19,;3.94,-7.42,;3.94,-5.88,;2.61,-5.11,;2.61,-3.57,;1.27,-5.88,;1.27,-7.42,;2.61,-8.19,;-.06,-8.19,;-.83,-9.53,;.71,-9.53,;-1.15,-7.1,;-2.64,-7.5,;-3.11,-8.97,;-4.65,-8.97,;-5.13,-7.5,;-6.62,-7.1,;-7.09,-5.64,;-8.63,-5.64,;-9.11,-7.1,;-10.6,-7.5,;-7.86,-8.01,;-3.88,-6.6,;-3.88,-5.06,;-5.22,-4.29,;-6.55,-5.06,;-7.88,-4.29,;-5.22,-2.75,;-3.88,-1.98,;-2.55,-2.75,;-2.55,-4.29,;-1.22,-5.06,;.12,-4.29,)|

BDBM456859

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)c2nc(C)cc(C)n2)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-7.06,-3.34,;-5.73,-4.11,;-4.39,-3.34,;-4.39,-1.8,;-3.06,-1.03,;-1.73,-1.8,;-1.73,-3.34,;-.39,-4.11,;.94,-3.34,;-3.06,-4.11,;-3.06,-5.65,;-1.81,-6.55,;-.33,-6.15,;.76,-7.24,;-.01,-8.58,;1.53,-8.58,;2.1,-6.47,;2.1,-4.93,;3.43,-4.16,;3.43,-2.62,;4.76,-4.93,;4.76,-6.47,;3.43,-7.24,;6.1,-7.24,;7.43,-6.47,;8.76,-7.24,;10.1,-6.47,;8.76,-8.78,;7.43,-9.55,;7.43,-11.09,;6.1,-8.78,;-2.29,-8.02,;-3.83,-8.02,;-4.31,-6.55,;-5.79,-6.15,;-6.27,-4.69,;-7.81,-4.69,;-8.29,-6.15,;-9.77,-6.55,;-7.04,-7.06,)|

BDBM456860

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2C[C@H](O)CN(C2)C(=O)N(C)C)nnc1-c1ccc(C)o1 |r,wD:16.16,18.19,(-6.07,-4.29,;-4.74,-5.06,;-3.41,-4.29,;-3.41,-2.75,;-2.07,-1.98,;-.74,-2.75,;-.74,-4.29,;.59,-5.06,;1.93,-4.29,;-2.07,-5.06,;-2.07,-6.6,;-.83,-7.5,;.66,-7.11,;1.75,-8.19,;.98,-9.53,;2.52,-9.53,;3.08,-7.42,;3.08,-5.88,;4.42,-5.11,;4.42,-3.57,;5.75,-5.88,;5.75,-7.42,;4.42,-8.19,;7.08,-8.19,;7.08,-9.73,;8.42,-7.42,;9.75,-8.19,;8.42,-5.88,;-1.3,-8.97,;-2.84,-8.97,;-3.32,-7.5,;-4.81,-7.11,;-5.28,-5.64,;-6.82,-5.64,;-7.3,-7.11,;-8.79,-7.5,;-6.05,-8.01,)|

BDBM456861

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)C(=O)N(C)C)nnc1-c1ccco1 |r,wU:16.16,(-6.84,-6.89,;-5.51,-7.66,;-4.18,-6.89,;-4.18,-5.35,;-2.84,-4.58,;-1.51,-5.35,;-1.51,-6.89,;-.18,-7.66,;1.16,-6.89,;-2.84,-7.66,;-2.84,-9.2,;-1.6,-10.1,;-.13,-9.63,;.96,-10.72,;.19,-12.05,;1.73,-12.05,;2.05,-9.63,;2.05,-8.09,;3.38,-7.32,;4.71,-8.09,;4.71,-9.63,;3.38,-10.4,;6.05,-10.4,;6.05,-11.94,;7.38,-9.63,;8.71,-10.4,;7.38,-8.09,;-2.07,-11.57,;-3.61,-11.57,;-4.09,-10.1,;-5.55,-9.63,;-6.03,-8.16,;-7.57,-8.16,;-8.05,-9.63,;-6.8,-10.53,)|

BDBM456862

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCN(C2)S(=O)(=O)C(C)C)nnc1-c1ccco1 |r,wD:16.16,(-6.54,-6.89,;-5.21,-7.66,;-3.87,-6.89,;-3.87,-5.35,;-2.54,-4.58,;-1.2,-5.35,;-1.2,-6.89,;.13,-7.66,;1.46,-6.89,;-2.54,-7.66,;-2.54,-9.2,;-1.29,-10.1,;.17,-9.63,;1.26,-10.72,;.49,-12.05,;2.03,-12.05,;2.35,-9.63,;2.35,-8.09,;3.68,-7.32,;5.02,-8.09,;5.02,-9.63,;3.68,-10.4,;6.35,-10.4,;5.58,-11.73,;7.12,-11.73,;7.69,-9.63,;9.02,-10.4,;7.69,-8.09,;-1.77,-11.57,;-3.31,-11.57,;-3.78,-10.1,;-5.25,-9.63,;-5.72,-8.16,;-7.26,-8.16,;-7.74,-9.63,;-6.49,-10.53,)|

BDBM456863

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)C(=O)N(C)C)nnc1-c1ccco1 |r,wU:16.16,(-6.88,-6.89,;-5.55,-7.66,;-4.21,-6.89,;-4.21,-5.35,;-2.88,-4.58,;-1.55,-5.35,;-1.55,-6.89,;-.21,-7.66,;1.12,-6.89,;-2.88,-7.66,;-2.88,-9.2,;-1.63,-10.1,;-.17,-9.63,;.92,-10.72,;.15,-12.05,;1.69,-12.05,;2.01,-9.63,;2.01,-8.09,;3.34,-7.32,;4.68,-8.09,;4.68,-9.63,;3.34,-10.4,;6.01,-10.4,;6.01,-11.94,;7.34,-9.63,;8.68,-10.4,;7.34,-8.09,;-2.11,-11.57,;-3.65,-11.57,;-4.13,-10.1,;-5.59,-9.63,;-6.07,-8.16,;-7.61,-8.16,;-8.08,-9.63,;-6.84,-10.53,)|

BDBM456864

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)CN2C(=O)CCC[C@@]2(C)C#N)nnc1-c1ccco1 |r,wU:16.17,25.28,wD:25.27,(.62,-29.7,;.3,-28.19,;1.45,-27.16,;2.91,-27.63,;4.05,-26.6,;3.73,-25.1,;2.27,-24.62,;1.95,-23.12,;3.09,-22.09,;1.13,-25.65,;-.34,-25.18,;-.82,-23.71,;.09,-22.47,;-.54,-21.06,;.87,-20.43,;-1.94,-21.69,;-1.16,-19.65,;-2.69,-19.49,;-.26,-18.41,;-.88,-17,;-2.42,-16.84,;-3.32,-18.08,;-3.04,-15.43,;-2.14,-14.19,;-.61,-14.35,;.02,-15.75,;1.3,-16.62,;1.45,-15.18,;2.88,-14.6,;-2.36,-23.71,;-2.83,-25.18,;-1.59,-26.08,;-1.59,-27.62,;-.34,-28.53,;-.82,-29.99,;-2.36,-29.99,;-2.83,-28.53,)|

BDBM456866

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CON(C)[C@H]2c2ncc(F)cn2)nnc1-c1ccco1 |r,wU:21.23,wD:16.16,(-5.34,-2.99,;-4,-3.76,;-2.67,-2.99,;-2.67,-1.45,;-1.34,-.68,;-0,-1.45,;-0,-2.99,;1.33,-3.76,;2.67,-2.99,;-1.34,-3.76,;-1.34,-5.3,;-.09,-6.21,;1.4,-5.81,;2.49,-6.9,;2.88,-8.38,;1.4,-7.98,;3.97,-6.5,;4.05,-4.96,;5.54,-4.56,;6.38,-5.85,;7.87,-6.25,;5.41,-7.05,;5.81,-8.54,;4.72,-9.63,;5.12,-11.11,;6.61,-11.51,;7.01,-13,;7.7,-10.42,;7.3,-8.94,;-.57,-7.67,;-2.11,-7.67,;-2.58,-6.21,;-3.92,-5.44,;-4.39,-3.97,;-5.93,-3.97,;-6.41,-5.44,;-5.16,-6.34,)|

BDBM456867

COc1ncnc(OC)c1\N=C(\NNC(=O)c1ccc(C)o1)NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r|

BDBM456868

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.46,-4.59,;3.32,-3.56,;3.64,-2.05,;2.49,-1.02,;2.81,.49,;1.03,-1.49,;.26,-2.83,;1.8,-2.83,;-.12,-.46,;-1.58,-.94,;-2.06,-2.4,;-3.6,-2.4,;-4.07,-.94,;-5.54,-.46,;-6.01,1,;-7.55,1,;-8.03,-.46,;-9.49,-.94,;-6.78,-1.37,;-2.83,-.03,;-2.83,1.51,;-4.16,2.28,;-5.5,1.51,;-6.83,2.28,;-4.16,3.82,;-2.83,4.59,;-1.49,3.82,;-1.49,2.28,;-.16,1.51,;1.17,2.28,;5.1,-1.57,;6.25,-2.6,;7.71,-2.13,;8.03,-.62,;9.49,-.15,;6.89,.41,;5.42,-.07,)|

BDBM456869

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r|

BDBM456870

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r|

BDBM456871

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r|

BDBM456872

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM456873

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1[C@H]1CCCOC1)c1ncc(Cl)cn1 |r|

BDBM456874

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)o2)n1[C@@H]1CCCOC1)c1ncc(Cl)cn1 |r|

BDBM456875

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r|

BDBM456876

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.83,1.76,;-5.5,.99,;-4.16,1.76,;-4.16,3.3,;-2.83,4.07,;-1.49,3.3,;-1.49,1.76,;-.16,.99,;1.17,1.76,;-2.83,.99,;-2.83,-.55,;-1.58,-1.45,;-.12,-.98,;1.03,-2.01,;.26,-3.34,;1.8,-3.34,;2.49,-1.53,;2.81,-.03,;3.64,-2.56,;3.32,-4.07,;5.1,-2.09,;6.25,-3.12,;7.71,-2.64,;8.03,-1.14,;9.49,-.66,;6.89,-.11,;5.42,-.58,;-2.06,-2.92,;-3.6,-2.92,;-4.07,-1.45,;-5.54,-.98,;-6.01,.49,;-7.55,.49,;-8.03,-.98,;-9.49,-1.45,;-6.78,-1.88,)|

BDBM456877

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(Br)o1 |r,wU:16.17,18.19,(-6.83,1.76,;-5.5,.99,;-4.16,1.76,;-4.16,3.3,;-2.83,4.07,;-1.49,3.3,;-1.49,1.76,;-.16,.99,;1.17,1.76,;-2.83,.99,;-2.83,-.55,;-1.58,-1.45,;-.12,-.98,;1.03,-2.01,;.26,-3.34,;1.8,-3.34,;2.49,-1.53,;2.81,-.03,;3.64,-2.56,;3.32,-4.07,;5.1,-2.09,;6.25,-3.12,;7.71,-2.64,;8.03,-1.14,;9.49,-.66,;6.89,-.11,;5.42,-.58,;-2.06,-2.92,;-3.6,-2.92,;-4.07,-1.45,;-5.54,-.98,;-6.01,.49,;-7.55,.49,;-8.03,-.98,;-9.49,-1.45,;-6.78,-1.88,)|

BDBM456878

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.1,1.85,;-4.76,1.08,;-3.43,1.85,;-3.43,3.39,;-2.1,4.16,;-.76,3.39,;-.76,1.85,;.57,1.08,;1.91,1.85,;-2.1,1.08,;-2.1,-.64,;-.85,-1.55,;.62,-1.07,;1.76,-2.1,;2.53,-3.43,;.99,-3.43,;3.22,-1.62,;3.54,-.12,;4.37,-2.65,;4.05,-4.16,;5.83,-2.18,;6.98,-3.21,;8.44,-2.73,;8.76,-1.23,;10.23,-.75,;7.62,-.2,;6.15,-.67,;-1.33,-3.01,;-2.87,-3.01,;-3.34,-1.55,;-4.81,-1.07,;-5.28,.4,;-6.82,.4,;-7.3,-1.07,;-8.76,-1.55,;-6.05,-1.97,)|

BDBM456879

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-8.79,8.34,;-7.45,7.57,;-6.12,8.34,;-6.12,9.88,;-4.79,10.65,;-3.45,9.88,;-3.45,8.34,;-2.12,7.57,;-.78,8.34,;-4.79,7.57,;-4.79,5.85,;-3.54,4.94,;-2.07,5.42,;-.93,4.39,;-.16,3.06,;-1.7,3.06,;.53,4.87,;.85,6.37,;1.68,3.83,;1.36,2.33,;3.14,4.31,;4.29,3.28,;5.75,3.76,;6.07,5.26,;7.54,5.74,;4.93,6.29,;3.46,5.82,;-4.02,3.48,;-5.56,3.48,;-6.03,4.94,;-7.5,5.42,;-7.97,6.88,;-9.51,6.88,;-9.99,5.42,;-11.45,4.94,;-8.74,4.51,)|

BDBM456880

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccc(C)o1 |r|

BDBM456881

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,18.19,(-6.83,1.76,;-5.5,.99,;-4.16,1.76,;-4.16,3.3,;-2.83,4.07,;-1.49,3.3,;-1.49,1.76,;-.16,.99,;1.17,1.76,;-2.83,.99,;-2.83,-.55,;-1.58,-1.45,;-.12,-.98,;1.03,-2.01,;.26,-3.34,;1.8,-3.34,;2.49,-1.53,;2.81,-.03,;3.64,-2.56,;3.32,-4.07,;5.1,-2.09,;5.42,-.58,;6.89,-.11,;8.03,-1.14,;9.49,-.66,;7.71,-2.64,;6.25,-3.12,;-2.06,-2.92,;-3.6,-2.92,;-4.07,-1.45,;-5.54,-.98,;-6.01,.49,;-7.55,.49,;-8.03,-.98,;-9.49,-1.45,;-6.78,-1.88,)|

BDBM456882

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(-6.83,3.03,;-5.5,2.26,;-4.16,3.03,;-4.16,4.57,;-2.83,5.34,;-1.49,4.57,;-1.49,3.03,;-.16,2.26,;1.17,3.03,;-2.83,2.26,;-2.83,.72,;-1.58,-.19,;-.12,.29,;1.03,-.74,;.26,-2.07,;1.8,-2.07,;2.49,-.27,;2.81,1.24,;3.64,-1.3,;3.32,-2.8,;4.46,-3.83,;4.14,-5.34,;5.93,-3.36,;5.1,-.82,;6.25,-1.85,;7.71,-1.37,;8.03,.13,;9.49,.61,;6.89,1.16,;5.42,.69,;-2.06,-1.65,;-3.6,-1.65,;-4.07,-.19,;-5.54,.29,;-6.01,1.75,;-7.55,1.75,;-8.03,.29,;-9.49,-.19,;-6.78,-.62,)|

BDBM456883

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2COCC[C@@H]2O)nnc1-c1ccc(C)o1 |wD:16.16,21.23,(2.87,-1.65,;1.53,-2.42,;.2,-1.65,;.2,-.11,;-1.13,.66,;-2.47,-.11,;-2.47,-1.65,;-3.8,-2.42,;-5.14,-1.65,;-1.13,-2.42,;-1.13,-3.96,;-2.38,-4.87,;-3.84,-4.39,;-4.99,-5.42,;-6.02,-4.28,;-3.96,-6.57,;-6.13,-6.46,;-5.81,-7.96,;-6.96,-8.99,;-8.42,-8.52,;-8.74,-7.01,;-7.6,-5.98,;-7.92,-4.47,;-1.9,-6.33,;-.36,-6.33,;.11,-4.87,;1.58,-4.39,;2.82,-5.3,;4.07,-4.39,;3.59,-2.93,;4.5,-1.68,;2.05,-2.93,)|

BDBM456884

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2COCC[C@@H]2O)nnc1-c1ccc(C)o1 |r,wD:16.16,21.23,(3.29,-2.74,;1.96,-3.51,;.63,-2.74,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;7.16,-5.16,;5.82,-5.93,;5.82,-7.47,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456885

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2COCC[C@@H]2O)nnc1-c1ccc(C)o1 |r,wU:16.16,wD:21.23,(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;7.16,-5.16,;5.82,-5.93,;5.82,-7.47,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456886

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2COCC[C@H]2O)nnc1-c1ccc(C)o1 |r,wU:21.23,wD:16.16,(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;7.16,-5.16,;5.82,-5.93,;5.82,-7.47,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456887

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CO[C@@H](O)[C@H](O)C2)nnc1-c1ccc(C)o1 |r,wU:16.16,19.20,wD:21.22,(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;8.49,-2.85,;7.16,-5.16,;8.49,-5.93,;5.82,-5.93,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456888

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CO[C@@H](O)[C@H](O)C2)nnc1-c1ccc(C)o1 |r,wU:19.20,wD:16.16,21.22,(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;8.49,-2.85,;7.16,-5.16,;8.49,-5.93,;5.82,-5.93,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456889

COc1cccc(OC)c1-n1c(NS(=O)(=O)C2COCC(CO)C2)nnc1-c1ccc(C)o1 |(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;7.16,-5.16,;8.49,-5.93,;8.49,-7.47,;5.82,-5.93,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456890

COc1cccc(OC)c1-n1c(NS(=O)(=O)C2COCC(C2)[C@@H](C)O)nnc1-c1ccc(C)o1 |r,wU:22.25,(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;7.16,-5.16,;5.82,-5.93,;8.49,-5.93,;9.83,-5.16,;8.49,-7.47,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM456891

COc1cccc(OC)c1-n1c(NS(=O)(=O)C2COCC(C2)[C@H](C)O)nnc1-c1ccc(C)o1 |r,wD:22.25,(3.29,-2.75,;1.96,-3.52,;.63,-2.75,;.58,-1.18,;-.76,-.41,;-2.09,-1.18,;-2.09,-2.72,;-3.42,-3.49,;-4.76,-2.72,;-.76,-3.49,;-.76,-5.03,;.49,-5.93,;1.82,-5.16,;3.16,-5.93,;4.49,-6.7,;1.82,-6.7,;4.49,-5.16,;4.49,-3.62,;5.82,-2.85,;7.16,-3.62,;7.16,-5.16,;5.82,-5.93,;8.49,-5.93,;9.83,-5.16,;8.49,-7.47,;.01,-7.4,;-1.53,-7.4,;-2,-5.93,;-3.54,-5.93,;-4.45,-4.69,;-5.91,-5.16,;-5.91,-6.7,;-7.16,-7.61,;-4.45,-7.18,)|

BDBM480992

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(Br)c2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;1.92,-2.94,;.38,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM480993

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(c2)C#N)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.7,-3.84,;4.37,-3.07,;4.37,-1.53,;3.03,-.76,;3.03,.78,;1.7,-1.53,;.93,-2.86,;2.47,-2.86,;.37,-.76,;-.97,-1.53,;-1.44,-2.99,;-2.98,-2.99,;-3.46,-1.53,;-4.95,-1.13,;-5.35,.36,;-6.83,.76,;-7.92,-.33,;-7.54,-1.85,;-6.04,-2.22,;-8.62,-2.94,;-9.71,-4.03,;-2.21,-.62,;-2.21,.92,;-3.55,1.69,;-4.88,.92,;-6.21,1.69,;-3.55,3.23,;-2.21,4,;-.88,3.23,;-.88,1.69,;.45,.92,;1.79,1.69,;5.7,-.76,;7.03,-1.53,;8.37,-.76,;8.37,.78,;9.7,1.55,;7.03,1.55,;5.7,.78,)|

BDBM480994

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(Cl)c2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.16,-3.92,;3.82,-3.15,;3.82,-1.61,;2.49,-.84,;2.49,.7,;1.15,-1.61,;.38,-2.94,;1.92,-2.94,;-.18,-.84,;-1.51,-1.61,;-1.99,-3.07,;-3.53,-3.07,;-4,-1.61,;-5.49,-1.21,;-5.89,.28,;-7.38,.68,;-8.47,-.41,;-8.07,-1.9,;-9.16,-2.99,;-6.58,-2.3,;-2.76,-.7,;-2.76,.84,;-4.09,1.61,;-5.43,.84,;-6.76,1.61,;-4.09,3.15,;-2.76,3.92,;-1.42,3.15,;-1.42,1.61,;-.09,.84,;1.24,1.61,;5.16,-.84,;6.49,-1.61,;7.82,-.84,;7.82,.7,;9.16,1.47,;6.49,1.47,;5.16,.7,)|

BDBM480995

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.81,-3.92,;3.48,-3.15,;3.48,-1.61,;2.14,-.84,;2.14,.7,;.81,-1.61,;.04,-2.94,;1.58,-2.94,;-.52,-.84,;-1.86,-1.61,;-2.33,-3.07,;-3.87,-3.07,;-4.35,-1.61,;-5.84,-1.21,;-6.24,.28,;-7.72,.68,;-8.81,-.41,;-8.41,-1.9,;-6.93,-2.3,;-3.1,-.7,;-3.1,.84,;-4.44,1.61,;-5.77,.84,;-7.1,1.61,;-4.44,3.15,;-3.1,3.92,;-1.77,3.15,;-1.77,1.61,;-.44,.84,;.9,1.61,;4.81,-.84,;6.14,-1.61,;7.48,-.84,;7.48,.7,;8.81,1.47,;6.14,1.47,;4.81,.7,)|

BDBM480996

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;4.32,-2.83,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM480997

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)c2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.32,-3.71,;5.41,-2.62,;5.01,-1.13,;3.52,-.73,;3.12,.76,;2.43,-1.82,;1.34,-2.91,;3.77,-2.59,;1.1,-1.05,;-.23,-1.82,;-.71,-3.28,;-2.25,-3.28,;-2.73,-1.82,;-4.21,-1.42,;-4.61,.07,;-6.1,.47,;-7.19,-.62,;-6.79,-2.11,;-7.88,-3.2,;-9.37,-2.8,;-5.3,-2.51,;-1.48,-.91,;-1.48,.63,;-2.81,1.4,;-4.15,.63,;-5.48,1.4,;-2.81,2.94,;-1.48,3.71,;-.15,2.94,;-.15,1.4,;1.19,.63,;2.52,1.4,;6.1,-.04,;7.59,-.44,;8.68,.65,;8.28,2.14,;9.37,3.23,;6.79,2.54,;5.7,1.45,)|

BDBM480998

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccccc1 |r,wU:16.17,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481000

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccccc1 |r,wU:16.17,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481001

COc1ncnc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1ccccc1 |(-6.57,1.25,;-5.24,.48,;-3.9,1.25,;-3.9,2.79,;-2.57,3.56,;-1.23,2.79,;-1.23,1.25,;.1,.48,;1.43,1.25,;-2.57,.48,;-2.57,-1.06,;-1.32,-1.97,;.01,-1.2,;1.34,-1.97,;.26,-3.05,;2.68,-2.74,;2.43,-.88,;3.92,-1.28,;5.01,-.19,;4.61,1.3,;5.7,2.39,;7.19,1.99,;8.28,3.08,;7.59,.5,;6.5,-.58,;6.9,-2.07,;7.29,-3.56,;-1.8,-3.43,;-3.34,-3.43,;-3.81,-1.97,;-5.3,-1.57,;-5.7,-.08,;-7.19,.32,;-8.28,-.77,;-7.88,-2.26,;-6.39,-2.66,)|

BDBM481003

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1ccccc1 |(-6.57,1.25,;-5.24,.48,;-3.9,1.25,;-3.9,2.79,;-2.57,3.56,;-1.23,2.79,;-1.23,1.25,;.1,.48,;1.43,1.25,;-2.57,.48,;-2.57,-1.06,;-1.32,-1.97,;.01,-1.2,;1.34,-1.97,;.26,-3.05,;2.68,-2.74,;2.43,-.88,;3.92,-1.28,;5.01,-.19,;4.61,1.3,;5.7,2.39,;7.19,1.99,;8.28,3.08,;7.59,.5,;6.5,-.58,;6.9,-2.07,;7.29,-3.56,;-1.8,-3.43,;-3.34,-3.43,;-3.81,-1.97,;-5.3,-1.57,;-5.7,-.08,;-7.19,.32,;-8.28,-.77,;-7.88,-2.26,;-6.39,-2.66,)|

BDBM481004

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,wD:18.19,(-6.57,1.79,;-5.24,1.02,;-3.9,1.79,;-3.9,3.33,;-2.57,4.1,;-1.23,3.33,;-1.23,1.79,;.1,1.02,;1.43,1.79,;-2.57,1.02,;-2.57,-.52,;-1.32,-1.42,;.01,-.65,;1.34,-1.42,;.26,-2.51,;2.68,-2.19,;2.43,-.33,;2.04,1.16,;3.92,-.73,;4.32,-2.22,;5.81,-2.62,;6.9,-1.53,;6.21,-4.1,;5.01,.36,;6.5,-.04,;7.59,1.05,;7.19,2.54,;8.28,3.63,;5.7,2.93,;4.61,1.85,;-1.8,-2.89,;-3.34,-2.89,;-3.81,-1.42,;-5.3,-1.02,;-5.7,.47,;-7.19,.86,;-8.28,-.23,;-7.88,-1.71,;-6.39,-2.11,)|

BDBM481005

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,wD:18.19,(-6.57,1.79,;-5.24,1.02,;-3.9,1.79,;-3.9,3.33,;-2.57,4.1,;-1.23,3.33,;-1.23,1.79,;.1,1.02,;1.43,1.79,;-2.57,1.02,;-2.57,-.52,;-1.32,-1.42,;.01,-.65,;1.34,-1.42,;.26,-2.51,;2.68,-2.19,;2.43,-.33,;2.04,1.16,;3.92,-.73,;4.32,-2.22,;5.81,-2.62,;6.9,-1.53,;6.21,-4.1,;5.01,.36,;6.5,-.04,;7.59,1.05,;7.19,2.54,;8.28,3.63,;5.7,2.93,;4.61,1.85,;-1.8,-2.89,;-3.34,-2.89,;-3.81,-1.42,;-5.3,-1.02,;-5.7,.47,;-7.19,.86,;-8.28,-.23,;-7.88,-1.71,;-6.39,-2.11,)|

BDBM481006

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;4.32,-2.83,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481007

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;4.32,-2.83,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481008

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;4.32,-2.83,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481009

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;4.32,-2.83,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481010

COc1ncnc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccccc1 |(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;3.92,-1.34,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481011

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.57,1.18,;-5.24,.41,;-3.9,1.18,;-3.9,2.72,;-2.57,3.49,;-1.23,2.72,;-1.23,1.18,;.1,.41,;1.43,1.18,;-2.57,.41,;-2.57,-1.13,;-1.32,-2.03,;.01,-1.26,;1.34,-2.03,;.26,-3.12,;2.68,-2.8,;2.43,-.94,;2.04,.55,;3.92,-1.34,;4.32,-2.83,;5.01,-.25,;6.5,-.65,;7.59,.44,;7.19,1.93,;8.28,3.02,;5.7,2.33,;4.61,1.24,;-1.8,-3.49,;-3.34,-3.49,;-3.81,-2.03,;-5.3,-1.63,;-5.7,-.14,;-7.19,.25,;-8.28,-.83,;-7.88,-2.32,;-6.39,-2.72,)|

BDBM481012

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccccc1 |r,wU:16.16,(-8.03,6.13,;-6.69,5.36,;-5.36,6.13,;-5.36,7.67,;-4.02,8.44,;-2.69,7.67,;-2.69,6.13,;-1.36,5.36,;-.02,6.13,;-4.02,5.36,;-4.02,3.82,;-2.78,2.92,;-1.29,3.32,;-.2,2.23,;.89,1.14,;-1.29,1.14,;.89,3.32,;.49,4.81,;1.58,5.89,;3.06,5.5,;3.46,4.01,;2.37,2.92,;4.95,3.61,;5.35,2.12,;6.84,1.72,;7.93,2.81,;9.41,2.41,;7.53,4.3,;6.04,4.7,;-3.25,1.45,;-4.79,1.45,;-5.27,2.92,;-6.76,3.32,;-7.16,4.81,;-8.64,5.2,;-9.73,4.11,;-9.33,2.63,;-7.85,2.23,)|

BDBM481013

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccccc1 |r,wD:16.16,(-7.87,-3.1,;-6.53,-3.87,;-5.2,-3.1,;-5.2,-1.56,;-3.86,-.79,;-2.53,-1.56,;-2.53,-3.1,;-1.2,-3.87,;.14,-3.1,;-3.86,-3.87,;-3.86,-5.41,;-2.62,-6.31,;-1.13,-5.91,;-.04,-7,;1.05,-8.09,;-1.13,-8.09,;1.05,-5.91,;.65,-4.42,;1.74,-3.34,;3.22,-3.73,;3.62,-5.22,;2.53,-6.31,;5.11,-5.62,;5.51,-7.11,;7,-7.51,;8.09,-6.42,;9.57,-6.82,;7.69,-4.93,;6.2,-4.53,;-3.09,-7.77,;-4.63,-7.77,;-5.11,-6.31,;-6.6,-5.91,;-7,-4.42,;-8.48,-4.03,;-9.57,-5.11,;-9.17,-6.6,;-7.69,-7,)|

BDBM481014

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(OC)ccnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(3.4,-3.93,;4.43,-2.79,;3.95,-1.32,;2.45,-1,;1.97,.46,;1.42,-2.15,;2.56,-3.18,;.39,-3.29,;.27,-1.12,;-1.19,-1.59,;-1.67,-3.06,;-3.21,-3.06,;-3.68,-1.59,;-5.15,-1.12,;-5.47,.39,;-6.93,.87,;-8.08,-.17,;-7.76,-1.67,;-6.29,-2.15,;-2.44,-.69,;-2.44,.85,;-1.1,1.62,;.23,.85,;1.56,1.62,;-1.1,3.16,;-2.44,3.93,;-3.77,3.16,;-3.77,1.62,;-5.1,.85,;-6.44,1.62,;4.99,-.18,;6.49,-.5,;7.52,.65,;7.05,2.11,;8.08,3.25,;5.54,2.43,;4.51,1.29,)|

BDBM481016

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.44,1.3,;-5.1,.53,;-3.77,1.3,;-3.77,2.84,;-2.44,3.61,;-1.1,2.84,;-1.1,1.3,;.23,.53,;1.56,1.3,;-2.44,.53,;-2.44,-1.01,;-1.19,-1.91,;.27,-1.44,;1.42,-2.47,;2.56,-3.5,;.39,-3.61,;2.45,-1.32,;1.97,.14,;3.95,-1.64,;4.43,-3.11,;4.99,-.5,;4.51,.97,;5.54,2.11,;7.05,1.79,;8.08,2.93,;7.52,.33,;6.49,-.82,;-1.67,-3.38,;-3.21,-3.38,;-3.68,-1.91,;-5.15,-1.44,;-5.47,.07,;-6.93,.55,;-8.08,-.49,;-7.76,-1.99,;-6.29,-2.47,)|

BDBM481017

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-6.44,1.3,;-5.1,.53,;-3.77,1.3,;-3.77,2.84,;-2.44,3.61,;-1.1,2.84,;-1.1,1.3,;.23,.53,;1.56,1.3,;-2.44,.53,;-2.44,-1.01,;-1.19,-1.91,;.27,-1.44,;1.42,-2.47,;2.56,-3.5,;.39,-3.61,;2.45,-1.32,;1.97,.14,;3.95,-1.64,;4.43,-3.11,;4.99,-.5,;4.51,.97,;5.54,2.11,;7.05,1.79,;8.08,2.93,;7.52,.33,;6.49,-.82,;-1.67,-3.38,;-3.21,-3.38,;-3.68,-1.91,;-5.15,-1.44,;-5.47,.07,;-6.93,.55,;-8.08,-.49,;-7.76,-1.99,;-6.29,-2.47,)|

BDBM481018

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccccc1 |r,wU:16.16,(-7.9,1.3,;-6.57,.53,;-5.24,1.3,;-5.24,2.84,;-3.9,3.61,;-2.57,2.84,;-2.57,1.3,;-1.24,.53,;.1,1.3,;-3.9,.53,;-3.9,-1.01,;-2.66,-1.91,;-1.19,-1.44,;-.05,-2.47,;1.1,-3.5,;-1.08,-3.61,;.98,-1.32,;.51,.14,;1.54,1.29,;3.04,.97,;3.52,-.5,;2.49,-1.64,;5.02,-.82,;5.5,-2.28,;7.01,-2.6,;8.04,-1.46,;9.54,-1.78,;7.56,.01,;6.06,.33,;-3.13,-3.38,;-4.67,-3.38,;-5.15,-1.91,;-6.61,-1.44,;-6.93,.07,;-8.4,.55,;-9.54,-.49,;-9.22,-1.99,;-7.76,-2.47,)|

BDBM481020

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wU:16.16,(-8.06,6.04,;-6.72,5.27,;-5.39,6.04,;-5.39,7.58,;-4.06,8.35,;-2.72,7.58,;-2.72,6.04,;-1.39,5.27,;-.06,6.04,;-4.06,5.27,;-4.06,3.73,;-2.81,2.82,;-1.32,3.22,;-.23,2.13,;.85,1.04,;-1.32,1.04,;.85,3.22,;.46,4.71,;1.54,5.8,;3.03,5.4,;3.43,3.91,;2.34,2.82,;4.92,3.51,;5.32,2.03,;6.8,1.63,;7.89,2.72,;9.38,2.32,;7.49,4.2,;6.01,4.6,;-3.29,1.36,;-4.83,1.36,;-5.3,2.82,;-6.79,3.22,;-7.19,4.71,;-8.68,5.11,;-9.77,4.02,;-9.37,2.53,;-7.88,2.13,)|

BDBM481021

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCN(C2)c2ncc(C)cn2)nnc1-c1ccccc1 |r,wD:16.16,(-7.92,-7.86,;-6.58,-8.63,;-5.25,-7.86,;-5.25,-6.32,;-3.92,-5.55,;-2.58,-6.32,;-2.58,-7.86,;-1.25,-8.63,;.09,-7.86,;-3.92,-8.63,;-3.92,-10.17,;-2.67,-11.08,;-1.2,-10.6,;-.06,-11.63,;-1.15,-12.72,;1.03,-12.72,;1.03,-10.54,;.63,-9.06,;1.72,-7.97,;3.21,-8.36,;3.61,-9.85,;2.52,-10.94,;5.09,-10.25,;5.49,-11.74,;6.98,-12.14,;8.07,-11.05,;9.56,-11.45,;7.67,-9.56,;6.18,-9.16,;-3.15,-12.54,;-4.69,-12.54,;-5.16,-11.08,;-6.63,-10.6,;-6.95,-9.09,;-8.41,-8.62,;-9.56,-9.65,;-9.23,-11.16,;-7.77,-11.63,)|

BDBM481022

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r,wU:16.16,(-7.9,1.3,;-6.57,.53,;-5.24,1.3,;-5.24,2.84,;-3.9,3.61,;-2.57,2.84,;-2.57,1.3,;-1.24,.53,;.1,1.3,;-3.9,.53,;-3.9,-1.01,;-2.66,-1.91,;-1.19,-1.44,;-.05,-2.47,;1.1,-3.5,;-1.08,-3.61,;.98,-1.32,;.51,.14,;1.54,1.29,;3.04,.97,;3.52,-.5,;2.49,-1.64,;5.02,-.82,;5.5,-2.28,;7.01,-2.6,;8.04,-1.46,;9.54,-1.78,;7.56,.01,;6.06,.33,;-3.13,-3.38,;-4.67,-3.38,;-5.15,-1.91,;-6.61,-1.44,;-6.93,.07,;-8.4,.55,;-9.54,-.49,;-9.22,-1.99,;-7.76,-2.47,)|

BDBM481024

CO[C@@H]1CCC[C@H](OC)[C@H]1n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccccc1 |r|

BDBM481025

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCCN(C2)C(=O)OC(C)(C)C)nnc1-c1ccccc1 |r,wD:16.16,(-5.87,-4.46,;-4.54,-5.23,;-3.2,-4.46,;-3.2,-2.92,;-1.87,-2.15,;-.54,-2.92,;-.54,-4.46,;.8,-5.23,;2.13,-4.46,;-1.87,-5.23,;-1.87,-6.77,;-.62,-7.67,;.86,-7.27,;1.95,-8.36,;.86,-9.45,;3.04,-9.45,;3.04,-7.27,;2.64,-5.79,;3.73,-4.7,;5.22,-5.1,;5.62,-6.58,;4.53,-7.67,;7.11,-6.98,;7.5,-8.47,;8.19,-5.89,;7.8,-4.41,;8.88,-3.32,;6.31,-4.01,;7.4,-2.92,;-1.1,-9.14,;-2.64,-9.14,;-3.12,-7.67,;-4.6,-7.27,;-5.69,-8.36,;-7.18,-7.96,;-7.58,-6.48,;-6.49,-5.39,;-5,-5.79,)|

BDBM481026

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r,wU:16.16,(-8.73,7.57,;-7.4,6.8,;-6.06,7.57,;-6.06,9.11,;-4.73,9.88,;-3.4,9.11,;-3.4,7.57,;-2.06,6.8,;-.73,7.57,;-4.73,6.8,;-4.73,5.26,;-3.49,4.35,;-2,4.75,;-.91,3.66,;-2,2.57,;.18,2.57,;.18,4.75,;-.22,6.24,;.87,7.33,;2.36,6.93,;2.76,5.44,;1.67,4.35,;4.24,5.04,;4.64,3.55,;6.13,3.16,;7.22,4.24,;8.71,3.85,;6.82,5.73,;5.33,6.13,;-3.96,2.89,;-5.5,2.89,;-5.98,4.35,;-7.46,4.75,;-8.55,3.66,;-10.04,4.06,;-10.44,5.55,;-9.35,6.64,;-7.86,6.24,)|

BDBM481027

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(OC)ccnc1OC)c1ncc(C)cn1 |wU:2.1,3.3,(-10.72,-6.31,;-9.25,-6.78,;-8.93,-8.29,;-7.47,-8.77,;-7.15,-10.27,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-5.18,-6.7,;-3.71,-7.18,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;1.39,-7.73,;-2.47,-6.27,;-2.47,-4.73,;-1.13,-3.96,;.2,-4.73,;1.53,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,)|

BDBM481028

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc3OC(F)(F)Oc3c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.56,-3.7,;5.22,-2.93,;5.22,-1.39,;3.89,-.62,;3.89,.92,;2.56,-1.39,;3.89,-2.16,;1.22,-2.16,;1.22,-.62,;-.24,-1.09,;-.72,-2.56,;-2.26,-2.56,;-2.73,-1.09,;-4.27,-1.09,;-5.04,.24,;-6.58,.24,;-7.35,-1.09,;-8.86,-1.41,;-9.02,-2.94,;-10.56,-2.94,;-9.24,-4.43,;-7.61,-3.57,;-6.58,-2.43,;-5.04,-2.43,;-1.49,-.19,;-1.49,1.35,;-2.82,2.12,;-4.15,1.35,;-5.49,2.12,;-2.82,3.66,;-1.49,4.43,;-.15,3.66,;-.15,2.12,;1.18,1.35,;2.51,2.12,;6.56,-.62,;7.89,-1.39,;9.23,-.62,;9.23,.92,;10.56,1.69,;7.89,1.69,;6.56,.92,)|

BDBM481029

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:1.0,2.2,(3.62,-3.68,;3.62,-2.14,;2.29,-1.37,;2.29,.17,;.95,-2.14,;2.29,-2.91,;-.38,-2.91,;-.38,-1.37,;-1.84,-1.85,;-2.32,-3.31,;-3.86,-3.31,;-4.34,-1.85,;-5.88,-1.85,;-6.65,-.51,;-8.19,-.51,;-8.96,-1.85,;-8.19,-3.18,;-6.65,-3.18,;-3.09,-.94,;-3.09,.6,;-4.42,1.37,;-5.76,.6,;-4.42,2.91,;-3.09,3.68,;-1.76,2.91,;-1.76,1.37,;-.42,.6,;4.96,-1.37,;6.29,-2.14,;7.62,-1.37,;7.62,.17,;8.96,.94,;6.29,.94,;4.96,.17,)|

BDBM481030

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.1,3.3,(4.96,-4.06,;3.62,-3.29,;3.62,-1.75,;2.29,-.98,;2.29,.56,;.95,-1.75,;2.29,-2.52,;-.38,-2.52,;-.38,-.98,;-1.84,-1.46,;-2.32,-2.93,;-3.86,-2.93,;-4.34,-1.46,;-5.88,-1.46,;-6.65,-.13,;-8.19,-.13,;-8.96,-1.46,;-8.19,-2.79,;-6.65,-2.79,;-3.09,-.56,;-3.09,.98,;-4.42,1.75,;-5.76,.98,;-4.42,3.29,;-3.09,4.06,;-1.76,3.29,;-1.76,1.75,;-.42,.98,;4.96,-.98,;6.29,-1.75,;7.62,-.98,;7.62,.56,;8.96,1.33,;6.29,1.33,;4.96,.56,)|

BDBM481031

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:5.5,wD:4.3,(4.96,-4.83,;4.96,-3.29,;6.29,-2.52,;3.62,-2.52,;3.62,-.98,;2.29,-.21,;2.29,1.33,;.95,-.98,;2.29,-1.75,;-.38,-1.75,;-.38,-.21,;-1.84,-.69,;-2.32,-2.16,;-3.86,-2.16,;-4.34,-.69,;-5.88,-.69,;-6.65,.64,;-8.19,.64,;-8.96,-.69,;-8.19,-2.02,;-6.65,-2.02,;-3.09,.21,;-3.09,1.75,;-4.42,2.52,;-5.76,1.75,;-4.42,4.06,;-3.09,4.83,;-1.76,4.06,;-1.76,2.52,;-.42,1.75,;4.96,-.21,;6.29,-.98,;7.62,-.21,;7.62,1.33,;8.96,2.1,;6.29,2.1,;4.96,1.33,)|

BDBM481032

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F)c1cnc(C)cn1 |r,wU:1.0,2.2,(3.62,-3.68,;3.62,-2.14,;2.29,-1.37,;2.29,.17,;.95,-2.14,;2.29,-2.91,;-.38,-2.91,;-.38,-1.37,;-1.84,-1.85,;-2.32,-3.31,;-3.86,-3.31,;-4.34,-1.85,;-5.88,-1.85,;-6.65,-.51,;-8.19,-.51,;-8.96,-1.85,;-8.19,-3.18,;-6.65,-3.18,;-3.09,-.94,;-3.09,.6,;-4.42,1.37,;-5.76,.6,;-4.42,2.91,;-3.09,3.68,;-1.76,2.91,;-1.76,1.37,;-.42,.6,;4.96,-1.37,;4.96,.17,;6.29,.94,;7.62,.17,;8.96,.94,;7.62,-1.37,;6.29,-2.14,)|

BDBM481033

C[C@@H]([C@H](O[Si](C)(C)C(C)(C)C)c1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F |r,wU:2.2,1.0,(2.29,2.1,;2.29,.56,;3.62,-.21,;3.62,-1.75,;2.29,-2.52,;.75,-2.52,;1.52,-1.19,;2.29,-4.06,;3.62,-4.83,;.95,-4.83,;2.29,-5.6,;4.96,.56,;6.29,-.21,;7.62,.56,;7.62,2.1,;8.96,2.87,;6.29,2.87,;4.96,2.1,;.95,-.21,;2.29,-.98,;-.38,-.98,;-.38,.56,;-1.84,.08,;-2.32,-1.39,;-3.86,-1.39,;-4.34,.08,;-5.88,.08,;-6.65,1.41,;-8.19,1.41,;-8.96,.08,;-8.19,-1.25,;-6.65,-1.25,;-3.09,.98,;-3.09,2.52,;-4.42,3.29,;-5.76,2.52,;-4.42,4.83,;-3.09,5.6,;-1.76,4.83,;-1.76,3.29,;-.42,2.52,)|

BDBM481034

C[C@@H]([C@H](O)c1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F |r,wU:2.2,1.0,(2.29,.17,;2.29,-1.37,;3.62,-2.14,;3.62,-3.68,;4.96,-1.37,;6.29,-2.14,;7.62,-1.37,;7.62,.17,;8.96,.94,;6.29,.94,;4.96,.17,;.95,-2.14,;2.29,-2.91,;-.38,-2.91,;-.38,-1.37,;-1.84,-1.85,;-2.32,-3.31,;-3.86,-3.31,;-4.34,-1.85,;-5.88,-1.85,;-6.65,-.51,;-8.19,-.51,;-8.96,-1.85,;-8.19,-3.18,;-6.65,-3.18,;-3.09,-.94,;-3.09,.6,;-4.42,1.37,;-5.76,.6,;-4.42,2.91,;-3.09,3.68,;-1.76,2.91,;-1.76,1.37,;-.42,.6,)|

BDBM481035

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F)c1ncc(Cl)cn1 |r,wU:1.0,2.2,(3.62,-3.68,;3.62,-2.14,;2.29,-1.37,;2.29,.17,;.95,-2.14,;2.29,-2.91,;-.38,-2.91,;-.38,-1.37,;-1.84,-1.85,;-2.32,-3.31,;-3.86,-3.31,;-4.34,-1.85,;-5.88,-1.85,;-6.65,-.51,;-8.19,-.51,;-8.96,-1.85,;-8.19,-3.18,;-6.65,-3.18,;-3.09,-.94,;-3.09,.6,;-4.42,1.37,;-5.76,.6,;-4.42,2.91,;-3.09,3.68,;-1.76,2.91,;-1.76,1.37,;-.42,.6,;4.96,-1.37,;6.29,-2.14,;7.62,-1.37,;7.62,.17,;8.96,.94,;6.29,.94,;4.96,.17,)|

BDBM481036

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(F)cccc1F)c1ncc(cn1)C#N |r,wU:1.0,2.2,(2.95,-3.68,;2.95,-2.14,;1.62,-1.37,;1.62,.17,;.29,-2.14,;1.62,-2.91,;-1.05,-2.91,;-1.05,-1.37,;-2.51,-1.85,;-2.99,-3.31,;-4.53,-3.31,;-5,-1.85,;-6.54,-1.85,;-7.31,-.51,;-8.85,-.51,;-9.62,-1.85,;-8.85,-3.18,;-7.31,-3.18,;-3.76,-.94,;-3.76,.6,;-5.09,1.37,;-6.42,.6,;-5.09,2.91,;-3.76,3.68,;-2.42,2.91,;-2.42,1.37,;-1.09,.6,;4.29,-1.37,;5.62,-2.14,;6.96,-1.37,;6.96,.17,;5.62,.94,;4.29,.17,;8.29,.94,;9.62,1.71,)|

BDBM481037

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccc(c1)C(F)(F)F |r,wU:18.19,16.17,(-5.41,.77,;-3.94,.29,;-2.8,1.32,;-3.12,2.83,;-1.97,3.86,;-.51,3.38,;-.19,1.88,;1.27,1.4,;2.42,2.43,;-1.33,.85,;-1.01,-.66,;.39,-1.29,;1.73,-.52,;3.06,-1.29,;2.29,-2.62,;4.39,-2.06,;3.83,.05,;3.06,1.38,;5.37,.05,;6.14,-1.29,;6.14,1.38,;7.68,1.38,;8.45,2.71,;7.68,4.05,;8.45,5.38,;6.14,4.05,;5.37,2.71,;.23,-2.82,;-1.27,-3.14,;-2.04,-1.8,;-3.58,-1.64,;-4.2,-.24,;-5.73,-.08,;-6.64,-1.32,;-6.01,-2.73,;-4.48,-2.89,;-6.92,-3.97,;-6.29,-5.38,;-8.45,-3.81,;-7.82,-5.22,)|

BDBM481038

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1cccc(c1)C(F)(F)F |r,wU:18.19,16.17,(-5.41,.77,;-3.94,.29,;-2.8,1.32,;-3.12,2.83,;-1.97,3.86,;-.51,3.38,;-.19,1.88,;1.27,1.4,;2.42,2.43,;-1.33,.85,;-1.01,-.66,;.39,-1.29,;1.73,-.52,;3.06,-1.29,;2.29,-2.62,;4.39,-2.06,;3.83,.05,;3.06,1.38,;5.37,.05,;6.14,-1.29,;6.14,1.38,;5.37,2.71,;6.14,4.05,;7.68,4.05,;8.45,5.38,;8.45,2.71,;7.68,1.38,;.23,-2.82,;-1.27,-3.14,;-2.04,-1.8,;-3.58,-1.64,;-4.2,-.24,;-5.73,-.08,;-6.64,-1.32,;-6.01,-2.73,;-4.48,-2.89,;-6.92,-3.97,;-6.29,-5.38,;-8.45,-3.81,;-7.82,-5.22,)|

BDBM481039

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccc(c1)C#N |r,wU:18.19,16.17,(-6.71,1.37,;-5.37,.6,;-4.04,1.37,;-4.04,2.91,;-2.71,3.68,;-1.37,2.91,;-1.37,1.37,;-.04,.6,;1.3,1.37,;-2.71,.6,;-2.71,-.94,;-1.46,-1.85,;.01,-1.37,;1.34,-2.14,;2.67,-2.91,;.01,-2.91,;2.67,-1.37,;2.67,.17,;4.01,-2.14,;4.01,-3.68,;5.34,-1.37,;6.67,-2.14,;8.01,-1.37,;8.01,.17,;9.34,.94,;6.67,.94,;5.34,.17,;-1.94,-3.31,;-3.48,-3.31,;-3.95,-1.85,;-5.49,-1.85,;-6.26,-3.18,;-7.8,-3.18,;-8.57,-1.85,;-7.8,-.51,;-6.26,-.51,;-8.57,.82,;-9.34,2.16,)|

BDBM481040

COc1ccnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccccc1 |r,wU:18.19,16.17,(.77,1.76,;-.56,.99,;-1.89,1.76,;-1.89,3.3,;-3.23,4.07,;-4.56,3.3,;-4.56,1.76,;-5.9,.99,;-7.23,1.76,;-3.23,.99,;-3.23,-.55,;-1.98,-1.45,;-.52,-.98,;.63,-2.01,;-.14,-3.34,;1.4,-3.34,;2.09,-1.53,;2.41,-.03,;3.24,-2.56,;2.92,-4.07,;4.7,-2.09,;5.02,-.58,;6.49,-.11,;7.63,-1.14,;9.09,-.66,;7.31,-2.64,;5.84,-3.12,;-2.46,-2.92,;-4,-2.92,;-4.47,-1.45,;-6.01,-1.45,;-6.78,-.12,;-8.32,-.12,;-9.09,-1.45,;-8.32,-2.79,;-6.78,-2.79,)|

BDBM481041

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1ccccc1 |r,wU:16.16,18.19,(-7.32,2.83,;-5.99,2.06,;-4.65,2.83,;-4.65,4.37,;-3.32,5.14,;-1.99,4.37,;-1.99,2.83,;-.65,2.06,;.68,2.83,;-3.32,2.06,;-3.32,.52,;-2.07,-.39,;-.61,.09,;.53,-.94,;-.24,-2.27,;1.3,-2.27,;2,-.46,;2.32,1.04,;3.78,1.52,;4.1,3.02,;4.93,.49,;4.61,-1.02,;3.14,-1.49,;5.75,-2.05,;5.43,-3.56,;6.58,-4.59,;8.04,-4.11,;9.19,-5.14,;8.36,-2.6,;7.22,-1.57,;-2.55,-1.85,;-4.09,-1.85,;-4.57,-.39,;-6.11,-.39,;-6.88,.95,;-8.42,.95,;-9.19,-.39,;-8.42,-1.72,;-6.88,-1.72,)|

BDBM481042

COc1ccnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(.77,1.76,;-.56,.99,;-1.89,1.76,;-1.89,3.3,;-3.23,4.07,;-4.56,3.3,;-4.56,1.76,;-5.9,.99,;-7.23,1.76,;-3.23,.99,;-3.23,-.55,;-1.98,-1.45,;-.52,-.98,;.63,-2.01,;-.14,-3.34,;1.4,-3.34,;2.09,-1.53,;2.41,-.03,;3.24,-2.56,;2.92,-4.07,;4.7,-2.09,;5.02,-.58,;6.49,-.11,;7.63,-1.14,;9.09,-.66,;7.31,-2.64,;5.84,-3.12,;-2.46,-2.92,;-4,-2.92,;-4.47,-1.45,;-6.01,-1.45,;-6.78,-.12,;-8.32,-.12,;-9.09,-1.45,;-8.32,-2.79,;-6.78,-2.79,)|

BDBM481046

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1-c1ccccc1 |r,wU:16.16,18.31,(-7.32,2.83,;-5.99,2.06,;-4.65,2.83,;-4.65,4.37,;-3.32,5.14,;-1.99,4.37,;-1.99,2.83,;-.65,2.06,;.68,2.83,;-3.32,2.06,;-3.32,.52,;-2.07,-.39,;-.61,.09,;.53,-.94,;-.24,-2.27,;1.3,-2.27,;2,-.46,;2.32,1.04,;3.78,1.52,;4.93,.49,;4.61,-1.02,;3.14,-1.49,;5.75,-2.05,;5.43,-3.56,;6.58,-4.59,;8.04,-4.11,;9.19,-5.14,;8.36,-2.6,;7.22,-1.57,;4.1,3.02,;5.57,3.5,;5.89,5.01,;6.71,2.47,;-2.55,-1.85,;-4.09,-1.85,;-4.57,-.39,;-6.11,-.39,;-6.88,.95,;-8.42,.95,;-9.19,-.39,;-8.42,-1.72,;-6.88,-1.72,)|

BDBM481048

COc1cccc(OC)c1-n1c(NS(=O)(=O)c2cncc(Br)c2)nnc1-c1ccccc1 |(-5.6,1.4,;-4.27,.63,;-2.94,1.4,;-2.94,2.94,;-1.6,3.71,;-.27,2.94,;-.27,1.4,;1.06,.63,;2.4,1.4,;-1.6,.63,;-1.6,-.91,;-.36,-1.82,;1.11,-1.34,;2.25,-2.37,;1.48,-3.71,;3.02,-3.71,;3.72,-1.9,;4.04,-.39,;5.5,.09,;6.65,-.95,;6.33,-2.45,;7.47,-3.48,;4.86,-2.93,;-.83,-3.28,;-2.37,-3.28,;-2.85,-1.82,;-4.39,-1.82,;-5.16,-.48,;-6.7,-.48,;-7.47,-1.82,;-6.7,-3.15,;-5.16,-3.15,)|

BDBM481049

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM481050

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM481051

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1C1CCOCC1)c1ncc(C)cn1 |r|

BDBM481052

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@H](CN(C2)c2ncc(F)cn2)OC(C)C)nnc1-c1ccccc1 |r,wU:16.16,18.31,(-7.32,2.83,;-5.99,2.06,;-4.65,2.83,;-4.65,4.37,;-3.32,5.14,;-1.99,4.37,;-1.99,2.83,;-.65,2.06,;.68,2.83,;-3.32,2.06,;-3.32,.52,;-2.07,-.39,;-.61,.09,;.53,-.94,;-.24,-2.27,;1.3,-2.27,;2,-.46,;2.32,1.04,;3.78,1.52,;4.93,.49,;4.61,-1.02,;3.14,-1.49,;5.75,-2.05,;5.43,-3.56,;6.58,-4.59,;8.04,-4.11,;9.19,-5.14,;8.36,-2.6,;7.22,-1.57,;4.1,3.02,;5.57,3.5,;5.89,5.01,;6.71,2.47,;-2.55,-1.85,;-4.09,-1.85,;-4.57,-.39,;-6.11,-.39,;-6.88,.95,;-8.42,.95,;-9.19,-.39,;-8.42,-1.72,;-6.88,-1.72,)|

BDBM481053

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(cc2)C(C)(C)C)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |wD:2.1,3.3,(4.88,-7.82,;3.35,-7.65,;2.44,-8.9,;.91,-8.74,;.01,-9.99,;.28,-7.33,;-1.12,-7.96,;1.69,-6.71,;-.34,-5.93,;.56,-4.68,;2.1,-4.68,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;1.33,2.31,;,1.54,;;1.33,3.85,;1.33,5.39,;-.21,3.85,;2.87,3.85,;.09,-3.22,;-1.38,-2.74,;-1.7,-1.23,;-.55,-.2,;-.87,1.3,;-3.16,-.76,;-4.31,-1.79,;-3.99,-3.29,;-2.52,-3.77,;-2.2,-5.28,;-3.35,-6.31,;3.07,-10.31,;4.6,-10.47,;5.23,-11.88,;4.32,-13.12,;4.95,-14.53,;2.79,-12.96,;2.16,-11.55,)|

BDBM481054

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc3OCOc3c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.86,-3.92,;4.52,-3.15,;4.52,-1.61,;3.19,-.84,;3.19,.7,;1.85,-1.61,;.52,-2.38,;3.19,-2.38,;.52,-.84,;-.81,-1.61,;-1.29,-3.07,;-2.83,-3.07,;-3.3,-1.61,;-4.77,-1.13,;-5.09,.37,;-6.55,.85,;-7.7,-.18,;-9.23,-.02,;-9.86,-1.43,;-8.71,-2.46,;-7.38,-1.69,;-5.91,-2.16,;-2.06,-.7,;-2.06,.84,;-3.39,1.61,;-4.73,.84,;-6.06,1.61,;-3.39,3.15,;-2.06,3.92,;-.73,3.15,;-.73,1.61,;.61,.84,;1.94,1.61,;5.86,-.84,;7.19,-1.61,;8.52,-.84,;8.52,.7,;9.86,1.47,;7.19,1.47,;5.86,.7,)|

BDBM481055

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2F)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(4.78,-3.92,;3.44,-3.15,;3.44,-1.61,;2.11,-.84,;2.11,.7,;.78,-1.61,;-.56,-2.38,;2.11,-2.38,;-.56,-.84,;-1.89,-1.61,;-2.37,-3.07,;-3.91,-3.07,;-4.38,-1.61,;-5.85,-1.13,;-6.17,.37,;-7.63,.85,;-8.78,-.18,;-8.46,-1.69,;-6.99,-2.16,;-6.67,-3.67,;-3.14,-.7,;-3.14,.84,;-4.47,1.61,;-5.81,.84,;-7.14,1.61,;-4.47,3.15,;-3.14,3.92,;-1.8,3.15,;-1.8,1.61,;-.47,.84,;.86,1.61,;4.78,-.84,;6.11,-1.61,;7.44,-.84,;7.44,.7,;8.78,1.47,;6.11,1.47,;4.78,.7,)|

BDBM481056

CO[C@@H]([C@H](C)S(=O)(=O)NC1=NN=C([NH+]1c1c(OC)cccc1OC)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ncc(C)cn1 |r,c:11,t:9|

BDBM481057

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(OC(F)(F)F)cc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.85,-3.92,;5.52,-3.15,;5.52,-1.61,;4.18,-.84,;4.18,.7,;2.85,-1.61,;1.52,-2.38,;4.18,-2.38,;1.52,-.84,;.18,-1.61,;-.29,-3.07,;-1.83,-3.07,;-2.31,-1.61,;-3.77,-1.13,;-4.09,.37,;-5.56,.85,;-6.7,-.18,;-8.17,.3,;-9.31,-.73,;-10.85,-.73,;-8.91,-2.22,;-10.4,-1.82,;-6.38,-1.69,;-4.92,-2.16,;-1.06,-.7,;-1.06,.84,;-2.4,1.61,;-3.73,.84,;-5.06,1.61,;-2.4,3.15,;-1.06,3.92,;.27,3.15,;.27,1.61,;1.6,.84,;2.94,1.61,;6.85,-.84,;8.18,-1.61,;9.52,-.84,;9.52,.7,;10.85,1.47,;8.18,1.47,;6.85,.7,)|

BDBM481058

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(Cl)c(Cl)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.51,-3.92,;4.18,-3.15,;4.18,-1.61,;2.84,-.84,;2.84,.7,;1.51,-1.61,;.17,-2.38,;2.84,-2.38,;.17,-.84,;-1.16,-1.61,;-1.64,-3.07,;-3.18,-3.07,;-3.65,-1.61,;-5.12,-1.13,;-5.44,.37,;-6.9,.85,;-8.05,-.18,;-9.51,.3,;-7.73,-1.69,;-8.87,-2.72,;-6.26,-2.16,;-2.41,-.7,;-2.41,.84,;-3.74,1.61,;-5.07,.84,;-6.41,1.61,;-3.74,3.15,;-2.41,3.92,;-1.07,3.15,;-1.07,1.61,;.26,.84,;1.6,1.61,;5.51,-.84,;6.84,-1.61,;8.18,-.84,;8.18,.7,;9.51,1.47,;6.84,1.47,;5.51,.7,)|

BDBM481059

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(Cl)cc2Cl)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.51,-3.92,;4.18,-3.15,;4.18,-1.61,;2.84,-.84,;2.84,.7,;1.51,-1.61,;.17,-2.38,;2.84,-2.38,;.17,-.84,;-1.16,-1.61,;-1.64,-3.07,;-3.18,-3.07,;-3.65,-1.61,;-5.12,-1.13,;-5.44,.37,;-6.9,.85,;-8.05,-.18,;-9.51,.3,;-7.73,-1.69,;-6.26,-2.16,;-5.94,-3.67,;-2.41,-.7,;-2.41,.84,;-3.74,1.61,;-5.07,.84,;-6.41,1.61,;-3.74,3.15,;-2.41,3.92,;-1.07,3.15,;-1.07,1.61,;.26,.84,;1.6,1.61,;5.51,-.84,;6.84,-1.61,;8.18,-.84,;8.18,.7,;9.51,1.47,;6.84,1.47,;5.51,.7,)|

BDBM481060

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(F)c(F)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.51,-3.92,;4.18,-3.15,;4.18,-1.61,;2.84,-.84,;2.84,.7,;1.51,-1.61,;.17,-2.38,;2.84,-2.38,;.17,-.84,;-1.16,-1.61,;-1.64,-3.07,;-3.18,-3.07,;-3.65,-1.61,;-5.12,-1.13,;-5.44,.37,;-6.9,.85,;-8.05,-.18,;-9.51,.3,;-7.73,-1.69,;-8.87,-2.72,;-6.26,-2.16,;-2.41,-.7,;-2.41,.84,;-3.74,1.61,;-5.07,.84,;-6.41,1.61,;-3.74,3.15,;-2.41,3.92,;-1.07,3.15,;-1.07,1.61,;.26,.84,;1.6,1.61,;5.51,-.84,;6.84,-1.61,;8.18,-.84,;8.18,.7,;9.51,1.47,;6.84,1.47,;5.51,.7,)|

BDBM481061

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(c2)S(=O)(=O)N(C)C)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.49,-3.25,;5.16,-2.48,;5.16,-.94,;3.83,-.17,;3.83,1.37,;2.49,-.94,;1.16,-1.71,;3.83,-1.71,;1.16,-.17,;-.18,-.94,;-.65,-2.4,;-2.19,-2.4,;-2.67,-.94,;-4.13,-.46,;-4.45,1.04,;-5.92,1.52,;-7.06,.49,;-6.74,-1.02,;-5.28,-1.49,;-7.89,-2.05,;-8.92,-.9,;-6.85,-3.19,;-9.03,-3.08,;-10.49,-2.6,;-8.71,-4.59,;-1.42,-.03,;-1.42,1.51,;-2.75,2.28,;-4.09,1.51,;-5.42,2.28,;-2.75,3.82,;-1.42,4.59,;-.09,3.82,;-.09,2.28,;1.25,1.51,;2.58,2.28,;6.49,-.17,;7.83,-.94,;9.16,-.17,;9.16,1.37,;10.49,2.14,;7.83,2.14,;6.49,1.37,)|

BDBM481062

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc3nc(N)sc3c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.61,-3.92,;5.28,-3.15,;5.28,-1.61,;3.94,-.84,;3.94,.7,;2.61,-1.61,;1.27,-2.38,;3.94,-2.38,;1.27,-.84,;-.06,-1.61,;-.54,-3.07,;-2.08,-3.07,;-2.55,-1.61,;-4.02,-1.13,;-4.34,.37,;-5.8,.85,;-6.95,-.18,;-8.48,-.02,;-9.1,-1.43,;-10.61,-1.75,;-7.96,-2.46,;-6.63,-1.69,;-5.16,-2.16,;-1.31,-.7,;-1.31,.84,;-2.64,1.61,;-3.97,.84,;-5.31,1.61,;-2.64,3.15,;-1.31,3.92,;.03,3.15,;.03,1.61,;1.36,.84,;2.7,1.61,;6.61,-.84,;7.94,-1.61,;9.28,-.84,;9.28,.7,;10.61,1.47,;7.94,1.47,;6.61,.7,)|

BDBM481063

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(OC)c(c2)C#N)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.76,-3.92,;4.43,-3.15,;4.43,-1.61,;3.09,-.84,;3.09,.7,;1.76,-1.61,;.43,-2.38,;3.09,-2.38,;.43,-.84,;-.91,-1.61,;-1.38,-3.07,;-2.92,-3.07,;-3.4,-1.61,;-4.86,-1.13,;-5.18,.37,;-6.65,.85,;-7.79,-.18,;-9.26,.3,;-9.58,1.8,;-7.47,-1.69,;-6.01,-2.16,;-8.62,-2.72,;-9.76,-3.75,;-2.15,-.7,;-2.15,.84,;-3.49,1.61,;-4.82,.84,;-6.15,1.61,;-3.49,3.15,;-2.15,3.92,;-.82,3.15,;-.82,1.61,;.51,.84,;1.85,1.61,;5.76,-.84,;7.09,-1.61,;8.43,-.84,;8.43,.7,;9.76,1.47,;7.09,1.47,;5.76,.7,)|

BDBM481064

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.92,-3.92,;4.59,-3.15,;4.59,-1.61,;3.25,-.84,;3.25,.7,;1.92,-1.61,;.59,-2.38,;3.25,-2.38,;.59,-.84,;-.75,-1.61,;-1.22,-3.07,;-2.76,-3.07,;-3.24,-1.61,;-4.7,-1.13,;-5.02,.37,;-6.49,.85,;-7.63,-.18,;-7.31,-1.69,;-8.46,-2.72,;-9.92,-2.24,;-5.85,-2.16,;-1.99,-.7,;-1.99,.84,;-3.33,1.61,;-4.66,.84,;-5.99,1.61,;-3.33,3.15,;-1.99,3.92,;-.66,3.15,;-.66,1.61,;.67,.84,;2.01,1.61,;5.92,-.84,;7.25,-1.61,;8.59,-.84,;8.59,.7,;9.92,1.47,;7.25,1.47,;5.92,.7,)|

BDBM481065

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(4.78,-3.92,;3.44,-3.15,;3.44,-1.61,;2.11,-.84,;2.11,.7,;.78,-1.61,;-.56,-2.38,;2.11,-2.38,;-.56,-.84,;-1.89,-1.61,;-2.37,-3.07,;-3.91,-3.07,;-4.38,-1.61,;-5.85,-1.13,;-6.17,.37,;-7.63,.85,;-8.78,-.18,;-8.46,-1.69,;-6.99,-2.16,;-3.14,-.7,;-3.14,.84,;-4.47,1.61,;-5.81,.84,;-7.14,1.61,;-4.47,3.15,;-3.14,3.92,;-1.8,3.15,;-1.8,1.61,;-.47,.84,;.86,1.61,;4.78,-.84,;6.11,-1.61,;7.44,-.84,;7.44,.7,;8.78,1.47,;6.11,1.47,;4.78,.7,)|

BDBM481066

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)cc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.52,-3.92,;4.19,-3.15,;4.19,-1.61,;2.85,-.84,;2.85,.7,;1.52,-1.61,;.19,-2.38,;2.85,-2.38,;.19,-.84,;-1.15,-1.61,;-1.62,-3.07,;-3.16,-3.07,;-3.64,-1.61,;-5.1,-1.13,;-5.42,.37,;-6.89,.85,;-8.03,-.18,;-9.52,.11,;-7.71,-1.69,;-6.25,-2.16,;-2.39,-.7,;-2.39,.84,;-3.73,1.61,;-5.06,.84,;-6.4,1.61,;-3.73,3.15,;-2.39,3.92,;-1.06,3.15,;-1.06,1.61,;.27,.84,;1.61,1.61,;5.52,-.84,;6.85,-1.61,;8.19,-.84,;8.19,.7,;9.52,1.47,;6.85,1.47,;5.52,.7,)|

BDBM481067

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(OC)ccc2OC)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.1,-3.8,;3.76,-3.03,;3.76,-1.49,;2.43,-.72,;2.43,.82,;1.1,-1.49,;-.24,-2.26,;2.43,-2.26,;-.24,-.72,;-1.57,-1.49,;-2.05,-2.96,;-3.59,-2.96,;-4.06,-1.49,;-5.53,-1.02,;-5.85,.49,;-7.31,.96,;-7.63,2.47,;-9.1,2.95,;-8.46,-.07,;-8.14,-1.57,;-6.67,-2.05,;-6.35,-3.56,;-4.89,-4.03,;-2.82,-.59,;-2.82,.95,;-4.15,1.72,;-5.49,.95,;-6.82,1.72,;-4.15,3.26,;-2.82,4.03,;-1.48,3.26,;-1.48,1.72,;-.15,.95,;1.18,1.72,;5.1,-.72,;6.43,-1.49,;7.76,-.72,;7.76,.82,;9.1,1.59,;6.43,1.59,;5.1,.82,)|

BDBM481068

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc3OCCc3c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.86,-3.92,;4.52,-3.15,;4.52,-1.61,;3.19,-.84,;3.19,.7,;1.85,-1.61,;.52,-2.38,;3.19,-2.38,;.52,-.84,;-.81,-1.61,;-1.29,-3.07,;-2.83,-3.07,;-3.3,-1.61,;-4.77,-1.13,;-5.09,.37,;-6.55,.85,;-7.7,-.18,;-9.23,-.02,;-9.86,-1.43,;-8.71,-2.46,;-7.38,-1.69,;-5.91,-2.16,;-2.06,-.7,;-2.06,.84,;-3.39,1.61,;-4.73,.84,;-6.06,1.61,;-3.39,3.15,;-2.06,3.92,;-.73,3.15,;-.73,1.61,;.61,.84,;1.94,1.61,;5.86,-.84,;7.19,-1.61,;8.52,-.84,;8.52,.7,;9.86,1.47,;7.19,1.47,;5.86,.7,)|

BDBM481069

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(Br)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.19,-3.92,;3.86,-3.15,;3.86,-1.61,;2.52,-.84,;2.52,.7,;1.19,-1.61,;-.15,-2.38,;2.52,-2.38,;-.15,-.84,;-1.48,-1.61,;-1.96,-3.07,;-3.5,-3.07,;-3.97,-1.61,;-5.44,-1.13,;-5.76,.37,;-7.22,.85,;-8.37,-.18,;-8.05,-1.69,;-9.19,-2.72,;-6.58,-2.16,;-2.73,-.7,;-2.73,.84,;-4.06,1.61,;-5.39,.84,;-6.73,1.61,;-4.06,3.15,;-2.73,3.92,;-1.39,3.15,;-1.39,1.61,;-.06,.84,;1.28,1.61,;5.19,-.84,;6.52,-1.61,;7.86,-.84,;7.86,.7,;9.19,1.47,;6.52,1.47,;5.19,.7,)|

BDBM481070

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(Oc3ccccc3)cc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(7.39,-3.92,;6.05,-3.15,;6.05,-1.61,;4.72,-.84,;4.72,.7,;3.38,-1.61,;2.05,-2.38,;4.72,-2.38,;2.05,-.84,;.72,-1.61,;.24,-3.07,;-1.3,-3.07,;-1.77,-1.61,;-3.24,-1.13,;-3.56,.37,;-5.02,.85,;-6.17,-.18,;-7.63,.3,;-8.78,-.73,;-10.24,-.26,;-11.39,-1.29,;-11.07,-2.8,;-9.6,-3.27,;-8.46,-2.24,;-5.85,-1.69,;-4.38,-2.16,;-.53,-.7,;-.53,.84,;-1.86,1.61,;-3.2,.84,;-4.53,1.61,;-1.86,3.15,;-.53,3.92,;.8,3.15,;.8,1.61,;2.14,.84,;3.47,1.61,;7.39,-.84,;8.72,-1.61,;10.05,-.84,;10.05,.7,;11.39,1.47,;8.72,1.47,;7.39,.7,)|

BDBM481071

CCN(CC)c1ccc(cc1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:21.22,19.20,(-10.81,-.26,;-9.35,-.73,;-8.21,.3,;-8.53,1.8,;-7.38,2.83,;-6.74,-.18,;-5.6,.85,;-4.13,.37,;-3.81,-1.13,;-4.96,-2.16,;-6.42,-1.69,;-2.35,-1.61,;-1.87,-3.07,;-.33,-3.07,;.15,-1.61,;1.48,-.84,;2.81,-1.61,;1.48,-2.38,;4.15,-2.38,;4.15,-.84,;4.15,.7,;5.48,-1.61,;5.48,-3.15,;6.81,-3.92,;6.81,-.84,;8.15,-1.61,;9.48,-.84,;9.48,.7,;10.81,1.47,;8.15,1.47,;6.81,.7,;-1.1,-.7,;-1.1,.84,;-2.43,1.61,;-3.77,.84,;-5.1,1.61,;-2.43,3.15,;-1.1,3.92,;.23,3.15,;.23,1.61,;1.57,.84,;2.9,1.61,)|

BDBM481072

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc3nccnc3c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.08,-3.92,;4.75,-3.15,;4.75,-1.61,;3.41,-.84,;3.41,.7,;2.08,-1.61,;.75,-2.38,;3.41,-2.38,;.75,-.84,;-.59,-1.61,;-1.06,-3.07,;-2.6,-3.07,;-3.08,-1.61,;-4.54,-1.13,;-4.86,.37,;-6.33,.85,;-7.47,-.18,;-8.94,.3,;-10.08,-.73,;-9.76,-2.24,;-8.3,-2.72,;-7.15,-1.69,;-5.69,-2.16,;-1.83,-.7,;-1.83,.84,;-3.17,1.61,;-4.5,.84,;-5.83,1.61,;-3.17,3.15,;-1.83,3.92,;-.5,3.15,;-.5,1.61,;.83,.84,;2.17,1.61,;6.08,-.84,;7.41,-1.61,;8.75,-.84,;8.75,.7,;10.08,1.47,;7.41,1.47,;6.08,.7,)|

BDBM481073

CO[C@@H]([C@H](C)S(=O)(=O)N\C(NNC(=O)c1cccc(F)c1)=N/c1c(OC)cccc1OC)c1ncc(C)cn1 |r|

BDBM481074

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(c2)C#N)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.76,-3.92,;4.43,-3.15,;4.43,-1.61,;3.09,-.84,;3.09,.7,;1.76,-1.61,;.43,-2.38,;3.09,-2.38,;.43,-.84,;-.91,-1.61,;-1.38,-3.07,;-2.92,-3.07,;-3.4,-1.61,;-4.86,-1.13,;-5.18,.37,;-6.65,.85,;-7.79,-.18,;-7.51,-1.72,;-6.01,-2.16,;-8.66,-2.75,;-9.8,-3.78,;-2.15,-.7,;-2.15,.84,;-3.49,1.61,;-4.82,.84,;-6.15,1.61,;-3.49,3.15,;-2.15,3.92,;-.82,3.15,;-.82,1.61,;.51,.84,;1.85,1.61,;5.76,-.84,;7.09,-1.61,;8.43,-.84,;8.43,.7,;9.76,1.47,;7.09,1.47,;5.76,.7,)|

BDBM481075

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(Cl)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.19,-3.92,;3.86,-3.15,;3.86,-1.61,;2.52,-.84,;2.52,.7,;1.19,-1.61,;-.15,-2.38,;2.52,-2.38,;-.15,-.84,;-1.48,-1.61,;-1.96,-3.07,;-3.5,-3.07,;-3.97,-1.61,;-5.44,-1.13,;-5.76,.37,;-7.22,.85,;-8.37,-.18,;-8.05,-1.69,;-9.19,-2.72,;-6.58,-2.16,;-2.73,-.7,;-2.73,.84,;-4.06,1.61,;-5.39,.84,;-6.73,1.61,;-4.06,3.15,;-2.73,3.92,;-1.39,3.15,;-1.39,1.61,;-.06,.84,;1.28,1.61,;5.19,-.84,;6.52,-1.61,;7.86,-.84,;7.86,.7,;9.19,1.47,;6.52,1.47,;5.19,.7,)|

BDBM481076

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(c2)[C@](C)(O)C(F)(F)F)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |wU:19.19,wD:19.21,2.1,3.3,(13.38,-6.31,;11.92,-6.78,;11.6,-8.29,;10.13,-8.77,;9.81,-10.27,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;7.85,-6.7,;6.38,-7.18,;5.91,-8.64,;4.37,-8.64,;3.89,-7.18,;2.42,-6.7,;1.28,-7.73,;-.18,-7.26,;-.5,-5.75,;.64,-4.72,;2.1,-5.2,;.32,-3.22,;-1.19,-3.54,;1.83,-2.9,;-0,-1.71,;-.32,-.2,;-1.51,-2.03,;1.51,-1.39,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,)|

BDBM481077

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC(F)(F)F)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(6.6,-4.26,;5.26,-3.49,;5.26,-1.95,;3.93,-1.18,;3.93,.36,;2.6,-1.95,;1.83,-3.29,;3.37,-3.29,;1.51,-.86,;.02,-1.26,;-.46,-2.73,;-2,-2.73,;-2.47,-1.26,;-3.96,-.86,;-4.36,.62,;-5.84,1.02,;-6.93,-.07,;-6.54,-1.55,;-7.62,-2.64,;-9.11,-2.24,;-10.2,-3.33,;-9.51,-.76,;-10.6,-1.85,;-5.05,-1.95,;-1.23,-.36,;-1.23,1.18,;-2.56,1.95,;-3.89,1.18,;-5.23,1.95,;-2.56,3.49,;-1.23,4.26,;.11,3.49,;.11,1.95,;1.44,1.18,;2.78,1.95,;6.6,-1.18,;7.93,-1.95,;9.27,-1.18,;9.27,.36,;10.6,1.13,;7.93,1.13,;6.6,.36,)|

BDBM481078

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3ncccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(2.31,3.16,;.78,3,;-.12,4.24,;-1.65,4.08,;-2.56,5.33,;-2.28,2.68,;-3.69,3.3,;-.87,2.05,;-2.91,1.27,;-2,.02,;-.46,.02,;.01,-1.44,;-1.23,-2.35,;-1.23,-3.89,;-2.57,-4.66,;-2.57,-6.2,;-1.23,-6.97,;.1,-6.2,;1.44,-6.97,;2.77,-6.2,;2.77,-4.66,;1.44,-3.89,;.1,-4.66,;-2.48,-1.44,;-3.94,-1.92,;-5.09,-.89,;-4.77,.62,;-5.91,1.65,;-6.55,-1.36,;-6.87,-2.87,;-5.73,-3.9,;-4.26,-3.42,;-3.12,-4.45,;-3.44,-5.96,;.5,5.65,;-.4,6.9,;.22,8.3,;1.76,8.47,;2.38,9.87,;2.66,7.22,;2.04,5.81,)|

BDBM481079

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3cn(C)nc23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.58,5.97,;.68,4.73,;-.85,4.89,;-1.76,3.64,;-3.29,3.8,;-1.13,2.23,;-2.54,1.61,;.27,2.86,;-.51,.83,;-1.41,-.42,;-2.95,-.42,;-3.43,-1.88,;-2.18,-2.79,;-2.18,-4.33,;-.85,-5.1,;-.85,-6.64,;-2.18,-7.41,;-3.51,-6.64,;-4.98,-7.11,;-5.88,-5.87,;-7.42,-5.87,;-4.98,-4.62,;-3.51,-5.1,;-.93,-1.88,;.53,-2.36,;.85,-3.87,;-.29,-4.9,;.03,-6.4,;2.31,-4.34,;3.46,-3.31,;3.14,-1.8,;1.67,-1.33,;1.35,.18,;2.5,1.21,;-1.48,6.29,;-3.01,6.45,;-3.64,7.86,;-2.73,9.11,;-3.36,10.51,;-1.2,8.95,;-.57,7.54,)|

BDBM481080

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3cn(C)nc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.58,5.97,;.68,4.73,;-.85,4.89,;-1.76,3.64,;-3.29,3.8,;-1.13,2.23,;-2.54,1.61,;.27,2.86,;-.51,.83,;-1.41,-.42,;-2.95,-.42,;-3.43,-1.88,;-2.18,-2.79,;-2.18,-4.33,;-.85,-5.1,;-.85,-6.64,;-2.18,-7.41,;-3.51,-6.64,;-4.98,-7.11,;-5.88,-5.87,;-7.42,-5.87,;-4.98,-4.62,;-3.51,-5.1,;-.93,-1.88,;.53,-2.36,;.85,-3.87,;-.29,-4.9,;.03,-6.4,;2.31,-4.34,;3.46,-3.31,;3.14,-1.8,;1.67,-1.33,;1.35,.18,;2.5,1.21,;-1.48,6.29,;-3.01,6.45,;-3.64,7.86,;-2.73,9.11,;-3.36,10.51,;-1.2,8.95,;-.57,7.54,)|

BDBM481081

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3cn(C)nc23)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.58,5.97,;.68,4.73,;-.85,4.89,;-1.76,3.64,;-3.29,3.8,;-1.13,2.23,;-2.54,1.61,;.27,2.86,;-.51,.83,;-1.41,-.42,;-2.95,-.42,;-3.43,-1.88,;-2.18,-2.79,;-2.18,-4.33,;-.85,-5.1,;-.85,-6.64,;-2.18,-7.41,;-3.51,-6.64,;-4.98,-7.11,;-5.88,-5.87,;-7.42,-5.87,;-4.98,-4.62,;-3.51,-5.1,;-.93,-1.88,;.53,-2.36,;.85,-3.87,;-.29,-4.9,;.03,-6.4,;2.31,-4.34,;3.46,-3.31,;3.14,-1.8,;1.67,-1.33,;1.35,.18,;2.5,1.21,;-1.48,6.29,;-3.01,6.45,;-3.64,7.86,;-2.73,9.11,;-3.36,10.51,;-1.2,8.95,;-.57,7.54,)|

BDBM481082

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3cn(C)nc23)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.58,5.97,;.68,4.73,;-.85,4.89,;-1.76,3.64,;-3.29,3.8,;-1.13,2.23,;-2.54,1.61,;.27,2.86,;-.51,.83,;-1.41,-.42,;-2.95,-.42,;-3.43,-1.88,;-2.18,-2.79,;-2.18,-4.33,;-.85,-5.1,;-.85,-6.64,;-2.18,-7.41,;-3.51,-6.64,;-4.98,-7.11,;-5.88,-5.87,;-7.42,-5.87,;-4.98,-4.62,;-3.51,-5.1,;-.93,-1.88,;.53,-2.36,;.85,-3.87,;-.29,-4.9,;.03,-6.4,;2.31,-4.34,;3.46,-3.31,;3.14,-1.8,;1.67,-1.33,;1.35,.18,;2.5,1.21,;-1.48,6.29,;-3.01,6.45,;-3.64,7.86,;-2.73,9.11,;-3.36,10.51,;-1.2,8.95,;-.57,7.54,)|

BDBM481083

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3cnccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-4.28,6.1,;-3.38,4.85,;-1.85,5.01,;-.94,3.77,;.59,3.93,;-1.57,2.36,;-.16,1.73,;-2.97,2.99,;-2.19,.95,;-1.29,-.29,;.25,-.29,;.73,-1.76,;-.52,-2.66,;-.52,-4.2,;-1.85,-4.97,;-1.85,-6.51,;-.52,-7.28,;.81,-6.51,;2.15,-7.28,;3.48,-6.51,;3.48,-4.97,;2.15,-4.2,;.81,-4.97,;-1.76,-1.76,;-3.23,-2.23,;-4.37,-1.2,;-4.05,.3,;-5.2,1.33,;-5.84,-1.68,;-6.16,-3.19,;-5.01,-4.22,;-3.55,-3.74,;-2.41,-4.77,;-2.73,-6.28,;-1.22,6.42,;-2.13,7.66,;-1.5,9.07,;.03,9.23,;.66,10.64,;.94,7.99,;.31,6.58,)|

BDBM481084

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccc1

BDBM481085

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccc1

BDBM481086

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM481087

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1C1(C)CC1)c1ncc(C)cn1 |r|

BDBM481088

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM481089

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc2nn(C)cc12 |r|

BDBM481090

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3nn(C)cc23)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM481091

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3nn(C)cc23)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM481092

COCC1(CCC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc2nn(C)cc12 |r|

BDBM481093

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2OC)n1[C@@H]1CCCOC1)c1ncc(Cl)cn1 |r|

BDBM481094

COc1cccc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1C1CCOCC1 |r|

BDBM481095

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc3nn(C)cc23)n1C1CCOCC1)c1ncc(C)cn1 |r|

BDBM481096

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(c2)S(C)(=O)=O)n1C1CC1)c1ncc(Cl)cn1

BDBM481097

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC(F)F)c2)n1C1CC1)c1ncc(Cl)cn1

BDBM481098

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r|

BDBM481099

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r|

BDBM481100

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r|

BDBM481101

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1ccccc1 |r,wU:16.17,18.19,(-7.23,1.76,;-5.9,.99,;-4.56,1.76,;-4.56,3.3,;-3.23,4.07,;-1.89,3.3,;-1.89,1.76,;-.56,.99,;.77,1.76,;-3.23,.99,;-3.23,-.55,;-1.98,-1.45,;-.52,-.98,;.63,-2.01,;-.71,-2.78,;1.72,-3.1,;2.09,-1.53,;2.41,-.03,;3.24,-2.56,;2.92,-4.07,;4.7,-2.09,;5.02,-.58,;6.49,-.11,;7.63,-1.14,;9.09,-.66,;7.31,-2.64,;5.84,-3.12,;-2.46,-2.92,;-4,-2.92,;-4.47,-1.45,;-6.01,-1.45,;-6.78,-.12,;-8.32,-.12,;-9.09,-1.45,;-8.32,-2.79,;-6.78,-2.79,)|

BDBM481102

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2Br)n1C1COC(C)(C)OC1 |r|

BDBM481103

COCCn1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccccc1 |r|

BDBM499481

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CC1 |r,wU:16.17,18.19,(.03,1.41,;-1.31,.64,;-2.64,1.41,;-2.64,2.95,;-3.97,3.72,;-5.31,2.95,;-5.31,1.41,;-6.64,.64,;-7.98,1.41,;-3.97,.64,;-3.97,-.9,;-2.73,-1.81,;-1.24,-1.41,;.09,-2.18,;-1.24,-2.95,;1.43,-2.95,;1.43,-1.41,;1.43,.13,;2.76,-2.18,;2.76,-3.72,;4.09,-1.41,;5.43,-2.18,;6.76,-1.41,;6.76,.13,;8.09,.9,;5.43,.9,;4.09,.13,;-3.2,-3.27,;-4.74,-3.27,;-5.22,-1.81,;-6.76,-1.81,;-8.09,-1.04,;-8.09,-2.58,)|

BDBM499482

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(.45,1.41,;-.89,.64,;-2.22,1.41,;-2.22,2.95,;-3.55,3.72,;-4.89,2.95,;-4.89,1.41,;-6.22,.64,;-7.55,1.41,;-3.55,.64,;-3.55,-.9,;-2.31,-1.81,;-.82,-1.41,;.51,-2.18,;-.82,-2.95,;1.85,-2.95,;1.85,-1.41,;1.85,.13,;3.18,-2.18,;3.18,-3.72,;4.52,-1.41,;5.85,-2.18,;7.18,-1.41,;7.18,.13,;8.52,.9,;5.85,.9,;4.52,.13,;-2.78,-3.27,;-4.32,-3.27,;-4.8,-1.81,;-6.34,-1.81,;-7.43,-.72,;-8.52,-1.81,;-7.43,-2.9,)|

BDBM499483

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCCCC1 |r,wU:16.17,18.19,(.9,1.41,;-.43,.64,;-1.77,1.41,;-1.77,2.95,;-3.1,3.72,;-4.44,2.95,;-4.44,1.41,;-5.77,.64,;-7.1,1.41,;-3.1,.64,;-3.1,-.9,;-1.86,-1.81,;-.37,-1.41,;.97,-2.18,;-.37,-2.95,;2.3,-2.95,;2.3,-1.41,;2.3,.13,;3.63,-2.18,;3.63,-3.72,;4.97,-1.41,;6.3,-2.18,;7.63,-1.41,;7.63,.13,;8.97,.9,;6.3,.9,;4.97,.13,;-2.33,-3.27,;-3.87,-3.27,;-4.35,-1.81,;-5.89,-1.81,;-6.66,-.47,;-8.2,-.47,;-8.97,-1.81,;-8.2,-3.14,;-6.66,-3.14,)|

BDBM499484

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCCCC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(2.54,-4.26,;3.63,-3.17,;3.63,-1.63,;2.3,-.86,;2.3,.68,;.97,-1.63,;-.37,-2.4,;2.3,-2.4,;-.37,-.86,;-1.86,-1.26,;-2.33,-2.73,;-3.87,-2.73,;-4.35,-1.26,;-5.89,-1.26,;-6.66,.07,;-8.2,.07,;-8.97,-1.26,;-8.2,-2.6,;-6.66,-2.6,;-3.1,-.36,;-3.1,1.18,;-1.77,1.95,;-.43,1.18,;.9,1.95,;-1.77,3.49,;-3.1,4.26,;-4.44,3.49,;-4.44,1.95,;-5.77,1.18,;-7.1,1.95,;4.97,-.86,;6.3,-1.63,;7.63,-.86,;7.63,.68,;8.97,1.45,;6.3,1.45,;4.97,.68,)|

BDBM499485

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(2.09,-4.26,;3.18,-3.17,;3.18,-1.63,;1.85,-.86,;1.85,.68,;.51,-1.63,;-.82,-2.4,;1.85,-2.4,;-.82,-.86,;-2.31,-1.26,;-2.78,-2.73,;-4.32,-2.73,;-4.8,-1.26,;-6.34,-1.26,;-7.43,-.17,;-8.52,-1.26,;-7.43,-2.35,;-3.55,-.36,;-3.55,1.18,;-2.22,1.95,;-.89,1.18,;.45,1.95,;-2.22,3.49,;-3.55,4.26,;-4.89,3.49,;-4.89,1.95,;-6.22,1.18,;-7.55,1.95,;4.52,-.86,;5.85,-1.63,;7.18,-.86,;7.18,.68,;8.52,1.45,;5.85,1.45,;4.52,.68,)|

BDBM499486

CO[C@@H]([C@H](C)S(=O)(=O)N\C(S)=N/c1c(OC)cccc1OC)c1ncc(C)cn1 |r|

BDBM499487

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCCC1 |r,wU:16.17,18.19,(.58,1.37,;-.75,.6,;-2.09,1.37,;-2.09,2.91,;-3.42,3.68,;-4.76,2.91,;-4.76,1.37,;-6.09,.6,;-7.42,1.37,;-3.42,.6,;-3.42,-.94,;-2.18,-1.85,;-.71,-1.37,;.62,-2.14,;-.71,-2.91,;1.96,-2.91,;1.96,-1.37,;1.96,.17,;3.29,-2.14,;3.29,-3.68,;4.62,-1.37,;5.96,-2.14,;7.29,-1.37,;7.29,.17,;8.62,.94,;5.96,.94,;4.62,.17,;-2.65,-3.31,;-4.19,-3.31,;-4.67,-1.85,;-6.13,-1.37,;-6.61,.1,;-8.15,.1,;-8.62,-1.37,;-7.38,-2.27,)|

BDBM499488

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCCC1 |r,wU:16.17,18.19,(.58,1.37,;-.75,.6,;-2.09,1.37,;-2.09,2.91,;-3.42,3.68,;-4.76,2.91,;-4.76,1.37,;-6.09,.6,;-7.42,1.37,;-3.42,.6,;-3.42,-.94,;-2.18,-1.85,;-.71,-1.37,;.62,-2.14,;-.71,-2.91,;1.96,-2.91,;1.96,-1.37,;1.96,.17,;3.29,-2.14,;3.29,-3.68,;4.62,-1.37,;5.96,-2.14,;7.29,-1.37,;7.29,.17,;8.62,.94,;5.96,.94,;4.62,.17,;-2.65,-3.31,;-4.19,-3.31,;-4.67,-1.85,;-6.13,-1.37,;-6.61,.1,;-8.15,.1,;-8.62,-1.37,;-7.38,-2.27,)|

BDBM499489

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1CCCC1 |r,wU:16.17,18.19,(.58,1.37,;-.75,.6,;-2.09,1.37,;-2.09,2.91,;-3.42,3.68,;-4.76,2.91,;-4.76,1.37,;-6.09,.6,;-7.42,1.37,;-3.42,.6,;-3.42,-.94,;-2.18,-1.85,;-.71,-1.37,;.62,-2.14,;-.71,-2.91,;1.96,-2.91,;1.96,-1.37,;1.96,.17,;3.29,-2.14,;3.29,-3.68,;4.62,-1.37,;5.96,-2.14,;7.29,-1.37,;7.29,.17,;8.62,.94,;5.96,.94,;4.62,.17,;-2.65,-3.31,;-4.19,-3.31,;-4.67,-1.85,;-6.13,-1.37,;-6.61,.1,;-8.15,.1,;-8.62,-1.37,;-7.38,-2.27,)|

BDBM499490

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC2(C)C)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM499492

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC2(C)C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,(4.87,1.73,;3.54,2.5,;3.54,4.04,;2.21,4.81,;2.21,6.35,;.87,4.04,;-.46,3.27,;2.21,3.27,;-.46,4.81,;-1.93,4.33,;-2.4,2.87,;-3.94,2.87,;-4.42,4.33,;-5.88,4.81,;-6.91,5.95,;-7.39,4.49,;-7.39,2.95,;-8.88,4.89,;-3.17,5.24,;-3.17,6.78,;-1.84,7.55,;-.5,6.78,;.83,7.55,;-1.84,9.09,;-3.17,9.86,;-4.5,9.09,;-4.5,7.55,;-5.84,6.78,;-7.17,7.55,;4.87,4.81,;6.21,4.04,;7.54,4.81,;7.54,6.35,;8.88,7.12,;6.21,7.12,;4.87,6.35,)|

BDBM499493

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC2(C)C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.87,1.73,;3.54,2.5,;3.54,4.04,;2.21,4.81,;2.21,6.35,;.87,4.04,;-.46,3.27,;2.21,3.27,;-.46,4.81,;-1.93,4.33,;-2.4,2.87,;-3.94,2.87,;-4.42,4.33,;-5.88,4.81,;-6.91,5.95,;-7.39,4.49,;-7.39,2.95,;-8.88,4.89,;-3.17,5.24,;-3.17,6.78,;-1.84,7.55,;-.5,6.78,;.83,7.55,;-1.84,9.09,;-3.17,9.86,;-4.5,9.09,;-4.5,7.55,;-5.84,6.78,;-7.17,7.55,;4.87,4.81,;6.21,4.04,;7.54,4.81,;7.54,6.35,;8.88,7.12,;6.21,7.12,;4.87,6.35,)|

BDBM499494

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.13,-4.06,;2.8,-3.29,;2.8,-1.75,;1.46,-.98,;1.46,.56,;.13,-1.75,;-1.2,-2.52,;1.46,-2.52,;-1.2,-.98,;-2.67,-1.46,;-3.14,-2.93,;-4.68,-2.93,;-5.16,-1.46,;-6.63,-.98,;-7.66,.16,;-8.13,-1.3,;-3.91,-.56,;-3.91,.98,;-2.58,1.75,;-1.25,.98,;.09,1.75,;-2.58,3.29,;-3.91,4.06,;-5.25,3.29,;-5.25,1.75,;-6.58,.98,;-7.92,1.75,;4.13,-.98,;5.46,-1.75,;6.8,-.98,;6.8,.56,;8.13,1.33,;5.46,1.33,;4.13,.56,)|

BDBM499495

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC2(C)C)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.87,1.73,;3.54,2.5,;3.54,4.04,;2.21,4.81,;2.21,6.35,;.87,4.04,;-.46,3.27,;2.21,3.27,;-.46,4.81,;-1.93,4.33,;-2.4,2.87,;-3.94,2.87,;-4.42,4.33,;-5.88,4.81,;-6.91,5.95,;-7.39,4.49,;-7.39,2.95,;-8.88,4.89,;-3.17,5.24,;-3.17,6.78,;-1.84,7.55,;-.5,6.78,;.83,7.55,;-1.84,9.09,;-3.17,9.86,;-4.5,9.09,;-4.5,7.55,;-5.84,6.78,;-7.17,7.55,;4.87,4.81,;6.21,4.04,;7.54,4.81,;7.54,6.35,;8.88,7.12,;6.21,7.12,;4.87,6.35,)|

BDBM499497

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(n1-c1c(OC)ncnc1OC)C12C3C4C5C3C1C5C24)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(2.28,-11.72,;3.77,-11.32,;4.16,-9.84,;3.08,-8.75,;3.47,-7.26,;1.59,-9.15,;1.59,-10.69,;.25,-9.92,;.25,-8.38,;-1.17,-9.28,;-1.64,-10.75,;-3.18,-10.75,;-3.66,-9.28,;-2.41,-8.38,;-2.41,-6.84,;-3.75,-6.07,;-5.08,-6.84,;-6.41,-6.07,;-3.75,-4.53,;-2.41,-3.76,;-1.08,-4.53,;-1.08,-6.07,;.25,-6.84,;1.59,-6.07,;-5.2,-9.28,;-6.29,-10.37,;-6.29,-11.91,;-7.38,-10.82,;-7.38,-9.28,;-6.29,-8.19,;-6.29,-9.73,;-5.2,-10.82,;5.65,-9.44,;6.74,-10.53,;8.23,-10.13,;8.63,-8.64,;10.11,-8.24,;7.54,-7.55,;6.05,-7.95,)|

BDBM499498

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H]2F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,16.17,wD:13.12,(4.5,1.22,;3.17,1.99,;3.17,3.53,;1.84,4.3,;1.84,5.84,;.5,3.53,;-.83,2.76,;1.84,2.76,;-.83,4.3,;-2.3,3.82,;-2.77,2.36,;-4.31,2.36,;-4.79,3.82,;-6.33,3.82,;-7.42,4.91,;-8.51,3.82,;-7.42,2.73,;-7.42,1.19,;-3.54,4.73,;-3.54,6.27,;-4.87,7.04,;-6.21,6.27,;-7.54,7.04,;-4.87,8.58,;-3.54,9.35,;-2.21,8.58,;-2.21,7.04,;-.87,6.27,;.46,7.04,;4.5,4.3,;5.84,3.53,;7.17,4.3,;7.17,5.84,;8.51,6.61,;5.84,6.61,;4.5,5.84,)|

BDBM499499

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H]2C(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,16.17,wD:13.12,(4.63,1.74,;3.29,2.51,;3.29,4.05,;1.96,4.82,;1.96,6.36,;.63,4.05,;-.71,3.28,;1.96,3.28,;-.71,4.82,;-2.17,4.34,;-2.65,2.88,;-4.19,2.88,;-4.66,4.34,;-6.2,4.34,;-7.29,5.43,;-8.38,4.34,;-7.29,3.25,;-7.29,1.71,;-5.96,.94,;-8.63,.94,;-3.42,5.25,;-3.42,6.79,;-4.75,7.56,;-6.09,6.79,;-7.42,7.56,;-4.75,9.1,;-3.42,9.87,;-2.09,9.1,;-2.09,7.56,;-.75,6.79,;.58,7.56,;4.63,4.82,;5.96,4.05,;7.29,4.82,;7.29,6.36,;8.63,7.13,;5.96,7.13,;4.63,6.36,)|

BDBM499500

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)ncnc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(4.44,-3.92,;3.1,-3.15,;3.1,-1.61,;1.77,-.84,;1.77,.7,;.44,-1.61,;-.33,-2.94,;1.21,-2.94,;-.9,-.84,;-2.23,-1.61,;-2.71,-3.07,;-4.25,-3.07,;-4.72,-1.61,;-6.26,-1.61,;-7.35,-.52,;-8.44,-1.61,;-7.35,-2.7,;-3.48,-.7,;-3.48,.84,;-4.81,1.61,;-6.14,.84,;-7.48,1.61,;-4.81,3.15,;-3.48,3.92,;-2.14,3.15,;-2.14,1.61,;-.81,.84,;.53,1.61,;4.44,-.84,;4.44,.7,;5.77,1.47,;7.11,.7,;8.44,1.47,;7.11,-.84,;5.77,-1.61,)|

BDBM499501

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1C1CCC1 |r,wU:16.17,wD:18.19,(-7.48,2.38,;-6.14,1.61,;-4.81,2.38,;-4.81,3.92,;-3.48,4.69,;-2.14,3.92,;-2.14,2.38,;-.81,1.61,;.53,2.38,;-3.48,1.61,;-3.48,.07,;-2.23,-.84,;-.9,-.07,;.44,-.84,;-.33,-2.17,;1.21,-2.17,;1.77,-.07,;1.77,1.47,;3.1,-.84,;3.1,-2.38,;4.44,-3.15,;4.44,-4.69,;5.77,-2.38,;4.44,-.07,;5.77,-.84,;7.11,-.07,;7.11,1.47,;8.44,2.24,;5.77,2.24,;4.44,1.47,;-2.71,-2.3,;-4.25,-2.3,;-4.72,-.84,;-6.26,-.84,;-7.35,.25,;-8.44,-.84,;-7.35,-1.93,)|

BDBM499502

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(-7.48,1.22,;-6.14,.45,;-4.81,1.22,;-4.81,2.76,;-3.48,3.53,;-2.14,2.76,;-2.14,1.22,;-.81,.45,;.53,1.22,;-3.48,.45,;-3.48,-1.09,;-2.23,-1.99,;-.9,-1.22,;.44,-1.99,;-.33,-3.33,;1.21,-3.33,;1.77,-1.22,;1.77,.32,;3.1,-1.99,;3.1,-3.53,;4.44,-1.22,;5.77,-1.99,;7.11,-1.22,;7.11,.32,;8.44,1.09,;5.77,1.09,;4.44,.32,;-2.71,-3.46,;-4.25,-3.46,;-4.72,-1.99,;-6.26,-1.99,;-7.35,-.9,;-8.44,-1.99,;-7.35,-3.08,)|

BDBM499503

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(-7.48,1.22,;-6.14,.45,;-4.81,1.22,;-4.81,2.76,;-3.48,3.53,;-2.14,2.76,;-2.14,1.22,;-.81,.45,;.53,1.22,;-3.48,.45,;-3.48,-1.09,;-2.23,-1.99,;-.9,-1.22,;.44,-1.99,;-.33,-3.33,;1.21,-3.33,;1.77,-1.22,;1.77,.32,;3.1,-1.99,;3.1,-3.53,;4.44,-1.22,;5.77,-1.99,;7.11,-1.22,;7.11,.32,;8.44,1.09,;5.77,1.09,;4.44,.32,;-2.71,-3.46,;-4.25,-3.46,;-4.72,-1.99,;-6.26,-1.99,;-7.35,-.9,;-8.44,-1.99,;-7.35,-3.08,)|

BDBM499504

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1C1CCC1 |r,wU:16.17,wD:18.19,(-7.48,2.38,;-6.14,1.61,;-4.81,2.38,;-4.81,3.92,;-3.48,4.69,;-2.14,3.92,;-2.14,2.38,;-.81,1.61,;.53,2.38,;-3.48,1.61,;-3.48,.07,;-2.23,-.84,;-.9,-.07,;.44,-.84,;-.33,-2.17,;1.21,-2.17,;1.77,-.07,;1.77,1.47,;3.1,-.84,;3.1,-2.38,;4.44,-3.15,;4.44,-4.69,;5.77,-2.38,;4.44,-.07,;4.44,1.47,;5.77,2.24,;7.11,1.47,;8.44,2.24,;7.11,-.07,;5.77,-.84,;-2.71,-2.3,;-4.25,-2.3,;-4.72,-.84,;-6.26,-.84,;-7.35,.25,;-8.44,-.84,;-7.35,-1.93,)|

BDBM499505

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(-7.48,1.22,;-6.14,.45,;-4.81,1.22,;-4.81,2.76,;-3.48,3.53,;-2.14,2.76,;-2.14,1.22,;-.81,.45,;.53,1.22,;-3.48,.45,;-3.48,-1.09,;-2.23,-1.99,;-.9,-1.22,;.44,-1.99,;-.33,-3.33,;1.21,-3.33,;1.77,-1.22,;1.77,.32,;3.1,-1.99,;3.1,-3.53,;4.44,-1.22,;4.44,.32,;5.77,1.09,;7.11,.32,;8.44,1.09,;7.11,-1.22,;5.77,-1.99,;-2.71,-3.46,;-4.25,-3.46,;-4.72,-1.99,;-6.26,-1.99,;-7.35,-.9,;-8.44,-1.99,;-7.35,-3.08,)|

BDBM499506

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(-7.48,1.22,;-6.14,.45,;-4.81,1.22,;-4.81,2.76,;-3.48,3.53,;-2.14,2.76,;-2.14,1.22,;-.81,.45,;.53,1.22,;-3.48,.45,;-3.48,-1.09,;-2.23,-1.99,;-.9,-1.22,;.44,-1.99,;-.33,-3.33,;1.21,-3.33,;1.77,-1.22,;1.77,.32,;3.1,-1.99,;3.1,-3.53,;4.44,-1.22,;4.44,.32,;5.77,1.09,;7.11,.32,;8.44,1.09,;7.11,-1.22,;5.77,-1.99,;-2.71,-3.46,;-4.25,-3.46,;-4.72,-1.99,;-6.26,-1.99,;-7.35,-.9,;-8.44,-1.99,;-7.35,-3.08,)|

BDBM499507

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1C1CCC1 |r,wU:16.17,wD:18.19,(-7.48,2.38,;-6.14,1.61,;-4.81,2.38,;-4.81,3.92,;-3.48,4.69,;-2.14,3.92,;-2.14,2.38,;-.81,1.61,;.53,2.38,;-3.48,1.61,;-3.48,.07,;-2.23,-.84,;-.9,-.07,;.44,-.84,;-.33,-2.17,;1.21,-2.17,;1.77,-.07,;1.77,1.47,;3.1,-.84,;3.1,-2.38,;4.44,-3.15,;4.44,-4.69,;5.77,-2.38,;4.44,-.07,;5.77,-.84,;7.11,-.07,;7.11,1.47,;8.44,2.24,;5.77,2.24,;4.44,1.47,;-2.71,-2.3,;-4.25,-2.3,;-4.72,-.84,;-6.26,-.84,;-7.35,.25,;-8.44,-.84,;-7.35,-1.93,)|

BDBM499508

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.44,-3.92,;3.1,-3.15,;3.1,-1.61,;1.77,-.84,;1.77,.7,;.44,-1.61,;-.33,-2.94,;1.21,-2.94,;-.9,-.84,;-2.23,-1.61,;-2.71,-3.07,;-4.25,-3.07,;-4.72,-1.61,;-6.26,-1.61,;-7.35,-.52,;-8.44,-1.61,;-7.35,-2.7,;-3.48,-.7,;-3.48,.84,;-4.81,1.61,;-6.14,.84,;-7.48,1.61,;-4.81,3.15,;-3.48,3.92,;-2.14,3.15,;-2.14,1.61,;-.81,.84,;.53,1.61,;4.44,-.84,;5.77,-1.61,;7.11,-.84,;7.11,.7,;8.44,1.47,;5.77,1.47,;4.44,.7,)|

BDBM499509

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)ncnc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(4.44,.82,;3.1,1.59,;3.1,3.13,;1.77,3.9,;1.77,5.44,;.44,3.13,;-.33,1.8,;1.21,1.8,;-.9,3.9,;-2.23,3.13,;-2.71,1.67,;-4.25,1.67,;-4.72,3.13,;-6.26,3.13,;-7.35,4.22,;-8.44,3.13,;-7.35,2.04,;-3.48,4.04,;-3.48,5.58,;-4.81,6.35,;-6.14,5.58,;-7.48,6.35,;-4.81,7.89,;-3.48,8.66,;-2.14,7.89,;-2.14,6.35,;-.81,5.58,;.53,6.35,;4.44,3.9,;4.44,5.44,;5.77,6.21,;7.11,5.44,;8.44,6.21,;7.11,3.9,;5.77,3.13,)|

BDBM499510

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)ncnc1OC |r,wU:10.11,8.9,(9.11,.32,;7.77,1.09,;6.44,.32,;6.44,-1.22,;5.11,-1.99,;3.77,-1.22,;3.77,.32,;5.11,1.09,;2.44,-1.99,;2.44,-3.53,;1.1,-1.22,;1.1,.32,;-.23,-1.99,;-1,-3.33,;.54,-3.33,;-1.56,-1.22,;-2.9,-1.99,;-3.37,-3.46,;-4.91,-3.46,;-5.39,-1.99,;-6.93,-1.99,;-8.02,-.9,;-9.11,-1.99,;-8.02,-3.08,;-4.14,-1.09,;-4.14,.45,;-5.48,1.22,;-6.81,.45,;-8.14,1.22,;-5.48,2.76,;-4.14,3.53,;-2.81,2.76,;-2.81,1.22,;-1.48,.45,;-.14,1.22,)|

BDBM499511

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.44,-3.92,;3.1,-3.15,;3.1,-1.61,;1.77,-.84,;1.77,.7,;.44,-1.61,;-.33,-2.94,;1.21,-2.94,;-.9,-.84,;-2.23,-1.61,;-2.71,-3.07,;-4.25,-3.07,;-4.72,-1.61,;-6.26,-1.61,;-7.35,-.52,;-8.44,-1.61,;-7.35,-2.7,;-3.48,-.7,;-3.48,.84,;-4.81,1.61,;-6.14,.84,;-7.48,1.61,;-4.81,3.15,;-3.48,3.92,;-2.14,3.15,;-2.14,1.61,;-.81,.84,;.53,1.61,;4.44,-.84,;5.77,-1.61,;7.11,-.84,;7.11,.7,;8.44,1.47,;5.77,1.47,;4.44,.7,)|

BDBM499512

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(F)cccc1F)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.44,-3.92,;3.1,-3.15,;3.1,-1.61,;1.77,-.84,;1.77,.7,;.44,-1.61,;-.33,-2.94,;1.21,-2.94,;-.9,-.84,;-2.23,-1.61,;-2.71,-3.07,;-4.25,-3.07,;-4.72,-1.61,;-6.26,-1.61,;-7.35,-.52,;-8.44,-1.61,;-7.35,-2.7,;-3.48,-.7,;-3.48,.84,;-4.81,1.61,;-6.14,.84,;-4.81,3.15,;-3.48,3.92,;-2.14,3.15,;-2.14,1.61,;-.81,.84,;4.44,-.84,;5.77,-1.61,;7.11,-.84,;7.11,.7,;8.44,1.47,;5.77,1.47,;4.44,.7,)|

BDBM499513

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1C1CCC1 |r|

BDBM499514

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1C1CCC1 |r|

BDBM499515

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM499516

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC2(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.76,.83,;3.43,1.6,;3.43,3.14,;2.09,3.91,;2.09,5.45,;.76,3.14,;-.01,1.81,;1.53,1.81,;-.57,3.91,;-1.91,3.14,;-2.38,1.67,;-3.92,1.67,;-4.4,3.14,;-5.94,3.14,;-7.27,3.91,;-7.27,2.37,;-8.76,1.97,;-6.88,.88,;-3.15,4.04,;-3.15,5.58,;-4.49,6.35,;-5.82,5.58,;-7.16,6.35,;-4.49,7.89,;-3.15,8.66,;-1.82,7.89,;-1.82,6.35,;-.49,5.58,;.85,6.35,;4.76,3.91,;6.09,3.14,;7.43,3.91,;7.43,5.45,;8.76,6.22,;6.09,6.22,;4.76,5.45,)|

BDBM499518

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC22CCOCC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(5.17,2.06,;3.84,2.83,;3.84,4.37,;2.5,5.14,;2.5,6.68,;1.17,4.37,;.4,3.03,;1.94,3.03,;-.16,5.14,;-1.5,4.37,;-1.97,2.9,;-3.51,2.9,;-3.99,4.37,;-5.53,4.37,;-6.86,5.14,;-6.86,3.6,;-8.4,3.6,;-9.17,2.26,;-8.4,.93,;-6.86,.93,;-6.09,2.26,;-2.74,5.27,;-2.74,6.81,;-4.08,7.58,;-5.41,6.81,;-6.74,7.58,;-4.08,9.12,;-2.74,9.89,;-1.41,9.12,;-1.41,7.58,;-.08,6.81,;1.26,7.58,;5.17,5.14,;6.51,4.37,;7.84,5.14,;7.84,6.68,;9.17,7.45,;6.51,7.45,;5.17,6.68,)|

BDBM499520

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC22CC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.68,.83,;3.35,1.6,;3.35,3.14,;2.02,3.91,;2.02,5.45,;.68,3.14,;-.09,1.81,;1.45,1.81,;-.65,3.91,;-1.99,3.14,;-2.46,1.68,;-4,1.68,;-4.48,3.14,;-6.02,3.14,;-7.35,3.91,;-7.35,2.37,;-8.68,1.6,;-7.35,.83,;-3.23,4.05,;-3.23,5.59,;-4.56,6.36,;-5.9,5.59,;-7.23,6.36,;-4.56,7.9,;-3.23,8.67,;-1.9,7.9,;-1.9,6.36,;-.56,5.59,;.77,6.36,;4.68,3.91,;6.02,3.14,;7.35,3.91,;7.35,5.45,;8.68,6.22,;6.02,6.22,;4.68,5.45,)|

BDBM499522

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(=C)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(5.21,-3.92,;3.87,-3.15,;3.87,-1.61,;2.54,-.84,;2.54,.7,;1.21,-1.61,;-.13,-2.38,;2.54,-2.38,;-.13,-.84,;-1.46,-1.61,;-1.94,-3.07,;-3.48,-3.07,;-3.95,-1.61,;-5.49,-1.61,;-6.58,-.52,;-7.67,-1.61,;-9.21,-1.61,;-6.58,-2.7,;-2.71,-.7,;-2.71,.84,;-4.04,1.61,;-5.37,.84,;-6.71,1.61,;-4.04,3.15,;-2.71,3.92,;-1.37,3.15,;-1.37,1.61,;-.04,.84,;1.3,1.61,;5.21,-.84,;6.54,-1.61,;7.88,-.84,;7.88,.7,;9.21,1.47,;6.54,1.47,;5.21,.7,)|

BDBM499523

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(C)(C)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(4.98,-3.92,;3.65,-3.15,;3.65,-1.61,;2.32,-.84,;2.32,.7,;.98,-1.61,;-.35,-2.38,;2.32,-2.38,;-.35,-.84,;-1.69,-1.61,;-2.16,-3.07,;-3.7,-3.07,;-4.18,-1.61,;-5.72,-1.61,;-6.81,-.52,;-7.9,-1.61,;-8.98,-.52,;-8.98,-2.7,;-6.81,-2.7,;-2.93,-.7,;-2.93,.84,;-4.26,1.61,;-5.6,.84,;-6.93,1.61,;-4.26,3.15,;-2.93,3.92,;-1.6,3.15,;-1.6,1.61,;-.26,.84,;1.07,1.61,;4.98,-.84,;6.32,-1.61,;7.65,-.84,;7.65,.7,;8.98,1.47,;6.32,1.47,;4.98,.7,)|

BDBM499524

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(C)(C)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(4.98,-3.92,;3.65,-3.15,;3.65,-1.61,;2.32,-.84,;2.32,.7,;.98,-1.61,;-.35,-2.38,;2.32,-2.38,;-.35,-.84,;-1.69,-1.61,;-2.16,-3.07,;-3.7,-3.07,;-4.18,-1.61,;-5.72,-1.61,;-6.81,-.52,;-7.9,-1.61,;-8.98,-.52,;-8.98,-2.7,;-6.81,-2.7,;-2.93,-.7,;-2.93,.84,;-4.26,1.61,;-5.6,.84,;-6.93,1.61,;-4.26,3.15,;-2.93,3.92,;-1.6,3.15,;-1.6,1.61,;-.26,.84,;1.07,1.61,;4.98,-.84,;6.32,-1.61,;7.65,-.84,;7.65,.7,;8.98,1.47,;6.32,1.47,;4.98,.7,)|

BDBM499525

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2C[C@@H](C2)C#N)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,15.17,13.12,(5.98,-3.92,;4.64,-3.15,;4.64,-1.61,;3.31,-.84,;3.31,.7,;1.98,-1.61,;.64,-2.38,;3.31,-2.38,;.64,-.84,;-.69,-1.61,;-1.17,-3.07,;-2.71,-3.07,;-3.18,-1.61,;-4.72,-1.61,;-5.81,-.52,;-6.9,-1.61,;-5.81,-2.7,;-8.44,-1.61,;-9.98,-1.61,;-1.94,-.7,;-1.94,.84,;-3.27,1.61,;-4.6,.84,;-5.94,1.61,;-3.27,3.15,;-1.94,3.92,;-.6,3.15,;-.6,1.61,;.73,.84,;2.07,1.61,;5.98,-.84,;7.31,-1.61,;8.65,-.84,;8.65,.7,;9.98,1.47,;7.31,1.47,;5.98,.7,)|

BDBM499527

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2C[C@H](CO)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,15.15,13.12,(5.59,-3.92,;4.26,-3.15,;4.26,-1.61,;2.93,-.84,;2.93,.7,;1.59,-1.61,;.26,-2.38,;2.93,-2.38,;.26,-.84,;-1.07,-1.61,;-1.55,-3.07,;-3.09,-3.07,;-3.57,-1.61,;-5.11,-1.61,;-6.2,-.52,;-7.28,-1.61,;-8.82,-1.61,;-9.59,-.27,;-6.2,-2.7,;-2.32,-.7,;-2.32,.84,;-3.65,1.61,;-4.99,.84,;-6.32,1.61,;-3.65,3.15,;-2.32,3.92,;-.99,3.15,;-.99,1.61,;.35,.84,;1.68,1.61,;5.59,-.84,;6.93,-1.61,;8.26,-.84,;8.26,.7,;9.59,1.47,;6.93,1.47,;5.59,.7,)|

BDBM499529

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1(CC1)c1ccccn1 |r,wU:16.17,18.19,(1.32,1.97,;-.01,1.2,;-1.34,1.97,;-1.39,3.54,;-2.73,4.31,;-4.06,3.54,;-4.06,2,;-5.39,1.23,;-6.57,2.22,;-2.73,1.23,;-2.73,-.31,;-1.48,-1.22,;-.15,-.45,;1.19,-1.22,;-.15,-1.99,;2.52,-1.99,;2.52,-.45,;2.52,1.09,;3.86,-1.22,;3.86,-2.76,;5.19,-.45,;6.52,-1.22,;7.86,-.45,;7.86,1.09,;9.19,1.86,;6.52,1.86,;5.19,1.09,;-1.96,-2.68,;-3.5,-2.68,;-3.97,-1.22,;-5.44,-.74,;-4.96,.72,;-6.47,.4,;-6.58,-1.77,;-8.05,-1.3,;-9.19,-2.33,;-8.87,-3.83,;-7.4,-4.31,;-6.26,-3.28,)|

BDBM499530

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1(CC1)c1ccccn1 |r,wU:16.17,18.19,(1.32,1.97,;-.01,1.2,;-1.34,1.97,;-1.39,3.54,;-2.73,4.31,;-4.06,3.54,;-4.06,2,;-5.39,1.23,;-6.57,2.22,;-2.73,1.23,;-2.73,-.31,;-1.48,-1.22,;-.15,-.45,;1.19,-1.22,;-.15,-1.99,;2.52,-1.99,;2.52,-.45,;2.52,1.09,;3.86,-1.22,;3.86,-2.76,;5.19,-.45,;6.52,-1.22,;7.86,-.45,;7.86,1.09,;9.19,1.86,;6.52,1.86,;5.19,1.09,;-1.96,-2.68,;-3.5,-2.68,;-3.97,-1.22,;-5.44,-.74,;-4.96,.72,;-6.47,.4,;-6.58,-1.77,;-8.05,-1.3,;-9.19,-2.33,;-8.87,-3.83,;-7.4,-4.31,;-6.26,-3.28,)|

BDBM499531

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM499534

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1C[C@H](CO)C1 |r,wU:13.13,15.15,28.29,wD:30.32,(-5.34,3.92,;-4.01,3.15,;-4.01,1.61,;-2.67,.84,;-1.34,1.61,;-1.34,3.15,;-.01,3.92,;-2.67,-.7,;-1.43,-1.61,;-.09,-.84,;1.24,-1.61,;-.09,-2.38,;2.57,-2.38,;2.57,-.84,;2.57,.7,;3.91,-1.61,;3.91,-3.15,;5.24,-3.92,;5.24,-.84,;6.57,-1.61,;7.91,-.84,;7.91,.7,;9.24,1.47,;6.57,1.47,;5.24,.7,;-1.9,-3.07,;-3.44,-3.07,;-3.92,-1.61,;-5.38,-1.13,;-6.76,-1.83,;-7.46,-.46,;-8.92,.02,;-9.24,1.52,;-6.08,.24,)|

BDBM499536

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1C[C@H](CO)C1 |r,wU:12.13,29.32,14.15,wD:27.29,(2.68,-.78,;1.5,-1.77,;1.77,-3.28,;.59,-4.27,;1.36,-5.61,;-.18,-5.61,;-.59,-3.28,;-.48,-1.75,;.83,-.93,;.77,.61,;-.77,.55,;2.31,.66,;.72,2.15,;-.64,2.87,;2.02,2.96,;3.38,2.24,;4.69,3.06,;1.97,4.5,;.61,5.22,;.56,6.76,;1.86,7.58,;1.81,9.12,;3.22,6.86,;3.28,5.32,;-1.91,-1.17,;-2.9,-2.35,;-2.08,-3.66,;-2.66,-5.08,;-4.08,-5.69,;-3.47,-7.1,;-4.05,-8.53,;-3.1,-9.75,;-2.06,-6.5,)|

BDBM499538

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](CO)C2)n1C1CC1)c1ncc(Cl)cn1 |r,wU:3.3,15.15,2.1,wD:13.12,(6.01,-1.27,;4.55,-.79,;4.23,.72,;2.76,1.19,;2.44,2.7,;1.62,.16,;.59,1.31,;2.65,-.98,;.47,-.87,;-.99,-.39,;-1.47,1.07,;-3.01,1.07,;-3.48,-.39,;-4.95,-.87,;-6.32,-.17,;-7.02,-1.54,;-8.48,-2.02,;-8.8,-3.52,;-5.65,-2.24,;-2.24,-1.3,;-2.24,-2.84,;-1.47,-4.17,;-3.01,-4.17,;5.37,1.75,;5.05,3.25,;6.2,4.28,;7.66,3.81,;8.81,4.84,;7.98,2.3,;6.84,1.27,)|

BDBM499540

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](CO)C2)n1C(C)C)c1ncc(Cl)cn1 |r,wU:3.3,15.15,2.1,wD:13.12,(3.49,5.16,;2.59,3.92,;1.06,4.08,;.15,2.83,;-1.38,2.99,;.78,1.43,;-.63,.8,;2.18,2.05,;1.4,.02,;.5,-1.23,;-1.04,-1.23,;-1.52,-2.69,;-.27,-3.6,;-.27,-5.14,;-1.36,-6.23,;-.27,-7.32,;-.27,-8.86,;1.06,-9.63,;.82,-6.23,;.97,-2.69,;2.44,-3.17,;3.58,-2.14,;2.76,-4.67,;.43,5.48,;-1.1,5.65,;-1.73,7.05,;-.82,8.3,;-1.45,9.71,;.71,8.14,;1.33,6.73,)|

BDBM499542

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:3.3,2.1,(-3.03,4.51,;-2.13,3.26,;-.6,3.42,;.31,2.17,;1.84,2.34,;-.32,.77,;1.09,.14,;-1.72,1.39,;-.94,-.64,;-.04,-1.89,;1.5,-1.89,;1.98,-3.35,;.73,-4.26,;.73,-5.8,;1.82,-6.88,;.73,-7.97,;-.36,-6.88,;-.51,-3.35,;-1.98,-3.83,;-3.12,-2.8,;-2.8,-1.29,;-3.95,-.26,;-4.59,-3.27,;-4.91,-4.78,;-3.76,-5.81,;-2.3,-5.33,;-1.15,-6.36,;-1.73,-7.79,;.03,4.83,;1.56,4.99,;2.19,6.39,;1.28,7.64,;1.91,9.05,;-.25,7.48,;-.87,6.07,)|

BDBM499543

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(.48,1.19,;-.85,.42,;-2.19,1.19,;-2.23,2.76,;-3.57,3.53,;-4.9,2.76,;-4.9,1.22,;-6.23,.45,;-7.41,1.44,;-3.57,.45,;-3.57,-1.09,;-2.32,-1.99,;-.99,-1.22,;.35,-1.99,;-.99,-2.76,;1.68,-2.76,;1.68,-1.22,;1.68,.32,;3.01,-1.99,;3.01,-3.53,;4.35,-1.22,;4.35,.32,;5.68,1.09,;7.01,.32,;8.35,1.09,;7.01,-1.22,;5.68,-1.99,;-2.8,-3.46,;-4.34,-3.46,;-4.81,-1.99,;-6.28,-1.52,;-6.98,-.14,;-8.35,-.84,;-7.65,-2.22,)|

BDBM499544

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1C1CCC1 |r,wU:16.17,wD:18.19,(.48,2.35,;-.85,1.58,;-2.19,2.35,;-2.23,3.92,;-3.57,4.69,;-4.9,3.92,;-4.9,2.38,;-6.23,1.61,;-7.41,2.6,;-3.57,1.61,;-3.57,.07,;-2.32,-.84,;-.99,-.07,;.35,-.84,;-.99,-1.61,;1.68,-1.61,;1.68,-.07,;1.68,1.47,;3.01,-.84,;3.01,-2.38,;4.35,-3.15,;4.35,-4.69,;5.68,-2.38,;4.35,-.07,;4.35,1.47,;5.68,2.24,;7.01,1.47,;8.35,2.24,;7.01,-.07,;5.68,-.84,;-2.8,-2.3,;-4.34,-2.3,;-4.81,-.84,;-6.28,-.36,;-6.98,1.01,;-8.35,.31,;-7.65,-1.06,)|

BDBM499545

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-3.03,4.51,;-2.13,3.26,;-.6,3.42,;.31,2.17,;1.84,2.34,;-.32,.77,;1.09,.14,;-1.72,1.39,;-.94,-.64,;-.04,-1.89,;1.5,-1.89,;1.98,-3.35,;.73,-4.26,;.73,-5.8,;1.82,-6.88,;.73,-7.97,;-.36,-6.88,;-.51,-3.35,;-1.98,-3.83,;-3.12,-2.8,;-2.8,-1.29,;-3.95,-.26,;-4.59,-3.27,;-4.91,-4.78,;-3.76,-5.81,;-2.3,-5.33,;-1.15,-6.36,;-1.73,-7.79,;.03,4.83,;-.87,6.07,;-.25,7.48,;1.28,7.64,;1.91,9.05,;2.19,6.39,;1.56,4.99,)|

BDBM499546

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1C1CCC1 |r,wU:16.17,wD:18.19,(.48,2.35,;-.85,1.58,;-2.19,2.35,;-2.23,3.92,;-3.57,4.69,;-4.9,3.92,;-4.9,2.38,;-6.23,1.61,;-7.41,2.6,;-3.57,1.61,;-3.57,.07,;-2.32,-.84,;-.99,-.07,;.35,-.84,;-.99,-1.61,;1.68,-1.61,;1.68,-.07,;1.68,1.47,;3.01,-.84,;3.01,-2.38,;4.35,-3.15,;4.35,-4.69,;5.68,-2.38,;4.35,-.07,;5.68,-.84,;7.01,-.07,;7.01,1.47,;8.35,2.24,;5.68,2.24,;4.35,1.47,;-2.8,-2.3,;-4.34,-2.3,;-4.81,-.84,;-6.28,-.36,;-6.98,1.01,;-8.35,.31,;-7.65,-1.06,)|

BDBM499547

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(.48,1.19,;-.85,.42,;-2.19,1.19,;-2.23,2.76,;-3.57,3.53,;-4.9,2.76,;-4.9,1.22,;-6.23,.45,;-7.41,1.44,;-3.57,.45,;-3.57,-1.09,;-2.32,-1.99,;-.99,-1.22,;.35,-1.99,;-.99,-2.76,;1.68,-2.76,;1.68,-1.22,;1.68,.32,;3.01,-1.99,;3.01,-3.53,;4.35,-1.22,;5.68,-1.99,;7.01,-1.22,;7.01,.32,;8.35,1.09,;5.68,1.09,;4.35,.32,;-2.8,-3.46,;-4.34,-3.46,;-4.81,-1.99,;-6.28,-1.52,;-6.98,-.14,;-8.35,-.84,;-7.65,-2.22,)|

BDBM499548

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@@H](CC2)C(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,16.19,(-6.71,0,;-5.24,-.48,;-4.92,-1.98,;-3.46,-2.46,;-3.14,-3.96,;-2.31,-1.43,;-1.28,-2.57,;-3.34,-.28,;-1.17,-.4,;.3,-.87,;.77,-2.34,;2.31,-2.34,;2.79,-.87,;4.25,-.4,;4.57,1.11,;6.04,1.59,;7.18,.56,;6.86,-.95,;5.4,-1.43,;8.65,1.03,;8.97,2.54,;9.79,0,;1.54,.03,;1.54,1.57,;.21,2.34,;-1.13,1.57,;-2.46,2.34,;.21,3.88,;1.54,4.65,;2.88,3.88,;2.88,2.34,;4.21,1.57,;3.94,.06,;-6.07,-3.01,;-5.75,-4.52,;-6.89,-5.55,;-8.36,-5.07,;-9.5,-6.1,;-8.68,-3.57,;-7.53,-2.54,)|

BDBM499550

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC[C@@H]2C(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:16.17,(2.15,5.02,;1.24,3.77,;-.29,3.94,;-1.19,2.69,;-2.73,2.85,;-.57,1.28,;-1.97,.66,;.84,1.91,;.06,-.12,;-.85,-1.37,;-2.39,-1.37,;-2.86,-2.83,;-1.62,-3.74,;-1.62,-5.28,;-.53,-6.37,;-1.62,-7.46,;-2.71,-6.37,;-4.25,-6.37,;-5.02,-7.7,;-5.02,-5.03,;-.37,-2.83,;1.09,-3.31,;2.24,-2.28,;1.92,-.77,;3.06,.26,;3.7,-2.76,;4.02,-4.26,;2.88,-5.29,;1.41,-4.82,;.27,-5.85,;-1.09,-5.12,;-.92,5.34,;-2.45,5.5,;-3.07,6.91,;-2.17,8.16,;-2.79,9.56,;-.64,8,;-.01,6.59,)|

BDBM499551

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(F)(F)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-2.94,-5.71,;-2.03,-4.47,;-.5,-4.63,;.4,-3.38,;1.94,-3.54,;-.22,-1.98,;1.18,-1.35,;-1.63,-2.6,;-.85,-.57,;.06,.68,;1.6,.68,;2.07,2.14,;.83,3.05,;.83,4.59,;-.26,5.68,;.83,6.76,;.02,8.08,;1.63,8.08,;1.92,5.68,;-.42,2.14,;-1.88,2.62,;-3.03,1.59,;-2.71,.08,;-3.85,-.95,;-4.49,2.06,;-4.81,3.57,;-3.67,4.6,;-2.2,4.12,;-1.06,5.15,;.3,4.43,;.13,-6.04,;1.66,-6.2,;2.28,-7.6,;1.38,-8.85,;2,-10.26,;-.15,-8.69,;-.78,-7.28,)|

BDBM499552

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](C)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,13.12,2.1,wD:15.15,(2.27,4.78,;1.36,3.53,;-.17,3.69,;-1.07,2.45,;-2.6,2.61,;-.45,1.04,;-1.85,.41,;.96,1.67,;.18,-.37,;-.72,-1.61,;-2.26,-1.61,;-2.74,-3.08,;-1.49,-3.98,;-1.49,-5.52,;-.41,-6.61,;-1.49,-7.7,;-1.49,-9.24,;-2.58,-6.61,;-.25,-3.08,;1.22,-3.55,;2.36,-2.52,;2.04,-1.02,;3.18,.01,;3.82,-3,;4.14,-4.51,;3,-5.54,;1.54,-5.06,;.39,-6.09,;-.97,-5.37,;-.79,5.1,;-2.33,5.26,;-2.95,6.67,;-2.05,7.91,;-2.67,9.32,;-.51,7.75,;.11,6.35,)|

BDBM499553

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@@H](C2)C(F)(F)F)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,13.12,2.1,wD:15.17,(2.27,4.78,;1.36,3.53,;-.17,3.69,;-1.07,2.45,;-2.6,2.61,;-.45,1.04,;-1.85,.41,;.96,1.67,;.18,-.37,;-.72,-1.61,;-2.26,-1.61,;-2.74,-3.08,;-1.49,-3.98,;-1.49,-5.52,;-.41,-6.61,;-1.49,-7.7,;-2.58,-6.61,;-1.49,-9.24,;-2.83,-10.01,;-.16,-10.01,;-1.49,-10.78,;-.25,-3.08,;1.22,-3.55,;2.36,-2.52,;2.04,-1.02,;3.18,.01,;3.82,-3,;4.14,-4.51,;3,-5.54,;1.54,-5.06,;.39,-6.09,;-.97,-5.37,;-.79,5.1,;-2.33,5.26,;-2.95,6.67,;-2.05,7.91,;-2.67,9.32,;-.51,7.75,;.11,6.35,)|

BDBM499554

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@@H](C2)C(F)(F)F)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,wD:15.17,3.3,2.1,(-2.61,4.6,;-1.71,3.36,;-.17,3.52,;.73,2.27,;2.26,2.43,;.1,.87,;1.51,.24,;-1.3,1.49,;-.52,-.54,;.38,-1.79,;1.92,-1.79,;2.4,-3.25,;1.15,-4.16,;1.15,-5.7,;2.24,-6.79,;1.15,-7.87,;.06,-6.79,;1.15,-9.41,;-.18,-10.18,;2.49,-10.18,;1.15,-10.95,;-.09,-3.25,;-1.56,-3.73,;-2.7,-2.7,;-2.38,-1.19,;-3.53,-.16,;-4.17,-3.17,;-4.49,-4.68,;-3.34,-5.71,;-1.88,-5.23,;-.73,-6.26,;-1.31,-7.69,;.45,4.93,;-.45,6.17,;.17,7.58,;1.7,7.74,;2.33,9.15,;2.61,6.49,;1.98,5.09,)|

BDBM499555

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](F)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,wD:15.15,3.3,2.1,(-2.61,4.6,;-1.71,3.36,;-.17,3.52,;.73,2.27,;2.26,2.43,;.1,.87,;1.51,.24,;-1.3,1.49,;-.52,-.54,;.38,-1.79,;1.92,-1.79,;2.4,-3.25,;1.15,-4.16,;1.15,-5.7,;2.24,-6.79,;1.15,-7.87,;1.15,-9.41,;.06,-6.79,;-.09,-3.25,;-1.56,-3.73,;-2.7,-2.7,;-2.38,-1.19,;-3.53,-.16,;-4.17,-3.17,;-4.49,-4.68,;-3.34,-5.71,;-1.88,-5.23,;-.73,-6.26,;-1.31,-7.69,;.45,4.93,;-.45,6.17,;.17,7.58,;1.7,7.74,;2.33,9.15,;2.61,6.49,;1.98,5.09,)|

BDBM499558

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](Cl)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,wD:15.15,3.3,2.1,(-2.61,4.6,;-1.71,3.36,;-.17,3.52,;.73,2.27,;2.26,2.43,;.1,.87,;1.51,.24,;-1.3,1.49,;-.52,-.54,;.38,-1.79,;1.92,-1.79,;2.4,-3.25,;1.15,-4.16,;1.15,-5.7,;2.24,-6.79,;1.15,-7.87,;1.15,-9.41,;.06,-6.79,;-.09,-3.25,;-1.56,-3.73,;-2.7,-2.7,;-2.38,-1.19,;-3.53,-.16,;-4.17,-3.17,;-4.49,-4.68,;-3.34,-5.71,;-1.88,-5.23,;-.73,-6.26,;-1.31,-7.69,;.45,4.93,;-.45,6.17,;.17,7.58,;1.7,7.74,;2.33,9.15,;2.61,6.49,;1.98,5.09,)|

BDBM499560

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@@H](C2)OC)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,wD:15.17,3.3,2.1,(-2.61,4.6,;-1.71,3.36,;-.17,3.52,;.73,2.27,;2.26,2.43,;.1,.87,;1.51,.24,;-1.3,1.49,;-.52,-.54,;.38,-1.79,;1.92,-1.79,;2.4,-3.25,;1.15,-4.16,;1.15,-5.7,;2.24,-6.79,;1.15,-7.87,;.06,-6.79,;1.15,-9.41,;-.29,-9.94,;-.09,-3.25,;-1.56,-3.73,;-2.7,-2.7,;-2.38,-1.19,;-3.53,-.16,;-4.17,-3.17,;-4.49,-4.68,;-3.34,-5.71,;-1.88,-5.23,;-.73,-6.26,;-1.31,-7.69,;.45,4.93,;-.45,6.17,;.17,7.58,;1.7,7.74,;2.33,9.15,;2.61,6.49,;1.98,5.09,)|

BDBM499562

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CCC2(F)F)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,13.12,2.1,(-6.1,-3.34,;-4.85,-2.44,;-5.01,-.9,;-3.77,0,;-3.93,1.53,;-2.36,-.63,;-1.73,.78,;-2.99,-2.03,;-.95,-1.25,;.29,-.35,;.29,1.19,;1.76,1.67,;2.66,.42,;4.2,.42,;5.29,-.67,;6.38,.42,;5.29,1.51,;6.1,2.83,;4.49,2.83,;1.76,-.82,;2.23,-2.29,;3.74,-2.61,;4.77,-1.46,;6.28,-1.78,;4.21,-4.07,;3.18,-5.22,;1.68,-4.9,;1.2,-3.43,;-.3,-3.11,;-.52,-1.59,;-6.42,-.28,;-7.67,-1.18,;-9.07,-.56,;-9.23,.97,;-10.64,1.6,;-7.99,1.88,;-6.58,1.25,)|

BDBM499564

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@@H](CC2)OC)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wD:13.12,3.3,16.19,2.1,(2.39,-5.98,;1.48,-4.74,;-.05,-4.9,;-.95,-3.65,;-2.48,-3.81,;-.33,-2.25,;1.08,-2.87,;-1.73,-1.62,;.3,-.84,;-.61,.41,;-2.15,.41,;-2.62,1.87,;-1.38,2.78,;-1.38,4.32,;-2.71,5.09,;-2.71,6.63,;-1.38,7.4,;-.04,6.63,;-.04,5.09,;-1.38,8.94,;.07,9.46,;-.13,1.87,;1.33,2.35,;2.48,1.32,;2.16,-.19,;3.3,-1.22,;3.94,1.79,;4.26,3.3,;3.12,4.33,;1.65,3.85,;.51,4.88,;1.09,6.31,;-.67,-6.31,;.23,-7.55,;-.4,-8.96,;-1.93,-9.12,;-2.55,-10.53,;-2.83,-7.87,;-2.21,-6.47,)|

BDBM499565

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2C[C@H](F)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,15.15,(2.26,4.6,;1.35,3.36,;-.18,3.52,;-1.08,2.27,;-2.61,2.43,;-.46,.87,;-1.86,.24,;.95,1.49,;.17,-.54,;-.73,-1.79,;-2.27,-1.79,;-2.75,-3.25,;-1.5,-4.16,;-1.5,-5.7,;-.42,-6.79,;-1.5,-7.87,;-1.5,-9.41,;-2.59,-6.79,;-.26,-3.25,;1.21,-3.73,;2.35,-2.7,;2.03,-1.19,;3.17,-.16,;3.81,-3.17,;4.14,-4.68,;2.99,-5.71,;1.53,-5.23,;.38,-6.26,;-.98,-5.54,;-.8,4.93,;-2.34,5.09,;-2.96,6.49,;-2.06,7.74,;-2.68,9.15,;-.52,7.58,;.1,6.17,)|

BDBM499567

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2C[C@H](Cl)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,15.15,(2.26,4.6,;1.35,3.36,;-.18,3.52,;-1.08,2.27,;-2.61,2.43,;-.46,.87,;-1.86,.24,;.95,1.49,;.17,-.54,;-.73,-1.79,;-2.27,-1.79,;-2.75,-3.25,;-1.5,-4.16,;-1.5,-5.7,;-.42,-6.79,;-1.5,-7.87,;-1.5,-9.41,;-2.59,-6.79,;-.26,-3.25,;1.21,-3.73,;2.35,-2.7,;2.03,-1.19,;3.17,-.16,;3.81,-3.17,;4.14,-4.68,;2.99,-5.71,;1.53,-5.23,;.38,-6.26,;-.98,-5.54,;-.8,4.93,;-2.34,5.09,;-2.96,6.49,;-2.06,7.74,;-2.68,9.15,;-.52,7.58,;.1,6.17,)|

BDBM499569

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H]1CC[C@@H]1C(F)F |r,wU:16.17,18.19,30.32,33.37,(1.12,2.18,;-.21,1.41,;-1.54,2.18,;-1.59,3.74,;-2.93,4.51,;-4.26,3.74,;-4.26,2.2,;-5.59,1.43,;-6.77,2.42,;-2.93,1.43,;-2.93,-.78,;-1.68,-1.68,;-.35,-.91,;.99,-1.68,;.22,-3.01,;1.76,-3.01,;2.32,-.91,;2.32,.63,;3.66,-1.68,;3.66,-3.22,;4.99,-.91,;6.32,-1.68,;7.66,-.91,;7.66,.63,;8.99,1.4,;6.32,1.4,;4.99,.63,;-2.16,-3.15,;-3.7,-3.15,;-4.17,-1.68,;-5.64,-1.2,;-6.33,.17,;-7.71,-.53,;-7.01,-1.9,;-7.48,-3.37,;-6.45,-4.51,;-8.99,-3.69,)|

BDBM499571

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1[C@@H]1CC[C@@H]1C(F)F |r,wU:16.17,33.35,36.40,wD:18.19,(1.12,2.68,;-.21,1.91,;-1.54,2.68,;-1.59,4.25,;-2.93,5.02,;-4.26,4.25,;-4.26,2.71,;-5.59,1.94,;-6.77,2.93,;-2.93,1.94,;-2.93,-.27,;-1.68,-1.17,;-.35,-.4,;.99,-1.17,;-.35,-1.94,;2.32,-1.94,;2.32,-.4,;2.32,1.14,;3.66,-1.17,;3.66,-2.71,;4.99,-3.48,;4.99,-5.02,;6.32,-2.71,;4.99,-.4,;6.32,-1.17,;7.66,-.4,;7.66,1.14,;8.99,1.91,;6.32,1.91,;4.99,1.14,;-2.16,-2.64,;-3.7,-2.64,;-4.17,-1.17,;-5.64,-.7,;-6.33,.68,;-7.71,-.02,;-7.01,-1.4,;-7.48,-2.86,;-6.45,-4,;-8.99,-3.18,)|

BDBM499574

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@H]2CN)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,16.17,13.12,2.1,(1.65,4.95,;.75,3.71,;-.78,3.87,;-1.69,2.62,;-3.22,2.78,;-1.06,1.22,;-2.47,.59,;.35,1.84,;-.43,-.19,;-1.34,-1.44,;-2.88,-1.44,;-3.36,-2.9,;-2.11,-3.81,;-2.11,-5.35,;-1.02,-6.43,;-2.11,-7.52,;-3.2,-6.43,;-4.74,-6.43,;-5.51,-7.77,;-.86,-2.9,;.6,-3.38,;1.75,-2.35,;1.43,-.84,;2.57,.19,;3.21,-2.82,;3.53,-4.33,;2.39,-5.36,;.92,-4.88,;-.22,-5.91,;-1.58,-5.19,;-1.41,5.28,;-2.94,5.44,;-3.57,6.84,;-2.66,8.09,;-3.29,9.5,;-1.13,7.93,;-.5,6.52,)|

BDBM499575

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@H]2CN)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,16.17,2.1,wD:13.12,(1.65,4.95,;.75,3.71,;-.78,3.87,;-1.69,2.62,;-3.22,2.78,;-1.06,1.22,;-2.47,.59,;.35,1.84,;-.43,-.19,;-1.34,-1.44,;-2.88,-1.44,;-3.36,-2.9,;-2.11,-3.81,;-2.11,-5.35,;-1.02,-6.43,;-2.11,-7.52,;-3.2,-6.43,;-4.74,-6.43,;-5.51,-7.77,;-.86,-2.9,;.6,-3.38,;1.75,-2.35,;1.43,-.84,;2.57,.19,;3.21,-2.82,;3.53,-4.33,;2.39,-5.36,;.92,-4.88,;-.22,-5.91,;-1.58,-5.19,;-1.41,5.28,;-2.94,5.44,;-3.57,6.84,;-2.66,8.09,;-3.29,9.5,;-1.13,7.93,;-.5,6.52,)|

BDBM499576

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@H](CC2)C(F)(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wD:13.12,3.3,16.19,2.1,(2.39,-5.98,;1.48,-4.74,;-.05,-4.9,;-.95,-3.65,;-2.48,-3.81,;-.33,-2.25,;1.08,-2.87,;-1.73,-1.62,;.3,-.84,;-.61,.41,;-2.15,.41,;-2.62,1.87,;-1.38,2.78,;-1.38,4.32,;-.04,5.09,;-.04,6.63,;-1.38,7.4,;-2.71,6.63,;-2.71,5.09,;-1.38,8.94,;-.04,9.71,;-2.71,9.71,;-1.38,10.48,;-.13,1.87,;1.33,2.35,;2.48,1.32,;2.16,-.19,;3.3,-1.22,;3.94,1.79,;4.26,3.3,;3.12,4.33,;1.65,3.85,;.51,4.88,;1.09,6.31,;-.67,-6.31,;.23,-7.55,;-.4,-8.96,;-1.93,-9.12,;-2.55,-10.53,;-2.83,-7.87,;-2.21,-6.47,)|

BDBM499579

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@H](F)CC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wD:3.3,13.12,16.16,2.1,(6.09,.14,;4.63,-.33,;4.31,-1.84,;2.84,-2.32,;2.52,-3.82,;1.7,-1.29,;2.73,-.14,;.67,-2.43,;.56,-.25,;-.91,-.73,;-1.38,-2.2,;-2.92,-2.2,;-3.4,-.73,;-4.87,-.25,;-6.01,-1.29,;-7.47,-.81,;-7.79,.7,;-9.26,1.17,;-6.65,1.73,;-5.19,1.25,;-2.15,.17,;-2.15,1.71,;-3.49,2.48,;-4.82,1.71,;-6.16,2.48,;-3.49,4.02,;-2.15,4.79,;-.82,4.02,;-.82,2.48,;.51,1.71,;.25,.2,;5.45,-2.87,;6.92,-2.39,;8.06,-3.43,;7.74,-4.93,;8.89,-5.96,;6.28,-5.41,;5.13,-4.38,)|

BDBM499581

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](C2)C(F)(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,15.17,(2.26,4.6,;1.35,3.36,;-.18,3.52,;-1.08,2.27,;-2.61,2.43,;-.46,.87,;-1.86,.24,;.95,1.49,;.17,-.54,;-.73,-1.79,;-2.27,-1.79,;-2.75,-3.25,;-1.5,-4.16,;-1.5,-5.7,;-2.59,-6.79,;-1.5,-7.87,;-.42,-6.79,;-1.5,-9.41,;-2.84,-10.18,;-.17,-10.18,;-1.5,-10.95,;-.26,-3.25,;1.21,-3.73,;2.35,-2.7,;2.03,-1.19,;3.17,-.16,;3.81,-3.17,;4.14,-4.68,;2.99,-5.71,;1.53,-5.23,;.38,-6.26,;-.98,-5.54,;-.8,4.93,;-2.34,5.09,;-2.96,6.49,;-2.06,7.74,;-2.68,9.15,;-.52,7.58,;.1,6.17,)|

BDBM499583

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@@H]2F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:16.17,13.12,wD:3.3,2.1,(-3.44,4.65,;-2.54,3.41,;-1,3.57,;-.1,2.32,;1.43,2.48,;-.73,.91,;.68,.29,;-2.13,1.54,;-1.35,-.49,;-.45,-1.74,;1.09,-1.74,;1.57,-3.2,;.32,-4.11,;.32,-5.65,;-.77,-6.74,;.32,-7.83,;1.41,-6.74,;2.95,-6.74,;-.92,-3.2,;-2.39,-3.68,;-2.71,-5.19,;-1.56,-6.22,;-1.88,-7.72,;-4.17,-5.66,;-5.32,-4.63,;-5,-3.13,;-3.53,-2.65,;-3.21,-1.14,;-1.69,-.93,;-.38,4.97,;-1.28,6.22,;-.66,7.63,;.87,7.79,;1.5,9.19,;1.78,6.54,;1.15,5.13,)|

BDBM499586

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H]2F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:16.17,wD:3.3,13.12,2.1,(-3.44,4.65,;-2.54,3.41,;-1,3.57,;-.1,2.32,;1.43,2.48,;-.73,.91,;.68,.29,;-2.13,1.54,;-1.35,-.49,;-.45,-1.74,;1.09,-1.74,;1.57,-3.2,;.32,-4.11,;.32,-5.65,;-.77,-6.74,;.32,-7.83,;1.41,-6.74,;2.95,-6.74,;-.92,-3.2,;-2.39,-3.68,;-2.71,-5.19,;-1.56,-6.22,;-1.88,-7.72,;-4.17,-5.66,;-5.32,-4.63,;-5,-3.13,;-3.53,-2.65,;-3.21,-1.14,;-1.69,-.93,;-.38,4.97,;-1.28,6.22,;-.66,7.63,;.87,7.79,;1.5,9.19,;1.78,6.54,;1.15,5.13,)|

BDBM499589

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(CC3)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.01,-2.89,;3.76,-1.99,;3.93,-.46,;2.68,.45,;2.84,1.98,;1.27,-.18,;.65,1.23,;1.9,-1.58,;-.13,-.8,;-1.38,.1,;-1.38,1.64,;-2.84,2.12,;-3.75,.87,;-5.29,.87,;-6.38,-.22,;-7.47,.87,;-8.8,.1,;-8.8,1.64,;-6.38,1.96,;-2.84,-.37,;-3.32,-1.84,;-2.29,-2.98,;-.78,-2.66,;.25,-3.81,;-2.77,-4.45,;-4.27,-4.77,;-5.3,-3.62,;-4.83,-2.16,;-5.86,-1.01,;-5.13,.35,;5.33,.17,;5.49,1.7,;6.9,2.33,;8.15,1.42,;9.55,2.05,;7.99,-.11,;6.58,-.73,)|

BDBM499590

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(CCC3)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-5.88,2.09,;-4.64,1.19,;-4.8,-.34,;-3.55,-1.25,;-3.71,-2.78,;-2.14,-.62,;-1.52,-2.03,;-2.77,.78,;-.74,0,;.51,-.9,;.51,-2.44,;1.97,-2.92,;2.88,-1.67,;4.42,-1.67,;5.51,-.58,;6.6,-1.67,;7.69,-.58,;8.78,-1.67,;7.69,-2.76,;5.51,-2.76,;1.97,-.43,;2.45,1.04,;1.42,2.18,;-.09,1.86,;-1.12,3.01,;1.9,3.65,;3.4,3.97,;4.43,2.82,;3.96,1.36,;4.99,.22,;4.26,-1.14,;-6.2,-.97,;-6.36,-2.5,;-7.77,-3.13,;-9.02,-2.22,;-10.42,-2.85,;-8.86,-.69,;-7.45,-.06,)|

BDBM499591

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](C)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,wD:15.15,(2.32,4.7,;1.42,3.46,;-.11,3.62,;-1.02,2.37,;-2.55,2.53,;-.39,.97,;-1.8,.34,;1.02,1.59,;.24,-.44,;-.67,-1.69,;-2.21,-1.69,;-2.69,-3.15,;-1.44,-4.06,;-1.44,-5.6,;-.35,-6.69,;-1.44,-7.78,;-1.44,-9.32,;-2.53,-6.69,;-.19,-3.15,;1.27,-3.63,;2.42,-2.6,;2.1,-1.09,;3.24,-.06,;3.88,-3.07,;4.2,-4.58,;3.06,-5.61,;1.59,-5.13,;.45,-6.16,;-.91,-5.44,;-.74,5.03,;-2.27,5.19,;-2.9,6.59,;-1.99,7.84,;-2.62,9.25,;-.46,7.68,;.17,6.27,)|

BDBM499592

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2C[C@H](C)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,15.15,(2.32,4.7,;1.42,3.46,;-.11,3.62,;-1.02,2.37,;-2.55,2.53,;-.39,.97,;-1.8,.34,;1.02,1.59,;.24,-.44,;-.67,-1.69,;-2.21,-1.69,;-2.69,-3.15,;-1.44,-4.06,;-1.44,-5.6,;-.35,-6.69,;-1.44,-7.78,;-1.44,-9.32,;-2.53,-6.69,;-.19,-3.15,;1.27,-3.63,;2.42,-2.6,;2.1,-1.09,;3.24,-.06,;3.88,-3.07,;4.2,-4.58,;3.06,-5.61,;1.59,-5.13,;.45,-6.16,;-.91,-5.44,;-.74,5.03,;-2.27,5.19,;-2.9,6.59,;-1.99,7.84,;-2.62,9.25,;-.46,7.68,;.17,6.27,)|

BDBM499593

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@@H]2C)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:16.17,wD:3.3,13.12,2.1,(-3.44,4.65,;-2.54,3.41,;-1,3.57,;-.1,2.32,;1.43,2.48,;-.73,.91,;.68,.29,;-2.13,1.54,;-1.35,-.49,;-.45,-1.74,;1.09,-1.74,;1.57,-3.2,;.32,-4.11,;.32,-5.65,;-.77,-6.74,;.32,-7.83,;1.41,-6.74,;2.95,-6.74,;-.92,-3.2,;-2.39,-3.68,;-2.71,-5.19,;-1.56,-6.22,;-1.88,-7.72,;-4.17,-5.66,;-5.32,-4.63,;-5,-3.13,;-3.53,-2.65,;-3.21,-1.14,;-1.69,-.93,;-.38,4.97,;-1.28,6.22,;-.66,7.63,;.87,7.79,;1.5,9.19,;1.78,6.54,;1.15,5.13,)|

BDBM499594

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC[C@H]2C)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wD:3.3,13.12,16.17,2.1,(-3.44,4.65,;-2.54,3.41,;-1,3.57,;-.1,2.32,;1.43,2.48,;-.73,.91,;.68,.29,;-2.13,1.54,;-1.35,-.49,;-.45,-1.74,;1.09,-1.74,;1.57,-3.2,;.32,-4.11,;.32,-5.65,;-.77,-6.74,;.32,-7.83,;1.41,-6.74,;2.95,-6.74,;-.92,-3.2,;-2.39,-3.68,;-2.71,-5.19,;-1.56,-6.22,;-1.88,-7.72,;-4.17,-5.66,;-5.32,-4.63,;-5,-3.13,;-3.53,-2.65,;-3.21,-1.14,;-1.69,-.93,;-.38,4.97,;-1.28,6.22,;-.66,7.63,;.87,7.79,;1.5,9.19,;1.78,6.54,;1.15,5.13,)|

BDBM499595

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](Cl)C2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,13.12,2.1,wD:15.15,(2.26,4.6,;1.35,3.36,;-.18,3.52,;-1.08,2.27,;-2.61,2.43,;-.46,.87,;-1.86,.24,;.95,1.49,;.17,-.54,;-.73,-1.79,;-2.27,-1.79,;-2.75,-3.25,;-1.5,-4.16,;-1.5,-5.7,;-.42,-6.79,;-1.5,-7.87,;-1.5,-9.41,;-2.59,-6.79,;-.26,-3.25,;1.21,-3.73,;2.35,-2.7,;2.03,-1.19,;3.17,-.16,;3.81,-3.17,;4.14,-4.68,;2.99,-5.71,;1.53,-5.23,;.38,-6.26,;-.98,-5.54,;-.8,4.93,;-2.34,5.09,;-2.96,6.49,;-2.06,7.74,;-2.68,9.15,;-.52,7.58,;.1,6.17,)|

BDBM499597

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1[C@H]1C[C@H](Cl)C1 |r,wU:16.17,18.19,32.35,wD:30.32,(1.21,1.53,;-.12,.76,;-1.45,1.53,;-1.5,3.1,;-2.83,3.87,;-4.17,3.1,;-4.17,1.56,;-5.5,.79,;-6.68,1.78,;-2.83,.79,;-2.83,-1.42,;-1.59,-2.33,;-.25,-1.56,;1.08,-2.33,;-.25,-3.1,;2.41,-3.1,;2.41,-1.56,;2.41,-.02,;3.75,-2.33,;3.75,-3.87,;5.08,-1.56,;6.41,-2.33,;7.75,-1.56,;7.75,-.02,;9.08,.75,;6.41,.75,;5.08,-.02,;-2.06,-3.79,;-3.6,-3.79,;-4.08,-2.33,;-5.54,-1.85,;-6.24,-.48,;-7.62,-1.18,;-9.08,-.7,;-6.92,-2.55,)|

BDBM499599

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@@](C)(F)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,15.15,2.1,wD:13.12,15.16,(-2.89,-5.79,;-1.99,-4.54,;-.46,-4.7,;.45,-3.46,;1.98,-3.62,;-.18,-2.05,;1.23,-1.43,;-1.59,-2.68,;-.81,-.64,;.1,.6,;1.64,.6,;2.12,2.07,;.87,2.97,;.87,4.51,;1.96,5.6,;.87,6.69,;1.67,8,;.06,8,;-.22,5.6,;-.38,2.07,;-1.84,2.54,;-2.99,1.51,;-2.67,0,;-3.81,-1.03,;-4.45,1.99,;-4.77,3.49,;-3.63,4.52,;-2.16,4.05,;-1.02,5.08,;.34,4.36,;.17,-6.11,;1.7,-6.27,;2.33,-7.68,;1.42,-8.92,;2.05,-10.33,;-.11,-8.76,;-.74,-7.36,)|

BDBM499600

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC(=O)C2(C)C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,(4.97,-3.2,;3.73,-2.29,;3.89,-.76,;2.64,.14,;2.8,1.67,;1.23,-.48,;.61,.92,;1.86,-1.89,;-.17,-1.11,;-1.42,-.21,;-1.42,1.33,;-2.88,1.81,;-3.79,.56,;-5.33,.56,;-6.42,-.52,;-7.51,.56,;-9.05,.56,;-6.42,1.65,;-7.22,2.97,;-5.61,2.97,;-2.88,-.68,;-3.36,-2.15,;-2.33,-3.29,;-.82,-2.97,;.21,-4.11,;-2.8,-4.75,;-4.31,-5.08,;-5.34,-3.93,;-4.86,-2.47,;-5.9,-1.32,;-5.17,.04,;5.29,-.14,;5.46,1.39,;6.86,2.02,;8.11,1.12,;9.52,1.74,;7.95,-.42,;6.54,-1.04,)|

BDBM499602

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@@](C)(F)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,15.15,2.1,wD:13.12,15.16,(-2.89,-5.78,;-1.98,-4.54,;-.45,-4.7,;.46,-3.45,;1.99,-3.61,;-.17,-2.04,;1.24,-1.42,;-1.58,-2.67,;-.8,-.64,;.11,.61,;1.65,.61,;2.12,2.07,;.88,2.98,;.88,4.52,;1.97,5.61,;.88,6.7,;.07,8.01,;1.68,8.01,;-.21,5.61,;-.37,2.07,;-1.83,2.55,;-2.98,1.52,;-2.66,.01,;-3.8,-1.02,;-4.44,1.99,;-4.76,3.5,;-3.62,4.53,;-2.15,4.05,;-1.01,5.09,;.35,4.36,;.18,-6.1,;1.71,-6.27,;2.34,-7.67,;1.43,-8.92,;2.06,-10.32,;-.1,-8.76,;-.73,-7.35,)|

BDBM499603

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@@H](CC2)C#N)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,16.19,wD:3.3,2.1,(2.88,-6.25,;1.97,-5,;.44,-5.17,;-.46,-3.92,;-2,-4.08,;.16,-2.51,;1.57,-3.14,;-1.24,-1.89,;.79,-1.11,;-.12,.14,;-1.66,.14,;-2.13,1.6,;-.89,2.51,;-.89,4.05,;.45,4.82,;.45,6.36,;-.89,7.13,;-2.22,6.36,;-2.22,4.82,;-.89,8.67,;-.89,10.21,;.36,1.6,;1.82,2.08,;2.97,1.05,;2.65,-.46,;3.79,-1.49,;4.43,1.53,;4.75,3.03,;3.61,4.06,;2.14,3.59,;1,4.62,;1.58,6.05,;-.19,-6.57,;.72,-7.82,;.09,-9.22,;-1.44,-9.39,;-2.06,-10.79,;-2.34,-8.14,;-1.72,-6.73,)|

BDBM499604

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(CC3)C2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(4.97,-2.99,;3.72,-2.09,;3.88,-.55,;2.64,.35,;2.8,1.88,;1.23,-.28,;.6,1.13,;1.86,-1.68,;-.18,-.9,;-1.42,0,;-1.42,1.54,;-2.89,2.02,;-3.79,.77,;-5.33,.77,;-6.42,-.32,;-7.51,.77,;-8.84,0,;-8.84,1.54,;-6.42,1.86,;-2.89,-.47,;-3.36,-1.94,;-2.33,-3.08,;-.83,-2.76,;.21,-3.91,;-2.81,-4.55,;-4.31,-4.87,;-5.34,-3.72,;-4.87,-2.26,;-5.9,-1.11,;-5.18,.25,;5.29,.07,;5.45,1.6,;6.86,2.23,;8.1,1.32,;9.51,1.95,;7.94,-.21,;6.54,-.83,)|

BDBM499606

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CC2(CC2)C1 |r,wU:16.17,18.19,(1.24,1.53,;-.1,.76,;-1.43,1.53,;-1.48,3.1,;-2.81,3.87,;-4.15,3.1,;-4.15,1.56,;-5.48,.79,;-6.66,1.78,;-2.81,.79,;-2.81,-1.42,;-1.57,-2.33,;-.23,-1.56,;1.1,-2.33,;-.23,-3.1,;2.43,-3.1,;2.43,-1.56,;2.43,-.02,;3.77,-2.33,;3.77,-3.87,;5.1,-1.56,;6.43,-2.33,;7.77,-1.56,;7.77,-.02,;9.1,.75,;6.43,.75,;5.1,-.02,;-2.04,-3.79,;-3.58,-3.79,;-4.06,-2.33,;-5.52,-1.85,;-6.22,-.48,;-7.6,-1.18,;-8.63,-.03,;-9.1,-1.5,;-6.9,-2.55,)|

BDBM499607

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(Cl)(Cl)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-2.89,-5.78,;-1.98,-4.54,;-.45,-4.7,;.46,-3.45,;1.99,-3.61,;-.17,-2.04,;1.24,-1.42,;-1.58,-2.67,;-.8,-.64,;.11,.61,;1.65,.61,;2.12,2.07,;.88,2.98,;.88,4.52,;-.21,5.61,;.88,6.7,;.07,8.01,;1.68,8.01,;1.97,5.61,;-.37,2.07,;-1.83,2.55,;-2.98,1.52,;-2.66,.01,;-3.8,-1.02,;-4.44,1.99,;-4.76,3.5,;-3.62,4.53,;-2.15,4.05,;-1.01,5.09,;.35,4.36,;.18,-6.1,;1.71,-6.27,;2.34,-7.67,;1.43,-8.92,;2.06,-10.32,;-.1,-8.76,;-.73,-7.35,)|

BDBM499608

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@]3(CC3(F)F)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,15.15,2.1,wD:13.12,(5.79,-3.09,;4.54,-2.19,;4.7,-.66,;3.46,.25,;3.62,1.78,;2.05,-.38,;1.42,1.03,;2.68,-1.78,;.64,-1,;-.6,-.1,;-.6,1.44,;-2.07,1.92,;-2.97,.67,;-4.51,.67,;-5.6,1.76,;-6.69,.67,;-8.02,-.1,;-8.02,1.44,;-9.42,2.09,;-7.89,2.97,;-5.6,-.42,;-2.07,-.58,;-2.54,-2.04,;-1.51,-3.18,;-.01,-2.86,;1.02,-4.01,;-1.99,-4.65,;-3.5,-4.97,;-4.53,-3.82,;-4.05,-2.36,;-5.08,-1.22,;-4.36,.14,;6.11,-.03,;6.27,1.5,;7.68,2.13,;8.92,1.22,;10.33,1.85,;8.76,-.31,;7.35,-.94,)|

BDBM499610

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CC[C@H]2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,wD:3.3,16.17,2.1,(-3.44,4.65,;-2.54,3.41,;-1,3.57,;-.1,2.32,;1.43,2.48,;-.73,.91,;.68,.29,;-2.13,1.54,;-1.35,-.49,;-.45,-1.74,;1.09,-1.74,;1.57,-3.2,;.32,-4.11,;.32,-5.65,;-.77,-6.74,;.32,-7.83,;1.41,-6.74,;2.95,-6.74,;-.92,-3.2,;-2.39,-3.68,;-2.71,-5.19,;-1.56,-6.22,;-1.88,-7.72,;-4.17,-5.66,;-5.32,-4.63,;-5,-3.13,;-3.53,-2.65,;-3.21,-1.14,;-1.69,-.93,;-.38,4.97,;-1.28,6.22,;-.66,7.63,;.87,7.79,;1.5,9.19,;1.78,6.54,;1.15,5.13,)|

BDBM499611

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OCC(F)F)c2ncc(C)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(.48,3.07,;-.85,2.3,;-2.19,3.07,;-2.23,4.64,;-3.57,5.41,;-4.9,4.64,;-4.9,3.1,;-6.23,2.33,;-7.41,3.32,;-3.57,2.33,;-3.57,.12,;-2.32,-.79,;-.99,-.02,;.35,-.79,;-.99,-1.56,;1.68,-1.56,;1.68,-.02,;1.68,1.52,;3.01,-.79,;3.01,-2.33,;4.35,-3.1,;4.35,-4.64,;5.68,-5.41,;3.01,-5.41,;4.35,-.02,;5.68,-.79,;7.01,-.02,;7.01,1.52,;8.35,2.29,;5.68,2.29,;4.35,1.52,;-2.8,-2.25,;-4.34,-2.25,;-4.81,-.79,;-6.28,-.31,;-6.98,1.06,;-8.35,.36,;-7.65,-1.01,)|

BDBM499612

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(Cl)cn2)nnc1C1CCC1 |(-7.48,1.18,;-6.14,.41,;-4.81,1.18,;-4.81,2.72,;-3.48,3.49,;-2.14,2.72,;-2.14,1.18,;-.81,.41,;.53,1.18,;-3.48,.41,;-3.48,-1.13,;-2.23,-2.03,;-.9,-1.26,;.44,-2.03,;-.33,-3.36,;1.21,-3.36,;1.77,-1.26,;3.1,-2.03,;4.44,-1.26,;5.77,-2.03,;7.11,-1.26,;7.11,.28,;8.44,1.05,;5.77,1.05,;4.44,.28,;-2.71,-3.49,;-4.25,-3.49,;-4.72,-2.03,;-6.26,-2.03,;-7.35,-.94,;-8.44,-2.03,;-7.35,-3.12,)|

BDBM499613

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1C1CCOCC1)c1ncc(Cl)cn1 |r|

BDBM499614

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC[C@H](C2)OC)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:16.18,(4.78,-10.65,;3.7,-9.56,;4.09,-8.07,;3,-6.98,;3.4,-5.5,;1.52,-7.38,;.03,-7.78,;2.61,-8.47,;.43,-6.29,;-1.06,-6.69,;-1.54,-8.16,;-3.08,-8.16,;-3.55,-6.69,;-4.88,-5.92,;-5.36,-4.46,;-6.9,-4.46,;-7.38,-5.92,;-6.13,-6.83,;-8.71,-6.69,;-10.04,-5.92,;-2.31,-5.79,;-2.31,-4.25,;-3.64,-3.48,;-4.97,-4.25,;-6.31,-3.48,;-3.64,-1.94,;-2.31,-1.17,;-.97,-1.94,;-.97,-3.48,;.36,-4.25,;1.7,-3.48,;5.58,-7.67,;6.67,-8.76,;8.16,-8.36,;8.56,-6.88,;10.04,-6.48,;7.47,-5.79,;5.98,-6.19,)|

BDBM499615

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC[C@@H](C2)OC)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:16.18,3.3,2.1,(4.78,1.17,;3.69,2.25,;4.09,3.74,;3,4.83,;3.4,6.32,;1.51,4.43,;.03,4.03,;2.6,3.34,;.42,5.52,;-1.06,5.12,;-1.54,3.66,;-3.08,3.66,;-3.56,5.12,;-4.89,5.89,;-5.36,7.36,;-6.9,7.36,;-7.38,5.89,;-6.13,4.99,;-8.71,5.12,;-10.05,5.89,;-2.31,6.03,;-2.31,7.57,;-3.64,8.34,;-4.98,7.57,;-6.31,8.34,;-3.64,9.88,;-2.31,10.65,;-.98,9.88,;-.98,8.34,;.36,7.57,;1.69,8.34,;5.58,4.14,;6.67,3.05,;8.15,3.45,;8.55,4.94,;10.04,5.34,;7.46,6.03,;5.98,5.63,)|

BDBM499617

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(n1-c1c(OC)cccc1OC)C12CC(C1)C2)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(3.27,-4.74,;2.18,-3.65,;2.58,-2.16,;1.49,-1.08,;1.89,.41,;.01,-1.47,;-1.48,-1.87,;1.09,-2.56,;-1.08,-.39,;-2.57,-.78,;-3.05,-2.25,;-4.59,-2.25,;-5.06,-.78,;-3.82,.12,;-3.82,1.66,;-5.15,2.43,;-6.48,1.66,;-7.82,2.43,;-5.15,3.97,;-3.82,4.74,;-2.48,3.97,;-2.48,2.43,;-1.15,1.66,;.18,2.43,;-6.55,-.39,;-6.65,1.11,;-7.36,-.2,;-5.88,-1.77,;-8.53,-.92,;4.07,-1.77,;5.16,-2.86,;6.65,-2.46,;7.04,-.97,;8.53,-.57,;5.96,.12,;4.47,-.28,)|

BDBM499618

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CC11CC1 |r,wU:16.17,18.19,wD:30.32,(-7.4,7.79,;-6.06,7.02,;-4.73,7.79,;-4.73,9.33,;-3.4,10.1,;-2.06,9.33,;-2.06,7.79,;-.73,7.02,;.6,7.79,;-3.4,7.02,;-3.4,5.48,;-2.15,4.58,;-.66,4.98,;.43,3.89,;-1.06,3.49,;1.51,2.8,;1.91,4.29,;2.31,5.77,;3,3.2,;2.6,1.71,;4.49,3.6,;5.58,2.51,;7.07,2.91,;7.46,4.39,;8.95,4.79,;6.38,5.48,;4.89,5.08,;-2.63,3.11,;-4.17,3.11,;-4.64,4.58,;-5.98,5.35,;-7.07,6.44,;-7.46,4.95,;-8.95,4.55,;-7.86,3.46,)|

BDBM499620

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CC1(F)F |r,wU:16.17,18.19,wD:30.32,(-7.4,7.79,;-6.06,7.02,;-4.73,7.79,;-4.73,9.33,;-3.4,10.1,;-2.06,9.33,;-2.06,7.79,;-.73,7.02,;.6,7.79,;-3.4,7.02,;-3.4,5.48,;-2.15,4.58,;-.66,4.98,;.43,3.89,;-1.06,3.49,;1.51,2.8,;1.91,4.29,;2.31,5.77,;3,3.2,;2.6,1.71,;4.49,3.6,;5.58,2.51,;7.07,2.91,;7.46,4.39,;8.95,4.79,;6.38,5.48,;4.89,5.08,;-2.63,3.11,;-4.17,3.11,;-4.64,4.58,;-5.98,5.35,;-7.07,6.44,;-7.46,4.95,;-7.46,3.41,;-8.95,5.35,)|

BDBM499622

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC22CC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(3.69,1.17,;2.6,2.25,;3,3.74,;1.91,4.83,;2.31,6.32,;.43,4.43,;-1.06,4.03,;1.51,3.34,;-.66,5.52,;-2.15,5.12,;-2.63,3.66,;-4.17,3.66,;-4.64,5.12,;-5.98,5.89,;-7.07,6.98,;-7.46,5.49,;-8.95,5.1,;-7.86,4.01,;-3.4,6.03,;-3.4,7.57,;-4.73,8.34,;-6.06,7.57,;-7.4,8.34,;-4.73,9.88,;-3.4,10.65,;-2.06,9.88,;-2.06,8.34,;-.73,7.57,;.6,8.34,;4.49,4.14,;5.58,3.05,;7.07,3.45,;7.46,4.94,;8.95,5.34,;6.38,6.03,;4.89,5.63,)|

BDBM499624

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2CCC(=O)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,(4.11,1.17,;3.02,2.25,;3.42,3.74,;2.33,4.83,;2.73,6.32,;.85,4.43,;-.64,4.03,;1.93,3.34,;-.24,5.52,;-1.73,5.12,;-2.21,3.66,;-3.75,3.66,;-4.22,5.12,;-5.56,5.89,;-6.03,7.36,;-7.57,7.36,;-8.05,5.89,;-9.38,5.12,;-6.8,4.99,;-2.98,6.03,;-2.98,7.57,;-4.31,8.34,;-5.64,7.57,;-6.98,8.34,;-4.31,9.88,;-2.98,10.65,;-1.64,9.88,;-1.64,8.34,;-.31,7.57,;1.02,8.34,;4.91,4.14,;6,3.05,;7.49,3.45,;7.88,4.94,;9.37,5.34,;6.8,6.03,;5.31,5.63,)|

BDBM499627

CO[C@H]1C[C@H](C1)c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:4.6,2.1,14.15,wD:16.17,(-9.88,.23,;-8.79,1.32,;-7.3,.92,;-5.97,1.69,;-5.2,.36,;-6.53,-.41,;-3.71,-.04,;-3.24,-1.5,;-1.7,-1.5,;-1.22,-.04,;.27,.36,;1.35,-.73,;.27,-1.82,;1.75,-2.22,;2.84,-.33,;3.24,1.16,;3.93,-1.42,;3.53,-2.91,;4.62,-4,;4.22,-5.49,;6.11,-3.6,;5.42,-1.02,;6.51,-2.11,;8,-1.71,;8.39,-.23,;9.88,.17,;7.3,.86,;5.82,.47,;-2.47,.87,;-2.47,2.41,;-3.8,3.18,;-5.14,2.41,;-6.47,3.18,;-3.8,4.72,;-2.47,5.49,;-1.13,4.72,;-1.13,3.18,;.2,2.41,;1.53,3.18,)|

BDBM499629

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@@H]1C2CC1[C@H]2O |r,wU:16.17,wD:33.35,18.19,37.42,(-7.01,3.18,;-5.68,2.41,;-4.35,3.18,;-4.35,4.72,;-3.01,5.49,;-1.68,4.72,;-1.68,3.18,;-.34,2.41,;.99,3.18,;-3.01,2.41,;-3.01,.87,;-1.77,-.04,;-.28,.36,;.81,-.73,;-.28,-1.82,;1.21,-2.22,;2.3,-.33,;2.7,1.16,;3.39,-1.42,;2.99,-2.91,;4.08,-4,;3.68,-5.49,;5.56,-3.6,;4.87,-1.02,;5.96,-2.11,;7.45,-1.71,;7.85,-.23,;9.34,.17,;6.76,.86,;5.27,.47,;-2.24,-1.5,;-3.78,-1.5,;-4.26,-.04,;-5.75,.36,;-7.08,-.41,;-7.08,.78,;-6.52,1.69,;-7.85,.92,;-9.34,1.32,)|

BDBM499631

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@@H]1CCC(=O)C1 |r,wU:16.17,33.35,wD:18.19,(-6.97,3.18,;-5.64,2.41,;-4.31,3.18,;-4.31,4.72,;-2.97,5.49,;-1.64,4.72,;-1.64,3.18,;-.3,2.41,;1.03,3.18,;-2.97,2.41,;-2.97,.87,;-1.73,-.04,;-.24,.36,;.85,-.73,;-.24,-1.82,;1.25,-2.22,;2.34,-.33,;2.74,1.16,;3.43,-1.42,;3.03,-2.91,;4.12,-4,;3.72,-5.49,;5.6,-3.6,;4.91,-1.02,;6,-2.11,;7.49,-1.71,;7.89,-.23,;9.38,.17,;6.8,.86,;5.31,.47,;-2.2,-1.5,;-3.74,-1.5,;-4.22,-.04,;-5.55,.73,;-6.03,2.19,;-7.57,2.19,;-8.04,.73,;-9.38,-.04,;-6.8,-.18,)|

BDBM499633

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1C1C[C@@](C)(O)C1 |r,wU:35.38,16.17,wD:18.19,35.39,(-7.09,3.18,;-5.76,2.41,;-4.42,3.18,;-4.42,4.72,;-3.09,5.49,;-1.76,4.72,;-1.76,3.18,;-.42,2.41,;.91,3.18,;-3.09,2.41,;-3.09,.87,;-1.84,-.04,;-.36,.36,;.73,-.73,;-.36,-1.82,;1.13,-2.22,;2.22,-.33,;2.62,1.16,;3.31,-1.42,;2.91,-2.91,;4,-4,;3.6,-5.49,;5.49,-3.6,;4.8,-1.02,;5.89,-2.11,;7.37,-1.71,;7.77,-.23,;9.26,.17,;6.68,.86,;5.2,.47,;-2.32,-1.5,;-3.86,-1.5,;-4.33,-.04,;-5.82,.36,;-6.59,1.69,;-7.93,.92,;-9.02,2.01,;-9.26,.15,;-7.16,-.41,)|

BDBM499634

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1[C@@H]1CCC(F)(F)C1 |r,wU:16.17,33.35,wD:18.19,(-6.97,3.18,;-5.64,2.41,;-4.31,3.18,;-4.31,4.72,;-2.97,5.49,;-1.64,4.72,;-1.64,3.18,;-.3,2.41,;1.03,3.18,;-2.97,2.41,;-2.97,.87,;-1.73,-.04,;-.24,.36,;.85,-.73,;-.24,-1.82,;1.25,-2.22,;2.34,-.33,;2.74,1.16,;3.43,-1.42,;3.03,-2.91,;4.12,-4,;3.72,-5.49,;5.6,-3.6,;4.91,-1.02,;6,-2.11,;7.49,-1.71,;7.89,-.23,;9.38,.17,;6.8,.86,;5.31,.47,;-2.2,-1.5,;-3.74,-1.5,;-4.22,-.04,;-5.55,.73,;-6.03,2.19,;-7.57,2.19,;-8.04,.73,;-9.38,-.04,;-9.38,1.5,;-6.8,-.18,)|

BDBM499635

CO[C@H]1CCC[C@H]1c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:15.16,6.7,2.1,wD:17.18,(-6.13,-2.49,;-7.46,-1.72,;-7.46,-.18,;-8.71,.73,;-8.23,2.19,;-6.69,2.19,;-6.22,.73,;-4.88,-.04,;-4.41,-1.5,;-2.87,-1.5,;-2.39,-.04,;-.91,.36,;.18,-.73,;-.91,-1.82,;.58,-2.22,;1.67,-.33,;2.07,1.16,;2.76,-1.42,;2.36,-2.91,;3.45,-4,;3.05,-5.49,;4.94,-3.6,;4.25,-1.02,;5.34,-2.11,;6.82,-1.71,;7.22,-.23,;8.71,.17,;6.13,.86,;4.65,.47,;-3.64,.87,;-3.64,2.41,;-4.97,3.18,;-6.31,2.41,;-7.64,3.18,;-4.97,4.72,;-3.64,5.49,;-2.31,4.72,;-2.31,3.18,;-.97,2.41,;.36,3.18,)|

BDBM499638

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(CCC3)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.53,-3.92,;4.19,-3.15,;4.19,-1.61,;2.86,-.84,;2.86,.7,;1.53,-1.61,;.76,-2.94,;2.3,-2.94,;.19,-.84,;-1.14,-1.61,;-1.62,-3.07,;-3.16,-3.07,;-3.63,-1.61,;-5.17,-1.61,;-6.26,-.52,;-7.35,-1.61,;-8.44,-.52,;-9.53,-1.61,;-8.44,-2.7,;-6.26,-2.7,;-2.39,-.7,;-2.39,.84,;-3.72,1.61,;-5.05,.84,;-6.39,1.61,;-3.72,3.15,;-2.39,3.92,;-1.05,3.15,;-1.05,1.61,;.28,.84,;1.61,1.61,;5.53,-.84,;6.86,-1.61,;8.19,-.84,;8.19,.7,;9.53,1.47,;6.86,1.47,;5.53,.7,)|

BDBM499639

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@](C)(F)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:13.12,3.3,2.1,15.15,wD:15.16,(4.98,-3.92,;3.65,-3.15,;3.65,-1.61,;2.32,-.84,;2.32,.7,;.98,-1.61,;.21,-2.94,;1.75,-2.94,;-.35,-.84,;-1.69,-1.61,;-2.16,-3.07,;-3.7,-3.07,;-4.18,-1.61,;-5.72,-1.61,;-6.81,-2.7,;-7.9,-1.61,;-8.98,-.52,;-8.98,-2.7,;-6.81,-.52,;-2.93,-.7,;-2.93,.84,;-4.26,1.61,;-5.6,.84,;-6.93,1.61,;-4.26,3.15,;-2.93,3.92,;-1.6,3.15,;-1.6,1.61,;-.26,.84,;1.07,1.61,;4.98,-.84,;6.32,-1.61,;7.65,-.84,;7.65,.7,;8.98,1.47,;6.32,1.47,;4.98,.7,)|

BDBM499640

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(C2)(OC)OC)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.75,-3.92,;4.42,-3.15,;4.42,-1.61,;3.09,-.84,;3.09,.7,;1.75,-1.61,;.98,-2.94,;2.52,-2.94,;.42,-.84,;-.92,-1.61,;-1.39,-3.07,;-2.93,-3.07,;-3.41,-1.61,;-4.95,-1.61,;-6.04,-.52,;-7.13,-1.61,;-6.04,-2.7,;-8.21,-.52,;-9.75,-.52,;-8.21,-2.7,;-9.75,-2.7,;-2.16,-.7,;-2.16,.84,;-3.49,1.61,;-4.83,.84,;-6.16,1.61,;-3.49,3.15,;-2.16,3.92,;-.83,3.15,;-.83,1.61,;.51,.84,;1.84,1.61,;5.75,-.84,;7.09,-1.61,;8.42,-.84,;8.42,.7,;9.75,1.47,;7.09,1.47,;5.75,.7,)|

BDBM499641

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(CC3)C2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.11,-3.92,;3.77,-3.15,;3.77,-1.61,;2.44,-.84,;2.44,.7,;1.1,-1.61,;.33,-2.94,;1.87,-2.94,;-.23,-.84,;-1.56,-1.61,;-2.04,-3.07,;-3.58,-3.07,;-4.05,-1.61,;-5.59,-1.61,;-6.68,-.52,;-7.77,-1.61,;-9.11,-.84,;-9.11,-2.38,;-6.68,-2.7,;-2.81,-.7,;-2.81,.84,;-4.14,1.61,;-5.48,.84,;-6.81,1.61,;-4.14,3.15,;-2.81,3.92,;-1.48,3.15,;-1.48,1.61,;-.14,.84,;1.19,1.61,;5.11,-.84,;6.44,-1.61,;7.77,-.84,;7.77,.7,;9.11,1.47,;6.44,1.47,;5.11,.7,)|

BDBM499642

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(COC3)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(5.6,-4.1,;4.27,-3.33,;4.27,-1.79,;2.94,-1.02,;2.94,.52,;1.6,-1.79,;.27,-2.56,;2.94,-2.56,;.27,-1.02,;-1.22,-1.42,;-1.69,-2.89,;-3.23,-2.89,;-3.71,-1.42,;-5.25,-1.42,;-6.34,-.33,;-7.43,-1.42,;-8.52,-.33,;-9.61,-1.42,;-8.52,-2.51,;-6.34,-2.51,;-2.46,-.52,;-2.46,1.02,;-3.8,1.79,;-5.13,1.02,;-6.46,1.79,;-3.8,3.33,;-2.46,4.1,;-1.13,3.33,;-1.13,1.79,;.2,1.02,;1.54,1.79,;5.6,-1.02,;6.94,-1.79,;8.27,-1.02,;8.27,.52,;9.61,1.29,;6.94,1.29,;5.6,.52,)|

BDBM499643

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCCC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.53,-3.92,;3.2,-3.15,;3.2,-1.61,;1.87,-.84,;1.87,.7,;.53,-1.61,;-.24,-2.94,;1.3,-2.94,;-.8,-.84,;-2.13,-1.61,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-.36,;-8.54,-.84,;-8.54,-2.38,;-7.07,-2.85,;-3.38,-.7,;-3.38,.84,;-4.71,1.61,;-6.05,.84,;-7.38,1.61,;-4.71,3.15,;-3.38,3.92,;-2.05,3.15,;-2.05,1.61,;-.71,.84,;.62,1.61,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,)|

BDBM507130

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,18.19,(1.25,1.37,;-.08,.6,;-1.42,1.37,;-1.42,2.91,;-2.75,3.68,;-4.09,2.91,;-4.09,1.37,;-5.42,.6,;-6.75,1.37,;-2.75,.6,;-2.75,-.94,;-1.51,-1.85,;-.04,-1.37,;1.29,-2.14,;2.63,-2.91,;-.04,-2.91,;2.63,-1.37,;2.63,.17,;3.96,-2.14,;3.96,-3.68,;5.29,-1.37,;6.63,-2.14,;7.96,-1.37,;7.96,.17,;9.3,.94,;6.63,.94,;5.29,.17,;-1.98,-3.31,;-3.52,-3.31,;-4,-1.85,;-5.46,-1.37,;-6.55,-.28,;-7.92,-.98,;-9.3,-.28,;-7.68,-2.5,;-6.16,-2.74,)|

BDBM507131

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1csc(C)n1 |r,wU:16.17,18.19,(.99,1.37,;-.35,.6,;-1.68,1.37,;-1.68,2.91,;-3.01,3.68,;-4.35,2.91,;-4.35,1.37,;-5.68,.6,;-7.01,1.37,;-3.01,.6,;-3.01,-.94,;-1.77,-1.85,;-.3,-1.37,;1.03,-2.14,;2.36,-2.91,;-.3,-2.91,;2.36,-1.37,;2.36,.17,;3.7,-2.14,;3.7,-3.68,;5.03,-1.37,;6.37,-2.14,;7.7,-1.37,;7.7,.17,;9.03,.94,;6.37,.94,;5.03,.17,;-2.24,-3.31,;-3.78,-3.31,;-4.26,-1.85,;-5.72,-1.37,;-6.81,-.28,;-8.18,-.98,;-7.94,-2.5,;-9.03,-3.59,;-6.42,-2.74,)|

BDBM507132

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,18.19,(1.25,1.37,;-.08,.6,;-1.42,1.37,;-1.42,2.91,;-2.75,3.68,;-4.09,2.91,;-4.09,1.37,;-5.42,.6,;-6.75,1.37,;-2.75,.6,;-2.75,-.94,;-1.51,-1.85,;-.04,-1.37,;1.29,-2.14,;2.63,-2.91,;-.04,-2.91,;2.63,-1.37,;2.63,.17,;3.96,-2.14,;3.96,-3.68,;5.29,-1.37,;6.63,-2.14,;7.96,-1.37,;7.96,.17,;9.3,.94,;6.63,.94,;5.29,.17,;-1.98,-3.31,;-3.52,-3.31,;-4,-1.85,;-5.46,-1.37,;-6.55,-.28,;-7.92,-.98,;-9.3,-.28,;-7.68,-2.5,;-6.16,-2.74,)|

BDBM507133

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nc(cs2)C2CC2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(6.06,-4.06,;4.73,-3.29,;4.73,-1.75,;3.4,-.98,;3.4,.56,;2.06,-1.75,;3.4,-2.52,;.73,-2.52,;.73,-.98,;-.74,-1.46,;-1.21,-2.93,;-2.75,-2.93,;-3.23,-1.46,;-4.69,-.98,;-5.78,.1,;-7.15,-.59,;-6.91,-2.12,;-5.39,-2.36,;-8.53,.1,;-9.3,1.44,;-10.07,.1,;-1.98,-.56,;-1.98,.98,;-.65,1.75,;.69,.98,;2.02,1.75,;-.65,3.29,;-1.98,4.06,;-3.32,3.29,;-3.32,1.75,;-4.65,.98,;-5.98,1.75,;6.06,-.98,;7.4,-1.75,;8.73,-.98,;8.73,.56,;10.07,1.33,;7.4,1.33,;6.06,.56,)|

BDBM507134

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2csc(C)n2)n1-c1c(OC)ncnc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.09,-4.06,;3.75,-3.29,;3.75,-1.75,;2.42,-.98,;2.42,.56,;1.09,-1.75,;2.18,-2.84,;-0,-2.84,;-.25,-.98,;-1.71,-1.46,;-2.19,-2.93,;-3.73,-2.93,;-4.2,-1.46,;-5.67,-.98,;-6.7,-2.13,;-8.11,-1.5,;-7.94,.03,;-9.09,1.06,;-6.44,.35,;-2.96,-.56,;-2.96,.98,;-1.62,1.75,;-.29,.98,;1.04,1.75,;-1.62,3.29,;-2.96,4.06,;-4.29,3.29,;-4.29,1.75,;-5.62,.98,;-6.96,1.75,;5.09,-.98,;6.42,-1.75,;7.76,-.98,;7.76,.56,;9.09,1.33,;6.42,1.33,;5.09,.56,)|

BDBM507135

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,(-6.82,7.66,;-5.49,6.89,;-4.16,7.66,;-4.16,9.2,;-2.82,9.97,;-1.49,9.2,;-1.49,7.66,;-.15,6.89,;1.18,7.66,;-2.82,6.89,;-2.82,5.35,;-1.58,4.45,;-.11,4.92,;.98,3.83,;.58,2.35,;1.38,5.32,;2.46,4.23,;2.86,5.72,;3.55,3.14,;5.04,3.54,;6.13,2.45,;7.62,2.85,;8.02,4.34,;9.5,4.74,;6.93,5.43,;5.44,5.03,;-2.05,2.98,;-3.59,2.98,;-4.07,4.45,;-5.53,4.92,;-6.01,6.39,;-7.55,6.39,;-8.02,4.92,;-9.49,4.45,;-6.78,4.02,)|

BDBM507136

COC1NC=NC(OC)=C1n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,c:4,8|

BDBM507137

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(C)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,(-7.09,7.15,;-5.75,6.38,;-4.42,7.15,;-4.42,8.69,;-3.09,9.46,;-1.75,8.69,;-1.75,7.15,;-.42,6.38,;.92,7.15,;-3.09,6.38,;-3.09,4.84,;-1.84,3.94,;-.37,4.41,;.71,3.32,;-.06,1.99,;1.48,1.99,;2.05,4.09,;2.05,5.63,;3.38,3.32,;4.72,4.09,;6.05,3.32,;7.38,4.09,;7.38,5.63,;8.72,6.4,;6.05,6.4,;4.72,5.63,;-2.32,2.47,;-3.86,2.47,;-4.33,3.94,;-5.8,4.41,;-6.27,5.88,;-7.81,5.88,;-8.72,7.12,;-8.29,4.41,;-7.04,3.51,)|

BDBM507138

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(C)cn2)nnc1-c1nc(C)cs1 |r,wD:16.17,(-7.09,-5.14,;-5.75,-5.91,;-4.42,-5.14,;-4.42,-3.6,;-3.09,-2.83,;-1.75,-3.6,;-1.75,-5.14,;-.42,-5.91,;.92,-5.14,;-3.09,-5.91,;-3.09,-7.45,;-1.84,-8.36,;-.37,-7.88,;.71,-8.97,;-.06,-10.3,;1.48,-10.3,;2.05,-8.2,;2.05,-6.66,;3.38,-8.97,;4.72,-8.2,;6.05,-8.97,;7.38,-8.2,;7.38,-6.66,;8.72,-5.89,;6.05,-5.89,;4.72,-6.66,;-2.32,-9.82,;-3.86,-9.82,;-4.33,-8.36,;-5.8,-7.88,;-6.27,-6.42,;-7.81,-6.42,;-8.72,-5.17,;-8.29,-7.88,;-7.04,-8.79,)|

BDBM507139

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(C)cn2)nnc1-c1nc(C)cs1 |(1.69,1.31,;.55,.28,;-.92,.75,;-1.24,2.26,;-2.7,2.74,;-3.85,1.71,;-3.53,.2,;-4.67,-.83,;-6.13,-.35,;-2.06,-.28,;-1.74,-1.78,;-.33,-2.41,;1,-1.64,;2.33,-2.41,;1.56,-3.74,;3.67,-3.18,;3.1,-1.07,;4.64,-1.07,;5.41,.26,;4.64,1.59,;5.41,2.93,;6.95,2.93,;7.72,4.26,;7.72,1.59,;6.95,.26,;-.49,-3.94,;-2,-4.26,;-2.77,-2.93,;-4.3,-2.77,;-5.07,-1.43,;-6.58,-1.75,;-7.72,-.72,;-6.74,-3.28,;-5.33,-3.91,)|

BDBM507140

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ccc(cn2)C#N)nnc1-c1nc(C)cs1 |r,wD:16.17,(1.31,6.97,;.16,5.93,;-1.3,6.41,;-1.62,7.92,;-3.09,8.39,;-4.23,7.36,;-3.91,5.86,;-5.05,4.83,;-6.52,5.3,;-2.45,5.38,;-2.13,3.87,;-.72,3.25,;.62,4.02,;1.95,3.25,;1.18,1.91,;3.28,2.48,;2.72,4.58,;1.95,5.91,;4.26,4.58,;5.03,5.91,;6.57,5.91,;7.34,7.25,;6.6,8.63,;5.03,8.58,;4.26,7.25,;7.37,9.96,;8.14,11.3,;-.88,1.72,;-2.39,1.4,;-3.16,2.73,;-4.69,2.89,;-5.46,4.22,;-6.96,3.9,;-8.11,4.93,;-7.12,2.37,;-5.72,1.75,)|

BDBM507141

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ccc(cn2)C#N)nnc1-c1nc(C)cs1 |r,wD:16.17,(1.31,6.92,;.16,5.89,;-1.3,6.37,;-1.62,7.87,;-3.09,8.35,;-4.23,7.32,;-3.91,5.81,;-5.05,4.78,;-6.52,5.26,;-2.45,5.34,;-2.13,3.83,;-.72,3.21,;.61,3.98,;1.95,3.21,;1.18,1.87,;3.28,2.44,;2.72,4.54,;1.95,5.87,;4.26,4.54,;5.03,5.87,;6.57,5.87,;7.34,7.21,;6.6,8.59,;5.03,8.54,;4.26,7.21,;7.37,9.92,;8.14,11.26,;-.88,1.67,;-2.39,1.35,;-3.16,2.69,;-4.69,2.85,;-5.46,4.18,;-6.96,3.86,;-8.11,4.89,;-7.13,2.33,;-5.72,1.7,)|

BDBM507142

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@@H](C)CCN(C)C2=O)nnc1-c1nc(C)cs1 |r,wD:19.20,(6.03,-3.95,;4.54,-4.35,;3.46,-3.26,;3.85,-1.77,;2.76,-.68,;1.28,-1.08,;.88,-2.57,;-.61,-2.97,;-1.7,-1.88,;1.97,-3.66,;1.57,-5.15,;2.47,-6.39,;4.01,-6.39,;4.78,-7.72,;5.55,-9.06,;3.45,-8.49,;6.12,-6.95,;6.12,-5.41,;7.45,-4.64,;8.79,-5.41,;8.79,-6.95,;10.12,-4.64,;10.12,-3.1,;8.79,-2.33,;8.79,-.79,;7.45,-3.1,;6.12,-2.33,;1.57,-7.64,;.1,-7.16,;.1,-5.62,;-1.23,-4.85,;-2.69,-5.33,;-3.6,-4.08,;-5.14,-4.08,;-2.69,-2.84,;-1.23,-3.31,)|

BDBM507143

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(-6.57,5.12,;-5.1,4.64,;-3.96,5.68,;-4.28,7.18,;-3.13,8.21,;-1.67,7.74,;-1.35,6.23,;.12,5.75,;1.26,6.78,;-2.49,5.2,;-2.17,3.69,;-.76,3.07,;.57,3.84,;1.9,3.07,;1.13,1.73,;3.24,2.3,;2.67,4.4,;1.9,5.73,;4.21,4.4,;4.98,3.07,;4.98,5.73,;6.52,5.73,;7.29,7.07,;6.52,8.4,;7.29,9.74,;4.98,8.4,;4.21,7.07,;-.93,1.53,;-2.43,1.21,;-3.2,2.55,;-4.73,2.71,;-5.5,4.04,;-7.01,3.72,;-7.17,2.19,;-8.5,1.42,;-5.76,1.57,)|

BDBM507144

COCC[C@H](Cc1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wD:4.3,(5.35,-1.44,;4.01,-2.21,;4.01,-3.75,;2.68,-4.52,;2.68,-6.06,;4.01,-6.83,;5.35,-6.06,;6.68,-6.83,;8.01,-6.06,;8.01,-4.52,;9.35,-3.75,;6.68,-3.75,;5.35,-4.52,;1.34,-6.83,;.26,-7.91,;2.43,-7.91,;.01,-6.06,;-1.45,-6.53,;-1.93,-8,;-3.47,-8,;-3.95,-6.53,;-5.41,-6.06,;-5.89,-4.59,;-7.43,-4.59,;-8.33,-3.35,;-7.9,-6.06,;-6.66,-6.96,;-2.7,-5.63,;-2.7,-4.09,;-4.03,-3.32,;-5.37,-4.09,;-6.7,-3.32,;-4.03,-1.78,;-2.7,-1.01,;-1.37,-1.78,;-1.37,-3.32,;-.03,-4.09,;1.29,-3.3,)|

BDBM507145

COCC[C@@H]([C@H](C)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wU:4.3,5.5,(4.47,17.2,;3.14,16.43,;3.14,14.89,;1.8,14.12,;1.8,12.58,;3.14,11.81,;3.14,10.27,;4.47,12.58,;5.81,11.81,;7.14,12.58,;7.14,14.12,;8.47,14.89,;5.81,14.89,;4.47,14.12,;.47,11.81,;-.62,10.72,;1.56,10.72,;-.86,12.58,;-2.33,12.11,;-2.8,10.64,;-4.34,10.64,;-4.82,12.11,;-6.28,12.58,;-6.76,14.05,;-8.3,14.05,;-9.2,15.29,;-8.78,12.58,;-7.53,11.68,;-3.57,13.01,;-3.57,14.55,;-4.91,15.32,;-6.24,14.55,;-7.57,15.32,;-4.91,16.86,;-3.57,17.63,;-2.24,16.86,;-2.24,15.32,;-.91,14.55,;.42,15.34,)|

BDBM507146

COCC[C@H](Cc1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wD:4.3,(4.92,-1.6,;3.58,-2.37,;3.58,-3.91,;2.25,-4.68,;2.25,-6.22,;3.58,-6.99,;4.92,-6.22,;6.25,-6.99,;7.59,-6.22,;7.59,-4.68,;8.92,-3.91,;6.25,-3.91,;4.92,-4.68,;.92,-6.99,;-.17,-8.08,;2.01,-8.08,;-.42,-6.22,;-1.88,-6.69,;-2.36,-8.16,;-3.9,-8.16,;-4.37,-6.69,;-5.84,-6.22,;-6.31,-4.75,;-7.85,-4.75,;-8.76,-3.51,;-8.33,-6.22,;-7.08,-7.12,;-3.13,-5.79,;-3.13,-4.25,;-4.46,-3.48,;-5.79,-4.25,;-7.13,-3.48,;-4.46,-1.94,;-3.13,-1.17,;-1.79,-1.94,;-1.79,-3.48,;-.46,-4.25,;.87,-3.46,)|

BDBM507147

COCC[C@H](Cc1ncc(C)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wD:4.4,(5.23,-2.9,;3.9,-3.67,;3.9,-5.21,;2.57,-5.98,;2.57,-7.52,;3.9,-8.29,;5.23,-7.52,;6.57,-8.29,;7.9,-7.52,;7.9,-5.98,;9.24,-5.21,;6.57,-5.21,;5.23,-5.98,;1.23,-8.29,;.14,-9.38,;2.32,-9.38,;-.1,-7.52,;-1.56,-7.99,;-2.04,-9.46,;-3.58,-9.46,;-4.06,-7.99,;-5.52,-7.52,;-6,-6.05,;-7.54,-6.05,;-8.44,-4.81,;-8.01,-7.52,;-6.77,-8.42,;-2.81,-7.09,;-2.81,-5.55,;-4.14,-4.78,;-5.48,-5.55,;-6.81,-4.78,;-4.14,-3.24,;-2.81,-2.47,;-1.48,-3.24,;-1.48,-4.78,;-.14,-5.55,;1.19,-4.78,)|

BDBM507148

COCC[C@H]([C@@H](C)c1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wD:4.3,5.5,(4.74,8.85,;3.4,8.08,;3.4,6.54,;2.07,5.77,;2.07,4.23,;3.4,3.46,;3.4,1.92,;4.74,4.23,;6.07,3.46,;7.4,4.23,;7.4,5.77,;8.74,6.54,;6.07,6.54,;4.74,5.77,;.74,3.46,;-.35,2.37,;1.82,2.37,;-.6,4.23,;-2.06,3.75,;-2.54,2.29,;-4.08,2.29,;-4.55,3.75,;-6.02,4.23,;-6.5,5.69,;-8.04,5.69,;-8.94,6.94,;-8.51,4.23,;-7.27,3.32,;-3.31,4.66,;-3.31,6.2,;-4.64,6.97,;-5.98,6.2,;-7.31,6.97,;-4.64,8.51,;-3.31,9.28,;-1.98,8.51,;-1.98,6.97,;-.64,6.2,;.68,6.98,)|

BDBM507151

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](CCOCc2ccccc2)Cc2ccc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,(.56,6.54,;-.78,5.77,;-2.11,6.54,;-2.11,8.08,;-3.45,8.85,;-4.78,8.08,;-4.78,6.54,;-6.11,5.77,;-7.45,6.54,;-3.45,5.77,;-3.45,4.23,;-2.2,3.32,;-.71,3.72,;.62,2.95,;-.47,1.86,;1.71,1.86,;1.95,3.72,;1.95,5.26,;3.29,6.03,;3.29,7.57,;4.62,8.34,;4.62,9.88,;3.29,10.65,;3.29,12.19,;4.62,12.96,;5.96,12.19,;5.96,10.65,;3.29,2.95,;4.62,3.72,;5.96,2.95,;7.29,3.72,;7.29,5.26,;8.62,6.03,;5.96,6.03,;4.62,5.26,;-2.68,1.86,;-4.22,1.86,;-4.69,3.32,;-6.16,3.8,;-6.63,5.26,;-8.17,5.26,;-9.08,6.51,;-8.65,3.8,;-7.4,2.9,)|

BDBM507152

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:18.19,wD:16.17,(2.3,-16.19,;.96,-16.96,;-.37,-16.19,;-.37,-14.65,;-1.7,-13.88,;-3.04,-14.65,;-3.04,-16.19,;-4.37,-16.96,;-5.71,-16.19,;-1.7,-16.96,;-1.7,-18.5,;-.46,-19.4,;1.03,-19,;2.12,-20.09,;1.03,-21.18,;3.21,-21.18,;3.21,-19,;2.81,-17.52,;4.69,-19.4,;5.09,-20.89,;5.78,-18.31,;5.39,-16.83,;6.47,-15.74,;7.96,-16.14,;9.05,-15.05,;8.36,-17.62,;7.27,-18.71,;-.93,-20.87,;-2.47,-20.87,;-2.95,-19.4,;-4.41,-18.93,;-4.89,-17.46,;-6.43,-17.46,;-6.91,-18.93,;-8.37,-19.4,;-5.66,-19.83,)|

BDBM507153

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,18.19,(1.76,-4.73,;.43,-5.5,;-.9,-4.73,;-.9,-3.19,;-2.24,-2.42,;-3.57,-3.19,;-3.57,-4.73,;-4.9,-5.5,;-6.24,-4.73,;-2.24,-5.5,;-2.24,-7.04,;-.99,-7.95,;.5,-7.55,;1.59,-8.64,;.5,-9.73,;2.68,-9.73,;2.68,-7.55,;2.28,-6.06,;4.16,-7.95,;4.56,-9.44,;5.25,-6.86,;4.85,-5.37,;5.94,-4.28,;7.43,-4.68,;8.52,-3.59,;7.83,-6.17,;6.74,-7.26,;-1.47,-9.41,;-3.01,-9.41,;-3.48,-7.95,;-4.95,-7.47,;-5.42,-6.01,;-6.96,-6.01,;-7.44,-7.47,;-8.9,-7.95,;-6.19,-8.38,)|

BDBM507154

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(F)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,18.19,(1.96,-4.42,;.62,-5.19,;-.71,-4.42,;-.71,-2.88,;-2.04,-2.11,;-3.38,-2.88,;-3.38,-4.42,;-4.71,-5.19,;-6.04,-4.42,;-2.04,-5.19,;-2.04,-6.73,;-.8,-7.64,;.69,-7.24,;1.78,-8.33,;.69,-9.42,;2.87,-9.42,;2.87,-7.24,;2.47,-5.75,;4.36,-7.64,;4.75,-9.12,;5.44,-6.55,;5.05,-5.06,;6.13,-3.97,;7.62,-4.37,;8.71,-3.28,;8.02,-5.86,;6.93,-6.95,;-1.27,-9.1,;-2.81,-9.1,;-3.29,-7.64,;-4.75,-7.16,;-5.23,-5.7,;-6.77,-5.7,;-7.25,-7.16,;-8.71,-7.64,;-6,-8.07,)|

BDBM507155

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:3.3,2.1,(5.63,-10.03,;6.4,-8.7,;5.63,-7.37,;4.09,-7.37,;3.32,-6.03,;3.32,-8.7,;2.55,-10.03,;4.66,-9.47,;1.99,-7.93,;.66,-8.7,;.5,-10.23,;-1.01,-10.55,;-1.78,-9.22,;-3.31,-9.06,;-4.08,-7.72,;-5.59,-8.04,;-5.75,-9.58,;-7.08,-10.35,;-4.34,-10.2,;-.75,-8.07,;-1.07,-6.57,;.07,-5.54,;1.54,-6.01,;2.68,-4.98,;-.25,-4.03,;-1.71,-3.56,;-2.85,-4.59,;-2.53,-6.09,;-3.68,-7.12,;-5.14,-6.65,;6.4,-6.03,;5.63,-4.7,;6.4,-3.37,;7.94,-3.37,;8.71,-2.03,;8.71,-4.7,;7.94,-6.03,)|

BDBM507156

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:3.3,2.1,(5.36,-10.83,;6.13,-9.49,;5.36,-8.16,;3.82,-8.16,;3.05,-6.83,;3.05,-9.49,;2.28,-10.83,;4.39,-10.26,;1.72,-8.72,;.39,-9.49,;.22,-11.03,;-1.28,-11.35,;-2.05,-10.01,;-3.58,-9.85,;-4.35,-8.52,;-5.86,-8.84,;-6.02,-10.37,;-7.35,-11.14,;-4.61,-11,;-1.02,-8.87,;-1.34,-7.36,;-.2,-6.33,;1.27,-6.81,;2.41,-5.78,;-.52,-4.83,;-1.98,-4.35,;-3.13,-5.38,;-2.81,-6.89,;-3.95,-7.92,;-5.42,-7.44,;6.13,-6.83,;5.36,-5.49,;6.13,-4.16,;7.67,-4.16,;8.44,-2.83,;8.44,-5.49,;7.67,-6.83,)|

BDBM507157

CCOC(=O)c1ccc(OC)c(c1)-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(-9.23,2.27,;-7.9,3.04,;-6.57,2.27,;-5.23,3.04,;-5.23,4.58,;-3.9,2.27,;-2.57,3.04,;-1.23,2.27,;-1.23,.73,;.1,-.04,;1.43,.73,;-2.57,-.04,;-3.9,.73,;-2.57,-1.58,;-1.32,-2.48,;.14,-2.01,;1.23,-3.1,;.14,-4.18,;1.63,-4.58,;2.57,-2.33,;3.9,-3.1,;5.23,-2.33,;6.57,-3.1,;7.9,-2.33,;7.9,-.79,;9.23,-.02,;6.57,-.02,;5.23,-.79,;-1.8,-3.95,;-3.34,-3.95,;-3.81,-2.48,;-5.28,-2.01,;-5.75,-.54,;-7.29,-.54,;-7.77,-2.01,;-6.52,-2.91,)|

BDBM507158

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cnccn1 |r,wU:16.17,(-6.48,5.83,;-5.01,5.35,;-3.87,6.38,;-4.19,7.89,;-3.04,8.92,;-1.58,8.45,;-1.26,6.94,;.21,6.46,;1.34,7.51,;-2.4,5.91,;-1.92,3.92,;-.51,3.29,;.82,4.06,;2.15,3.29,;1.38,1.96,;3.49,2.52,;2.92,4.62,;2.15,5.96,;4.46,4.62,;5.23,5.96,;4.46,7.29,;5.23,8.62,;6.77,8.62,;7.54,9.96,;7.54,7.29,;6.77,5.96,;-.67,1.76,;-2.18,1.44,;-2.95,2.77,;-4.48,2.93,;-5.39,1.69,;-6.92,1.85,;-7.54,3.25,;-6.64,4.5,;-5.11,4.34,)|

BDBM507160

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccncn1 |r,wD:16.17,(1.47,-3.92,;.27,-4.94,;-1.23,-4.4,;-1.56,-2.93,;-2.96,-2.48,;-4.13,-3.47,;-3.83,-4.97,;-5,-6.04,;-6.49,-5.6,;-2.36,-5.48,;-1.94,-7.45,;-.51,-8.08,;.84,-7.3,;2.15,-8.08,;3.53,-8.86,;1.41,-9.42,;2.96,-6.73,;2.33,-5.68,;4.49,-6.76,;5.27,-5.39,;6.82,-5.39,;7.6,-4.04,;6.82,-2.72,;7.63,-1.38,;5.3,-2.72,;4.49,-4.04,;-.69,-9.6,;-2.21,-9.93,;-2.99,-8.62,;-4.55,-8.38,;-5.15,-7.03,;-6.7,-6.85,;-7.63,-8.11,;-7,-9.51,;-5.45,-9.69,)|

BDBM507162

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cccnn1 |r,wD:16.17,(-6.52,-5.14,;-5.19,-5.91,;-3.86,-5.14,;-3.86,-3.6,;-2.52,-2.83,;-1.19,-3.6,;-1.19,-5.14,;.15,-5.91,;1.48,-5.14,;-2.52,-5.91,;-2.52,-7.45,;-1.28,-8.36,;.06,-7.59,;1.39,-8.36,;.06,-9.13,;2.73,-9.13,;2.73,-7.59,;2.73,-6.05,;4.06,-8.36,;5.39,-7.59,;6.73,-8.36,;8.06,-7.59,;8.06,-6.05,;9.39,-5.28,;6.73,-5.28,;5.39,-6.05,;-1.75,-9.82,;-3.29,-9.82,;-3.77,-8.36,;-5.31,-8.36,;-6.08,-7.03,;-7.62,-7.03,;-8.39,-8.36,;-7.62,-9.69,;-6.08,-9.69,)|

BDBM507163

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(C)c1 |r,wU:16.17,(-6.12,6.09,;-4.66,5.62,;-3.51,6.65,;-3.83,8.15,;-2.69,9.19,;-1.22,8.71,;-.9,7.2,;.56,6.73,;1.69,7.77,;-2.05,6.17,;-1.57,4.18,;-.16,3.55,;1.17,4.32,;2.51,3.55,;1.74,2.22,;3.84,2.78,;3.28,4.89,;2.51,6.22,;4.82,4.89,;5.59,6.22,;4.82,7.55,;5.59,8.89,;7.13,8.89,;7.9,10.22,;7.9,7.55,;7.13,6.22,;-.32,2.02,;-1.83,1.7,;-2.6,3.04,;-4.13,3.2,;-4.9,4.53,;-6.4,4.21,;-6.56,2.68,;-7.9,1.91,;-5.16,2.05,)|

BDBM507165

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,(1.81,-4.22,;.63,-5.24,;-.86,-4.74,;-1.16,-3.29,;-2.64,-2.76,;-3.74,-3.78,;-3.47,-5.27,;-4.62,-6.37,;-6.11,-5.9,;-1.98,-5.79,;-1.57,-7.77,;-.14,-8.37,;1.18,-7.63,;2.5,-8.4,;3.85,-9.17,;1.76,-9.75,;3.27,-7.08,;2.69,-6.01,;4.84,-7.05,;5.58,-5.71,;7.15,-5.71,;7.92,-4.33,;7.15,-3.04,;7.94,-1.69,;5.61,-3.04,;4.84,-4.36,;-.33,-9.94,;-1.85,-10.27,;-2.62,-8.92,;-4.16,-8.73,;-4.9,-7.44,;-6.41,-7.74,;-6.6,-9.28,;-7.95,-10.08,;-5.2,-9.91,)|

BDBM507166

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,(1.82,-3.59,;.63,-4.61,;-.85,-4.12,;-1.16,-2.63,;-2.64,-2.14,;-3.74,-3.13,;-3.47,-4.64,;-4.62,-5.71,;-6.11,-5.27,;-1.98,-5.16,;-1.57,-7.14,;-.14,-7.75,;1.18,-6.98,;2.5,-7.78,;3.85,-8.55,;1.76,-9.12,;3.3,-6.43,;2.7,-5.35,;4.84,-6.43,;5.58,-5.05,;7.15,-5.08,;7.92,-3.7,;7.18,-2.41,;7.95,-1.06,;5.61,-2.38,;4.84,-3.73,;-.33,-9.32,;-1.84,-9.62,;-2.61,-8.3,;-4.15,-8.08,;-4.92,-6.79,;-6.41,-7.09,;-6.6,-8.66,;-7.95,-9.4,;-5.2,-9.26,)|

BDBM507167

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccncn1 |r,wD:16.17,(1.43,-3.84,;.24,-4.91,;-1.25,-4.41,;-1.55,-2.96,;-3.04,-2.46,;-4.15,-3.46,;-3.84,-4.91,;-4.99,-6.02,;-6.48,-5.56,;-2.35,-5.48,;-1.97,-7.39,;-.56,-8.04,;.78,-7.28,;2.12,-8.04,;3.45,-8.81,;1.35,-9.38,;2.88,-6.74,;2.31,-5.67,;4.45,-6.7,;5.21,-5.37,;6.74,-5.37,;7.54,-4.07,;6.74,-2.73,;7.5,-1.36,;5.21,-2.73,;4.41,-4.03,;-.71,-9.57,;-2.24,-9.88,;-3,-8.58,;-4.53,-8.35,;-5.14,-7.01,;-6.67,-6.82,;-7.59,-8.08,;-6.98,-9.46,;-5.45,-9.65,)|

BDBM507168

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccncn1 |r,wD:16.17,(1.46,-3.84,;.27,-4.91,;-1.2,-4.42,;-1.52,-2.95,;-2.99,-2.45,;-4.12,-3.47,;-3.8,-4.97,;-4.98,-6.01,;-6.48,-5.57,;-2.35,-5.49,;-1.92,-7.45,;-.51,-8.06,;.85,-7.31,;2.18,-8.06,;3.51,-8.84,;1.4,-9.41,;2.99,-6.73,;2.35,-5.69,;4.52,-6.73,;5.27,-5.37,;6.86,-5.4,;7.61,-4.01,;6.83,-2.71,;7.61,-1.39,;5.3,-2.71,;4.52,-4.04,;-.65,-9.62,;-2.18,-9.93,;-2.96,-8.61,;-4.52,-8.4,;-5.13,-7.02,;-6.69,-6.84,;-7.61,-8.11,;-6.97,-9.5,;-5.41,-9.67,)|

BDBM507169

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cnn(C)c1 |r,wD:16.17,(1.81,-3.67,;.63,-4.67,;-.85,-4.16,;-1.15,-2.68,;-2.6,-2.19,;-3.74,-3.22,;-3.44,-4.76,;-4.59,-5.79,;-6.04,-5.34,;-1.96,-5.21,;-1.54,-7.21,;-.15,-7.84,;1.18,-7.06,;2.51,-7.87,;3.87,-8.63,;1.75,-9.2,;3.29,-6.51,;2.69,-5.46,;4.83,-6.51,;5.59,-5.12,;4.83,-3.8,;5.62,-2.47,;7.16,-2.47,;7.91,-1.11,;7.91,-3.8,;7.16,-5.15,;-.3,-9.38,;-1.81,-9.71,;-2.57,-8.39,;-4.14,-8.2,;-4.89,-6.88,;-6.4,-7.18,;-6.55,-8.72,;-7.91,-9.53,;-5.13,-9.35,)|

BDBM507170

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1nnc(C)o1 |r,wD:16.17,(1.83,-3.61,;.62,-4.67,;-.85,-4.15,;-1.15,-2.68,;-2.63,-2.2,;-3.74,-3.22,;-3.44,-4.7,;-4.62,-5.75,;-6.09,-5.33,;-2,-5.21,;-1.58,-7.16,;-.16,-7.79,;1.16,-7.01,;2.49,-7.79,;3.84,-8.58,;1.73,-9.15,;3.3,-6.47,;2.7,-5.42,;4.83,-6.47,;5.59,-5.12,;4.8,-3.79,;5.62,-2.44,;7.15,-2.47,;7.94,-1.11,;7.94,-3.76,;7.15,-5.12,;-.34,-9.33,;-1.85,-9.66,;-2.6,-8.34,;-4.16,-8.13,;-4.92,-6.8,;-6.45,-7.13,;-6.6,-8.64,;-7.96,-9.42,;-5.19,-9.33,)|

BDBM507171

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cncnc1 |r,wD:16.17,(1.39,-4.01,;.24,-5.07,;-1.25,-4.58,;-1.55,-3.1,;-3.03,-2.64,;-4.12,-3.64,;-3.85,-5.16,;-5,-6.19,;-6.43,-5.7,;-2.37,-5.61,;-1.94,-7.58,;-.55,-8.19,;.79,-7.43,;2.12,-8.22,;3.45,-9.01,;1.36,-9.55,;2.91,-6.89,;2.3,-5.86,;4.45,-6.89,;5.21,-5.55,;4.42,-4.22,;5.21,-2.88,;6.76,-2.88,;7.55,-1.55,;7.52,-4.22,;6.76,-5.55,;-.7,-9.74,;-2.22,-10.07,;-3,-8.74,;-4.52,-8.55,;-5.43,-9.83,;-6.97,-9.65,;-7.58,-8.31,;-6.7,-7.01,;-5.13,-7.19,)|

BDBM507172

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccnnc1 |r,wD:16.17,(1.51,-5.18,;.37,-6.21,;-1.1,-5.73,;-1.42,-4.22,;-2.88,-3.75,;-4.02,-4.78,;-3.7,-6.28,;-4.85,-7.32,;-6.31,-6.84,;-2.24,-6.76,;-1.92,-8.27,;-.51,-8.89,;.82,-8.12,;2.15,-8.89,;1.38,-10.23,;3.49,-9.66,;2.92,-7.56,;2.15,-6.23,;4.46,-7.56,;5.23,-6.23,;4.46,-4.89,;5.23,-3.56,;6.77,-3.56,;7.54,-2.22,;7.54,-4.89,;6.77,-6.23,;-.67,-10.42,;-2.18,-10.74,;-2.95,-9.41,;-4.48,-9.25,;-5.11,-7.84,;-6.64,-7.68,;-7.54,-8.93,;-6.92,-10.34,;-5.39,-10.5,)|

BDBM507173

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cnn(C)c1 |r,wD:16.17,(1.78,-3.65,;.6,-4.66,;-.87,-4.17,;-1.2,-2.67,;-2.62,-2.23,;-3.77,-3.21,;-3.47,-4.72,;-4.62,-5.78,;-6.1,-5.32,;-2.02,-5.24,;-1.61,-7.18,;-.19,-7.81,;1.12,-7.04,;2.46,-7.81,;3.8,-8.6,;1.7,-9.15,;3.26,-6.47,;2.66,-5.43,;4.76,-6.47,;5.53,-5.13,;7.09,-5.13,;7.85,-3.82,;7.09,-2.48,;7.85,-1.13,;5.56,-2.48,;4.76,-3.79,;-.35,-9.34,;-1.86,-9.67,;-2.65,-8.33,;-4.18,-8.14,;-4.92,-6.85,;-6.45,-7.15,;-6.62,-8.68,;-7.9,-9.5,;-5.19,-9.31,)|

BDBM507174

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cnn(C)c1 |r,wD:16.17,(1.84,-3.7,;.66,-4.72,;-.82,-4.22,;-1.15,-2.71,;-2.61,-2.25,;-3.73,-3.26,;-3.43,-4.77,;-4.59,-5.84,;-6.07,-5.38,;-1.98,-5.27,;-1.56,-7.24,;-.14,-7.85,;1.18,-7.11,;2.53,-7.88,;3.87,-8.64,;1.76,-9.22,;3.32,-6.53,;2.72,-5.49,;4.83,-6.53,;5.6,-5.16,;4.83,-3.84,;5.63,-2.49,;7.17,-2.52,;7.94,-1.15,;7.94,-3.84,;7.17,-5.18,;-.3,-9.41,;-1.81,-9.74,;-2.58,-8.4,;-4.15,-8.2,;-4.89,-6.91,;-6.42,-7.22,;-6.59,-8.75,;-7.93,-9.55,;-5.16,-9.36,)|

BDBM507175

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)n(C)n1 |r,wD:16.17,(-6.64,-3.94,;-5.3,-4.71,;-3.97,-3.94,;-3.97,-2.4,;-2.64,-1.63,;-1.3,-2.4,;-1.3,-3.94,;.03,-4.71,;1.36,-3.94,;-2.64,-4.71,;-2.64,-6.25,;-1.39,-7.15,;-.06,-6.38,;1.28,-7.15,;-.06,-7.92,;2.61,-7.92,;2.61,-6.38,;2.61,-4.84,;3.94,-7.15,;5.28,-6.38,;6.61,-7.15,;7.95,-6.38,;7.95,-4.84,;9.28,-4.07,;6.61,-4.07,;5.28,-4.84,;-1.87,-8.62,;-3.41,-8.62,;-3.88,-7.15,;-5.42,-7.15,;-6.33,-5.91,;-7.79,-6.38,;-9.28,-5.99,;-7.79,-7.92,;-9.13,-8.69,;-6.33,-8.4,)|

BDBM507182

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)n(C)n1 |r,wD:16.17,(1.87,-5.28,;.72,-6.31,;-.74,-5.84,;-1.06,-4.33,;-2.53,-3.86,;-3.67,-4.89,;-3.35,-6.39,;-4.49,-7.42,;-5.96,-6.95,;-1.89,-6.87,;-1.57,-8.37,;-.16,-9,;1.17,-8.23,;2.51,-9,;1.74,-10.34,;3.84,-9.77,;3.28,-7.67,;2.51,-6.33,;4.82,-7.67,;5.59,-6.33,;4.82,-5,;5.59,-3.67,;7.13,-3.67,;7.9,-2.33,;7.9,-5,;7.13,-6.33,;-.32,-10.53,;-1.83,-10.85,;-2.6,-9.52,;-4.13,-9.36,;-4.9,-8.02,;-6.4,-8.35,;-7.55,-7.31,;-6.56,-9.88,;-7.9,-10.65,;-5.16,-10.5,)|

BDBM507184

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cn(C)nn1 |r,wD:16.17,(1.87,-5.28,;.72,-6.31,;-.74,-5.84,;-1.06,-4.33,;-2.53,-3.86,;-3.67,-4.89,;-3.35,-6.39,;-4.49,-7.42,;-5.96,-6.95,;-1.89,-6.87,;-1.57,-8.37,;-.16,-9,;1.17,-8.23,;2.51,-9,;1.74,-10.34,;3.84,-9.77,;3.28,-7.67,;2.51,-6.33,;4.82,-7.67,;5.59,-6.33,;4.82,-5,;5.59,-3.67,;7.13,-3.67,;7.9,-2.33,;7.9,-5,;7.13,-6.33,;-.32,-10.53,;-1.83,-10.85,;-2.6,-9.52,;-4.13,-9.36,;-5.16,-10.5,;-6.56,-9.88,;-7.9,-10.65,;-6.4,-8.35,;-4.9,-8.02,)|

BDBM507185

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ncccn1 |r,wD:16.17,(1.51,-5.18,;.37,-6.21,;-1.1,-5.73,;-1.42,-4.22,;-2.88,-3.75,;-4.02,-4.78,;-3.7,-6.28,;-4.85,-7.32,;-6.31,-6.84,;-2.24,-6.76,;-1.92,-8.27,;-.51,-8.89,;.82,-8.12,;2.15,-8.89,;1.38,-10.23,;3.49,-9.66,;2.92,-7.56,;2.15,-6.23,;4.46,-7.56,;5.23,-6.23,;4.46,-4.89,;5.23,-3.56,;6.77,-3.56,;7.54,-2.22,;7.54,-4.89,;6.77,-6.23,;-.67,-10.42,;-2.18,-10.74,;-2.95,-9.41,;-4.48,-9.25,;-5.11,-7.84,;-6.64,-7.68,;-7.54,-8.93,;-6.92,-10.34,;-5.39,-10.5,)|

BDBM507186

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)no1 |r,wD:16.17,(1.69,-5.28,;.55,-6.31,;-.92,-5.84,;-1.24,-4.33,;-2.7,-3.86,;-3.85,-4.89,;-3.53,-6.39,;-4.67,-7.42,;-6.13,-6.95,;-2.06,-6.87,;-1.74,-8.37,;-.33,-9,;1,-8.23,;2.33,-9,;1.56,-10.34,;3.67,-9.77,;3.1,-7.67,;2.33,-6.33,;4.64,-7.67,;5.41,-6.33,;4.64,-5,;5.41,-3.67,;6.95,-3.67,;7.72,-2.33,;7.72,-5,;6.95,-6.33,;-.49,-10.53,;-2,-10.85,;-2.77,-9.52,;-4.3,-9.36,;-5.07,-8.02,;-6.58,-8.35,;-7.72,-7.31,;-6.74,-9.88,;-5.33,-10.5,)|

BDBM507193

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1conc1C |r,wD:16.17,(-6.63,-6.84,;-5.16,-7.31,;-4.02,-6.28,;-4.34,-4.78,;-3.19,-3.75,;-1.73,-4.22,;-1.41,-5.73,;.06,-6.21,;1.2,-5.17,;-2.55,-6.76,;-2.23,-8.27,;-.83,-8.89,;.51,-8.12,;1.84,-8.89,;1.07,-10.23,;3.18,-9.66,;2.61,-7.56,;1.84,-6.23,;4.15,-7.56,;4.92,-6.23,;4.15,-4.89,;4.92,-3.56,;6.46,-3.56,;7.23,-2.22,;7.23,-4.89,;6.46,-6.23,;-.99,-10.42,;-2.49,-10.74,;-3.26,-9.41,;-4.79,-9.25,;-5.56,-7.92,;-7.07,-8.24,;-7.23,-9.77,;-5.82,-10.39,;-5.5,-11.9,)|

BDBM507195

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:15.16,(-7.9,-11.99,;-7.9,-10.45,;-6.56,-9.68,;-6.4,-8.15,;-4.9,-7.83,;-4.13,-9.16,;-5.16,-10.31,;-2.6,-9.32,;-1.83,-10.66,;-.32,-10.34,;-.16,-8.8,;1.17,-8.03,;2.51,-8.8,;1.74,-10.14,;3.84,-9.57,;3.28,-7.47,;2.51,-6.14,;4.82,-7.47,;5.59,-6.14,;4.82,-4.8,;5.59,-3.47,;7.13,-3.47,;7.9,-2.14,;7.9,-4.8,;7.13,-6.14,;-1.57,-8.18,;-1.89,-6.67,;-3.35,-6.2,;-4.49,-7.23,;-5.96,-6.75,;-3.67,-4.69,;-2.53,-3.66,;-1.06,-4.13,;-.74,-5.64,;.72,-6.12,;1.87,-5.09,)|

BDBM507196

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(-5.96,-6.29,;-4.49,-6.76,;-3.35,-5.73,;-3.67,-4.22,;-2.53,-3.19,;-1.06,-3.67,;-.74,-5.18,;.72,-5.65,;1.87,-4.62,;-1.89,-6.21,;-1.57,-7.71,;-.16,-8.34,;1.17,-7.57,;2.51,-8.34,;1.74,-9.67,;3.84,-9.11,;3.28,-7.01,;2.51,-5.67,;4.82,-7.01,;5.59,-8.34,;5.59,-5.67,;7.13,-5.67,;7.9,-4.34,;7.13,-3,;7.9,-1.67,;5.59,-3,;4.82,-4.34,;-.32,-9.87,;-1.83,-10.19,;-2.6,-8.86,;-4.13,-8.7,;-4.9,-7.36,;-6.4,-7.68,;-6.56,-9.21,;-7.9,-9.98,;-5.16,-9.84,)|

BDBM507200

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc[nH]n1 |r,wU:16.17,(-5.47,-7.99,;-4.01,-8.46,;-2.86,-7.43,;-3.18,-5.93,;-2.04,-4.9,;-.57,-5.37,;-.25,-6.88,;1.21,-7.35,;2.36,-6.32,;-1.4,-7.91,;-1.08,-9.41,;.33,-10.04,;1.66,-9.27,;3,-10.04,;2.23,-11.37,;4.33,-10.81,;3.77,-8.71,;5.31,-8.71,;3,-7.37,;3.77,-6.04,;5.31,-6.04,;6.08,-4.71,;5.31,-3.37,;6.08,-2.04,;3.77,-3.37,;3,-4.71,;.17,-11.57,;-1.34,-11.89,;-2.11,-10.56,;-3.64,-10.4,;-4.41,-9.06,;-5.92,-9.38,;-6.08,-10.92,;-4.67,-11.54,)|

BDBM507201

CNC(=O)n1ccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,(-4.74,-14.33,;-6.08,-13.56,;-6.08,-12.02,;-7.41,-11.25,;-4.74,-11.25,;-4.58,-9.72,;-3.08,-9.4,;-2.31,-10.73,;-3.34,-11.87,;-.77,-10.89,;-0,-12.22,;1.5,-11.9,;1.66,-10.37,;3,-9.6,;4.33,-10.37,;3.56,-11.71,;5.66,-11.14,;5.1,-9.04,;6.64,-9.04,;4.33,-7.71,;5.1,-6.37,;6.64,-6.37,;7.41,-5.04,;6.64,-3.7,;7.41,-2.37,;5.1,-3.7,;4.33,-5.04,;.26,-9.75,;-.06,-8.24,;-1.53,-7.76,;-2.67,-8.79,;-4.14,-8.32,;-1.85,-6.26,;-.7,-5.23,;.76,-5.7,;1.08,-7.21,;2.55,-7.69,;3.69,-6.66,)|

BDBM507206

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1noc2ccccc12 |r,wU:16.17,18.19,(1.19,2.34,;-.14,1.57,;-1.47,2.34,;-1.47,3.88,;-2.81,4.65,;-4.14,3.88,;-4.14,2.34,;-5.47,1.57,;-6.81,2.34,;-2.81,1.57,;-2.81,.03,;-1.56,-.87,;-.23,-.1,;1.11,-.87,;-.23,-1.64,;2.44,-1.64,;2.44,-.1,;2.44,1.44,;3.77,-.87,;3.77,-2.41,;5.11,-.1,;6.44,-.87,;7.77,-.1,;7.77,1.44,;9.11,2.21,;6.44,2.21,;5.11,1.44,;-2.04,-2.34,;-3.58,-2.34,;-4.05,-.87,;-5.59,-.87,;-6.5,.37,;-7.96,-.1,;-7.96,-1.64,;-9.11,-2.67,;-8.79,-4.18,;-7.32,-4.65,;-6.18,-3.62,;-6.5,-2.12,)|

BDBM507207

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-.03,1.8,;.13,3.33,;-1.11,4.24,;-2.52,3.61,;-3.77,4.52,;-2.68,2.08,;-4.21,2.24,;-1.15,1.92,;-2.84,.55,;-1.6,-.36,;-.13,.12,;.77,-1.13,;-.13,-2.37,;.34,-3.84,;-.56,-5.08,;.34,-6.33,;1.81,-5.85,;3.14,-6.62,;4.47,-5.85,;4.47,-4.31,;3.14,-3.54,;1.81,-4.31,;-1.6,-1.9,;-2.84,-2.8,;-2.68,-4.33,;-1.28,-4.96,;-1.11,-6.49,;-3.93,-5.24,;-5.34,-4.61,;-5.5,-3.08,;-4.25,-2.18,;-4.41,-.64,;-5.82,-.02,;-.95,5.77,;-2.2,6.67,;-2.04,8.21,;-.63,8.83,;-.47,10.36,;.61,7.93,;.45,6.4,)|

BDBM507208

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccccc23)n1C1CCOCC1)c1ncc(C)cn1 |r|

BDBM507209

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(-.02,1.8,;.14,3.33,;-1.1,4.24,;-2.51,3.61,;-3.76,4.52,;-2.67,2.08,;-4.2,2.24,;-1.14,1.92,;-2.83,.55,;-1.59,-.36,;-.12,.12,;.78,-1.13,;-.12,-2.37,;.35,-3.84,;-.55,-5.08,;.35,-6.33,;1.82,-5.85,;3.15,-6.62,;4.48,-5.85,;4.48,-4.31,;3.15,-3.54,;1.82,-4.31,;-1.59,-1.9,;-2.83,-2.8,;-2.67,-4.33,;-1.27,-4.96,;-1.1,-6.49,;-3.92,-5.24,;-5.33,-4.61,;-5.49,-3.08,;-4.24,-2.18,;-4.4,-.64,;-5.81,-.02,;-.94,5.77,;-2.19,6.68,;-2.03,8.21,;-.62,8.83,;-.46,10.36,;.62,7.93,;.46,6.4,)|

BDBM507210

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1noc2ccccc12 |r,wU:18.19,16.17,(1.24,2.36,;-.08,1.57,;-1.43,2.32,;-1.57,3.87,;-2.88,4.64,;-4.19,3.9,;-4.22,2.35,;-5.55,1.56,;-6.75,2.54,;-2.88,1.58,;-2.91,.03,;-1.65,-.87,;-.2,-.41,;1.13,-1.17,;-.18,-1.94,;2.47,-1.94,;2.44,-.38,;2.47,1.12,;3.83,-1.15,;3.81,-2.7,;5.14,-.38,;6.45,-1.17,;7.79,-.41,;7.82,1.15,;9.13,1.91,;6.45,1.91,;5.12,1.15,;-2.11,-2.35,;-3.67,-2.35,;-4.13,-.9,;-5.69,-.87,;-6.56,.38,;-8.04,-.11,;-8.04,-1.64,;-9.13,-2.65,;-8.83,-4.18,;-7.38,-4.64,;-6.26,-3.63,;-6.56,-2.1,)|

BDBM507211

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccon2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(-6.66,.29,;-5.19,-.19,;-4.87,-1.69,;-3.41,-2.17,;-3.09,-3.67,;-2.26,-1.14,;-3.29,.01,;-1.23,-2.28,;-1.12,-.11,;.35,-.58,;.82,-2.05,;2.36,-2.05,;2.84,-.58,;4.3,-.11,;4.78,1.36,;6.32,1.36,;6.8,-.11,;5.55,-1.01,;1.59,.32,;1.59,1.86,;.26,2.63,;-1.07,1.86,;-2.41,2.63,;.26,4.17,;1.59,4.94,;2.93,4.17,;2.93,2.63,;4.26,1.86,;5.59,2.63,;-6.02,-2.72,;-5.7,-4.23,;-6.84,-5.26,;-8.3,-4.78,;-9.45,-5.81,;-8.62,-3.28,;-7.48,-2.25,)|

BDBM507212

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cscn1 |(-7.42,1.45,;-6.09,.68,;-4.76,1.45,;-4.76,2.99,;-3.42,3.76,;-2.09,2.99,;-2.09,1.45,;-.75,.68,;.58,1.45,;-3.42,.68,;-3.42,-1.22,;-2.18,-2.13,;-.71,-1.65,;.62,-2.42,;-.15,-3.76,;1.39,-3.76,;1.96,-1.65,;3.29,-2.42,;4.62,-1.65,;5.96,-2.42,;7.29,-1.65,;7.29,-.11,;8.62,.66,;5.96,.66,;4.62,-.11,;-2.65,-3.59,;-4.19,-3.59,;-4.67,-2.13,;-6.13,-1.65,;-6.61,-.19,;-8.15,-.19,;-8.62,-1.65,;-7.38,-2.56,)|

BDBM507213

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ncco1 |(-7.42,1.45,;-6.09,.68,;-4.76,1.45,;-4.76,2.99,;-3.42,3.76,;-2.09,2.99,;-2.09,1.45,;-.75,.68,;.58,1.45,;-3.42,.68,;-3.42,-1.22,;-2.18,-2.13,;-.71,-1.65,;.62,-2.42,;-.15,-3.76,;1.39,-3.76,;1.96,-1.65,;3.29,-2.42,;4.62,-1.65,;5.96,-2.42,;7.29,-1.65,;7.29,-.11,;8.62,.66,;5.96,.66,;4.62,-.11,;-2.65,-3.59,;-4.19,-3.59,;-4.67,-2.13,;-6.13,-1.65,;-7.38,-2.56,;-8.62,-1.65,;-8.15,-.19,;-6.61,-.19,)|

BDBM507214

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cncn1C |(-7.42,1.62,;-6.09,.85,;-4.76,1.62,;-4.76,3.16,;-3.42,3.93,;-2.09,3.16,;-2.09,1.62,;-.75,.85,;.58,1.62,;-3.42,.85,;-3.42,-1.05,;-2.18,-1.96,;-.71,-1.48,;.62,-2.25,;-.15,-3.59,;1.39,-3.59,;1.96,-1.48,;3.29,-2.25,;4.62,-1.48,;5.96,-2.25,;7.29,-1.48,;7.29,.06,;8.62,.83,;5.96,.83,;4.62,.06,;-2.65,-3.42,;-4.19,-3.42,;-4.67,-1.96,;-6.13,-1.48,;-6.61,-.02,;-8.15,-.02,;-8.62,-1.48,;-7.38,-2.39,;-7.38,-3.93,)|

BDBM507215

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(F)cn2)nnc1-c1nc(C)cs1 |(-5.85,-6.3,;-4.51,-7.07,;-3.18,-6.3,;-3.18,-4.76,;-1.85,-3.99,;-.51,-4.76,;-.51,-6.3,;.82,-7.07,;2.16,-6.3,;-1.85,-7.07,;-1.85,-8.61,;-.6,-9.52,;.89,-9.12,;2.22,-9.89,;2.99,-11.22,;1.45,-11.22,;3.56,-9.12,;4.89,-9.89,;6.22,-9.12,;7.56,-9.89,;8.89,-9.12,;8.89,-7.58,;10.22,-6.81,;7.56,-6.81,;6.22,-7.58,;-1.08,-10.98,;-2.62,-10.98,;-3.09,-9.52,;-4.58,-9.12,;-5.05,-7.66,;-6.59,-7.66,;-7.36,-6.32,;-7.07,-9.12,;-5.82,-10.03,)|

BDBM507216

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCN2[C@@H](C)CCCC2=O)nnc1-c1nc(C)cs1 |r,wD:19.20,(-7.11,7.57,;-5.78,6.8,;-4.44,7.57,;-4.44,9.11,;-3.11,9.88,;-1.78,9.11,;-1.78,7.57,;-.44,6.8,;.88,7.59,;-3.11,6.8,;-3.11,4.94,;-1.86,4.03,;-.4,4.51,;.74,3.48,;-.03,2.15,;1.51,2.15,;2.21,3.96,;3.35,2.92,;4.82,3.4,;5.96,2.37,;5.64,.86,;7.43,2.85,;7.75,4.35,;6.6,5.38,;5.14,4.91,;3.99,5.94,;-2.34,2.57,;-3.88,2.57,;-4.36,4.03,;-5.82,4.51,;-6.3,5.97,;-7.84,5.97,;-8.74,7.22,;-8.31,4.51,;-7.07,3.6,)|

BDBM507217

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ncc(F)cn2)nnc1-c1nc(cs1)C(C)C |(-6.44,1.27,;-5.11,.5,;-3.78,1.27,;-3.78,2.81,;-2.44,3.58,;-1.11,2.81,;-1.11,1.27,;.23,.5,;1.56,1.27,;-2.44,.5,;-2.44,-1.04,;-1.2,-1.95,;.27,-1.47,;1.6,-2.24,;.83,-3.58,;2.37,-3.58,;2.94,-1.47,;4.27,-2.24,;5.6,-1.47,;6.94,-2.24,;8.27,-1.47,;8.27,.07,;9.6,.84,;6.94,.84,;5.6,.07,;-1.67,-3.41,;-3.21,-3.41,;-3.69,-1.95,;-5.15,-1.47,;-5.63,-.01,;-7.17,-.01,;-7.64,-1.47,;-6.4,-2.38,;-8.07,1.24,;-9.6,1.08,;-7.45,2.64,)|

BDBM507218

CCc1csc(n1)-c1nnc(NS(=O)(=O)CCc2ncc(F)cn2)n1-c1c(OC)cccc1OC |(-9.6,1.08,;-8.07,1.24,;-7.17,-.01,;-7.64,-1.47,;-6.4,-2.38,;-5.15,-1.47,;-5.63,-.01,;-3.69,-1.95,;-3.21,-3.41,;-1.67,-3.41,;-1.2,-1.95,;.27,-1.47,;1.6,-2.24,;.83,-3.58,;2.37,-3.58,;2.94,-1.47,;4.27,-2.24,;5.6,-1.47,;6.94,-2.24,;8.27,-1.47,;8.27,.07,;9.6,.84,;6.94,.84,;5.6,.07,;-2.44,-1.04,;-2.44,.5,;-3.78,1.27,;-5.11,.5,;-6.44,1.27,;-3.78,2.81,;-2.44,3.58,;-1.11,2.81,;-1.11,1.27,;.23,.5,;1.56,1.27,)|

BDBM507219

COc1ccc(CNCc2ccc(OC)cc2OC)c(OC)c1

BDBM507220

CCc1nc(cs1)-c1nnc(NS(=O)(=O)CCc2ncc(F)cn2)n1-c1c(OC)cccc1OC |(-9.6,1.08,;-8.07,1.24,;-7.17,-.01,;-5.63,-.01,;-5.15,-1.47,;-6.4,-2.38,;-7.64,-1.47,;-3.69,-1.95,;-3.21,-3.41,;-1.67,-3.41,;-1.2,-1.95,;.27,-1.47,;1.6,-2.24,;.83,-3.58,;2.37,-3.58,;2.94,-1.47,;4.27,-2.24,;5.6,-1.47,;6.94,-2.24,;8.27,-1.47,;8.27,.07,;9.6,.84,;6.94,.84,;5.6,.07,;-2.44,-1.04,;-2.44,.5,;-3.78,1.27,;-5.11,.5,;-6.44,1.27,;-3.78,2.81,;-2.44,3.58,;-1.11,2.81,;-1.11,1.27,;.23,.5,;1.56,1.27,)|

BDBM507221

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wD:16.17,(-7.29,-4.13,;-5.95,-4.9,;-4.62,-4.13,;-4.62,-2.59,;-3.28,-1.82,;-1.95,-2.59,;-1.95,-4.13,;-.62,-4.9,;.71,-4.11,;-3.28,-4.9,;-3.28,-6.76,;-2.04,-7.67,;-.57,-7.19,;.76,-7.96,;-.01,-9.29,;1.53,-9.29,;2.09,-7.19,;2.09,-5.65,;3.43,-7.96,;4.76,-7.19,;6.09,-7.96,;7.43,-7.19,;7.43,-5.65,;8.76,-4.88,;6.09,-4.88,;4.76,-5.65,;-2.51,-9.13,;-4.05,-9.13,;-4.53,-7.67,;-6,-7.19,;-6.47,-5.73,;-8.01,-5.73,;-8.92,-4.48,;-8.49,-7.19,;-7.24,-8.1,)|

BDBM507222

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,(-7.29,-4.13,;-5.95,-4.9,;-4.62,-4.13,;-4.62,-2.59,;-3.28,-1.82,;-1.95,-2.59,;-1.95,-4.13,;-.62,-4.9,;.71,-4.11,;-3.28,-4.9,;-3.28,-6.76,;-2.04,-7.67,;-.57,-7.19,;.76,-7.96,;-.01,-9.29,;1.53,-9.29,;2.09,-7.19,;2.09,-5.65,;3.43,-7.96,;4.76,-7.19,;6.09,-7.96,;7.43,-7.19,;7.43,-5.65,;8.76,-4.88,;6.09,-4.88,;4.76,-5.65,;-2.51,-9.13,;-4.05,-9.13,;-4.53,-7.67,;-6,-7.19,;-6.47,-5.73,;-8.01,-5.73,;-8.92,-4.48,;-8.49,-7.19,;-7.24,-8.1,)|

BDBM507225

CCc1csc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:15.16,(-9.6,-4.48,;-8.07,-4.32,;-7.17,-5.57,;-7.64,-7.03,;-6.4,-7.94,;-5.15,-7.03,;-5.63,-5.57,;-3.69,-7.51,;-3.21,-8.97,;-1.67,-8.97,;-1.2,-7.51,;.27,-7.03,;1.6,-7.8,;.83,-9.13,;2.37,-9.13,;2.94,-7.03,;2.94,-5.49,;4.27,-7.8,;5.6,-7.03,;6.94,-7.8,;8.27,-7.03,;8.27,-5.49,;9.6,-4.72,;6.94,-4.72,;5.6,-5.49,;-2.44,-6.6,;-2.44,-5.06,;-3.78,-4.29,;-5.11,-5.06,;-6.44,-4.29,;-3.78,-2.75,;-2.44,-1.98,;-1.11,-2.75,;-1.11,-4.29,;.23,-5.06,;1.56,-4.29,)|

BDBM507226

CCc1csc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:15.16,(-9.6,-5.11,;-8.07,-4.95,;-7.17,-6.19,;-7.64,-7.66,;-6.4,-8.56,;-5.15,-7.66,;-5.63,-6.19,;-3.69,-8.13,;-3.21,-9.6,;-1.67,-9.6,;-1.2,-8.13,;.27,-7.66,;1.6,-8.43,;.83,-9.76,;2.37,-9.76,;2.94,-7.66,;2.94,-6.12,;4.27,-8.43,;5.6,-7.66,;6.94,-8.43,;8.27,-7.66,;8.27,-6.12,;9.6,-5.35,;6.94,-5.35,;5.6,-6.12,;-2.44,-7.23,;-2.44,-5.69,;-3.78,-4.92,;-5.11,-5.69,;-6.44,-4.92,;-3.78,-3.38,;-2.44,-2.61,;-1.11,-3.38,;-1.11,-4.92,;.23,-5.69,;1.56,-4.92,)|

BDBM507227

CCc1csc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:15.16,(-9.6,-5.11,;-8.07,-4.95,;-7.17,-6.19,;-7.64,-7.66,;-6.4,-8.56,;-5.15,-7.66,;-5.63,-6.19,;-3.69,-8.13,;-3.21,-9.6,;-1.67,-9.6,;-1.2,-8.13,;.27,-7.66,;1.6,-8.43,;.83,-9.76,;2.37,-9.76,;2.94,-7.66,;2.94,-6.12,;4.27,-8.43,;5.6,-7.66,;6.94,-8.43,;8.27,-7.66,;8.27,-6.12,;9.6,-5.35,;6.94,-5.35,;5.6,-6.12,;-2.44,-7.23,;-2.44,-5.69,;-3.78,-4.92,;-5.11,-5.69,;-6.44,-4.92,;-3.78,-3.38,;-2.44,-2.61,;-1.11,-3.38,;-1.11,-4.92,;.23,-5.69,;1.56,-4.92,)|

BDBM507228

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H]2CCC[C@H]2c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:20.22,wD:16.16,(-5.63,-3.98,;-4.3,-4.75,;-2.96,-3.98,;-2.96,-2.44,;-1.63,-1.67,;-.3,-2.44,;-.3,-3.98,;1.04,-4.75,;2.37,-3.98,;-1.63,-4.75,;-1.63,-6.29,;-.38,-7.19,;1.08,-6.72,;2.42,-7.49,;1.65,-8.82,;3.19,-8.82,;3.75,-6.72,;3.91,-5.19,;5.42,-4.87,;6.19,-6.2,;5.16,-7.34,;5.48,-8.85,;4.33,-9.88,;4.65,-11.39,;6.12,-11.86,;6.44,-13.37,;7.26,-10.83,;6.94,-9.33,;-.86,-8.66,;-2.4,-8.66,;-2.88,-7.19,;-4.34,-6.72,;-4.82,-5.25,;-6.36,-5.25,;-7.26,-4.01,;-6.83,-6.72,;-5.59,-7.62,)|

BDBM507230

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCC[C@@H]2c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.16,wD:20.22,(-5.63,-3.98,;-4.3,-4.75,;-2.96,-3.98,;-2.96,-2.44,;-1.63,-1.67,;-.3,-2.44,;-.3,-3.98,;1.04,-4.75,;2.37,-3.98,;-1.63,-4.75,;-1.63,-6.29,;-.38,-7.19,;1.08,-6.72,;2.42,-7.49,;1.65,-8.82,;3.19,-8.82,;3.75,-6.72,;3.91,-5.19,;5.42,-4.87,;6.19,-6.2,;5.16,-7.34,;5.48,-8.85,;4.33,-9.88,;4.65,-11.39,;6.12,-11.86,;6.44,-13.37,;7.26,-10.83,;6.94,-9.33,;-.86,-8.66,;-2.4,-8.66,;-2.88,-7.19,;-4.34,-6.72,;-4.82,-5.25,;-6.36,-5.25,;-7.26,-4.01,;-6.83,-6.72,;-5.59,-7.62,)|

BDBM507231

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCC[C@H]2c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.16,20.22,(-5.63,-3.98,;-4.3,-4.75,;-2.96,-3.98,;-2.96,-2.44,;-1.63,-1.67,;-.3,-2.44,;-.3,-3.98,;1.04,-4.75,;2.37,-3.98,;-1.63,-4.75,;-1.63,-6.29,;-.38,-7.19,;1.08,-6.72,;2.42,-7.49,;1.65,-8.82,;3.19,-8.82,;3.75,-6.72,;3.91,-5.19,;5.42,-4.87,;6.19,-6.2,;5.16,-7.34,;5.48,-8.85,;4.33,-9.88,;4.65,-11.39,;6.12,-11.86,;6.44,-13.37,;7.26,-10.83,;6.94,-9.33,;-.86,-8.66,;-2.4,-8.66,;-2.88,-7.19,;-4.34,-6.72,;-4.82,-5.25,;-6.36,-5.25,;-7.26,-4.01,;-6.83,-6.72,;-5.59,-7.62,)|

BDBM507232

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,wD:18.19,(-7.21,-4.59,;-5.87,-5.36,;-4.54,-4.59,;-4.54,-3.05,;-3.21,-2.28,;-1.87,-3.05,;-1.87,-4.59,;-.54,-5.36,;.79,-4.59,;-3.21,-5.36,;-3.21,-6.9,;-1.96,-7.8,;-.5,-7.33,;.84,-8.1,;.07,-9.43,;1.61,-9.43,;2.17,-7.33,;2.17,-5.79,;3.5,-8.1,;3.5,-9.64,;4.84,-7.33,;6.17,-8.1,;7.51,-7.33,;7.51,-5.79,;8.84,-5.02,;6.17,-5.02,;4.84,-5.79,;-2.44,-9.27,;-3.98,-9.27,;-4.45,-7.8,;-5.92,-7.33,;-6.39,-5.86,;-7.93,-5.86,;-8.84,-4.61,;-8.41,-7.33,;-7.16,-8.23,)|

BDBM507234

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O[Si](C)(C)C(C)(C)C)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,wD:18.19,(-.34,14.23,;-.02,12.73,;-1.16,11.69,;-2.63,12.17,;-3.77,11.14,;-3.45,9.63,;-1.99,9.16,;-1.67,7.65,;-2.81,6.62,;-.84,10.19,;.62,9.71,;1.1,8.25,;.19,7,;.82,5.6,;-.59,4.97,;2.23,6.22,;1.45,4.19,;2.98,4.03,;.54,2.94,;-.99,3.1,;-1.89,1.86,;-3.14,2.76,;-.65,.95,;-2.8,.61,;-4.05,1.52,;-1.55,-.29,;-3.71,-.63,;1.17,1.54,;2.7,1.37,;3.33,-.03,;2.42,-1.28,;3.05,-2.68,;.89,-1.12,;.26,.29,;2.64,8.25,;3.12,9.71,;1.87,10.62,;1.87,12.16,;.62,13.06,;1.1,14.53,;.19,15.77,;2.64,14.53,;3.12,13.06,)|

BDBM507235

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,wD:2.1,(2.29,1.73,;3.63,2.5,;3.63,4.04,;2.29,4.81,;2.29,6.35,;.96,4.04,;.19,2.71,;1.73,2.71,;-.37,4.81,;-1.84,4.34,;-2.31,2.87,;-3.85,2.87,;-4.33,4.34,;-5.8,4.81,;-6.27,6.28,;-7.81,6.28,;-8.72,7.53,;-8.29,4.81,;-7.04,3.91,;-3.08,5.24,;-3.08,7.11,;-4.42,7.88,;-5.75,7.11,;-7.09,7.88,;-4.42,9.42,;-3.08,10.19,;-1.75,9.42,;-1.75,7.88,;-.42,7.11,;.91,7.89,;4.96,4.81,;6.29,4.04,;7.63,4.81,;7.63,6.35,;8.96,7.12,;6.29,7.12,;4.96,6.35,)|

BDBM507236

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:2.1,wD:3.3,(2.29,1.73,;3.63,2.5,;3.63,4.04,;2.29,4.81,;2.29,6.35,;.96,4.04,;.19,2.71,;1.73,2.71,;-.37,4.81,;-1.84,4.34,;-2.31,2.87,;-3.85,2.87,;-4.33,4.34,;-5.8,4.81,;-6.27,6.28,;-7.81,6.28,;-8.72,7.53,;-8.29,4.81,;-7.04,3.91,;-3.08,5.24,;-3.08,7.11,;-4.42,7.88,;-5.75,7.11,;-7.09,7.88,;-4.42,9.42,;-3.08,10.19,;-1.75,9.42,;-1.75,7.88,;-.42,7.11,;.91,7.89,;4.96,4.81,;6.29,4.04,;7.63,4.81,;7.63,6.35,;8.96,7.12,;6.29,7.12,;4.96,6.35,)|

BDBM507237

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cc2F)nnc1-c1ccn(C)n1 |r,wU:17.18,(-7.21,-4.48,;-5.87,-5.25,;-4.54,-4.48,;-4.54,-2.94,;-3.21,-2.17,;-1.87,-2.94,;-1.87,-4.48,;-.54,-5.25,;.79,-4.48,;-3.21,-5.25,;-3.21,-6.79,;-1.96,-7.69,;-.5,-7.22,;.84,-7.99,;.07,-9.32,;1.61,-9.32,;2.17,-7.22,;3.5,-7.99,;3.5,-9.53,;4.84,-7.22,;6.17,-7.99,;7.51,-7.22,;7.51,-5.68,;8.84,-4.91,;6.17,-4.91,;4.84,-5.68,;3.5,-4.91,;-2.44,-9.16,;-3.98,-9.16,;-4.45,-7.69,;-5.92,-7.22,;-7.16,-8.12,;-8.41,-7.22,;-7.93,-5.75,;-8.84,-4.51,;-6.39,-5.75,)|

BDBM507238

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(4.84,-10.02,;3.5,-9.25,;3.5,-7.71,;2.17,-6.94,;2.17,-5.4,;.84,-7.71,;.07,-9.04,;1.61,-9.04,;-.5,-6.94,;-1.96,-7.42,;-2.44,-8.88,;-3.98,-8.88,;-4.45,-7.42,;-5.92,-6.94,;-7.16,-7.85,;-8.41,-6.94,;-7.93,-5.48,;-8.84,-4.23,;-6.39,-5.48,;-3.21,-6.51,;-3.21,-4.97,;-4.54,-4.2,;-5.87,-4.97,;-7.21,-4.2,;-4.54,-2.66,;-3.21,-1.89,;-1.87,-2.66,;-1.87,-4.2,;-.54,-4.97,;.79,-4.2,;4.84,-6.94,;6.17,-7.71,;7.51,-6.94,;7.51,-5.4,;8.84,-4.63,;6.17,-4.63,;4.84,-5.4,)|

BDBM507240

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.17,wD:18.19,(-7.21,1.37,;-5.87,.6,;-4.54,1.37,;-4.54,2.91,;-3.21,3.68,;-1.87,2.91,;-1.87,1.37,;-.54,.6,;.79,1.37,;-3.21,.6,;-3.21,-.94,;-1.96,-1.85,;-.5,-1.37,;.84,-2.14,;.07,-3.47,;1.61,-3.47,;2.17,-1.37,;2.17,.17,;3.5,-2.14,;3.5,-3.68,;4.84,-1.37,;6.17,-2.14,;7.51,-1.37,;7.51,.17,;8.84,.94,;6.17,.94,;4.84,.17,;-2.44,-3.31,;-3.98,-3.31,;-4.45,-1.85,;-5.92,-1.37,;-6.39,.1,;-7.93,.1,;-8.84,1.34,;-8.41,-1.37,;-7.16,-2.27,)|

BDBM507241

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:18.19,16.17,(-7.21,1.37,;-5.87,.6,;-4.54,1.37,;-4.54,2.91,;-3.21,3.68,;-1.87,2.91,;-1.87,1.37,;-.54,.6,;.79,1.37,;-3.21,.6,;-3.21,-.94,;-1.96,-1.85,;-.5,-1.37,;.84,-2.14,;.07,-3.47,;1.61,-3.47,;2.17,-1.37,;2.17,.17,;3.5,-2.14,;3.5,-3.68,;4.84,-1.37,;6.17,-2.14,;7.51,-1.37,;7.51,.17,;8.84,.94,;6.17,.94,;4.84,.17,;-2.44,-3.31,;-3.98,-3.31,;-4.45,-1.85,;-5.92,-1.37,;-6.39,.1,;-7.93,.1,;-8.84,1.34,;-8.41,-1.37,;-7.16,-2.27,)|

BDBM507242

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wD:18.19,16.17,(-7.21,1.37,;-5.87,.6,;-4.54,1.37,;-4.54,2.91,;-3.21,3.68,;-1.87,2.91,;-1.87,1.37,;-.54,.6,;.79,1.37,;-3.21,.6,;-3.21,-.94,;-1.96,-1.85,;-.5,-1.37,;.84,-2.14,;.07,-3.47,;1.61,-3.47,;2.17,-1.37,;2.17,.17,;3.5,-2.14,;3.5,-3.68,;4.84,-1.37,;6.17,-2.14,;7.51,-1.37,;7.51,.17,;8.84,.94,;6.17,.94,;4.84,.17,;-2.44,-3.31,;-3.98,-3.31,;-4.45,-1.85,;-5.92,-1.37,;-6.39,.1,;-7.93,.1,;-8.84,1.34,;-8.41,-1.37,;-7.16,-2.27,)|

BDBM507243

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wD:16.17,18.19,(-7.21,-4.59,;-5.87,-5.36,;-4.54,-4.59,;-4.54,-3.05,;-3.21,-2.28,;-1.87,-3.05,;-1.87,-4.59,;-.54,-5.36,;.79,-4.59,;-3.21,-5.36,;-3.21,-6.9,;-1.96,-7.8,;-.5,-7.33,;.84,-8.1,;.07,-9.43,;1.61,-9.43,;2.17,-7.33,;2.17,-5.79,;3.5,-8.1,;3.5,-9.64,;4.84,-7.33,;6.17,-8.1,;7.51,-7.33,;7.51,-5.79,;8.84,-5.02,;6.17,-5.02,;4.84,-5.79,;-2.44,-9.27,;-3.98,-9.27,;-4.45,-7.8,;-5.92,-7.33,;-6.39,-5.86,;-7.93,-5.86,;-8.84,-4.61,;-8.41,-7.33,;-7.16,-8.23,)|

BDBM507245

COc1cccc(C)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(2.02,-3.88,;.88,-4.91,;-.59,-4.44,;-.91,-2.93,;-2.37,-2.45,;-3.52,-3.48,;-3.24,-5.03,;-4.38,-6.06,;-1.73,-5.47,;-1.41,-6.97,;-0,-7.6,;1.33,-6.83,;2.66,-7.6,;1.89,-8.93,;4,-8.37,;3.43,-6.27,;4.97,-6.27,;5.74,-4.93,;7.28,-4.93,;8.05,-3.6,;7.28,-2.26,;8.05,-.93,;5.74,-2.26,;4.97,-3.6,;-.16,-9.13,;-1.67,-9.45,;-2.44,-8.12,;-3.97,-7.96,;-4.74,-6.62,;-6.25,-6.94,;-6.41,-8.47,;-5,-9.1,)|

BDBM507246

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)N1CCCC1=O |(.57,.59,;-.75,-.19,;-2.09,.58,;-2.09,2.12,;-3.42,2.89,;-4.76,2.12,;-4.76,.58,;-3.42,-.19,;-3.42,-2.05,;-2.18,-2.96,;-.71,-2.48,;.62,-3.25,;-.47,-4.34,;1.02,-4.74,;1.96,-2.48,;3.29,-3.25,;4.62,-2.48,;5.96,-3.25,;7.29,-2.48,;7.29,-.94,;8.62,-.17,;5.96,-.17,;4.62,-.94,;-2.65,-4.42,;-4.19,-4.42,;-4.67,-2.96,;-6.13,-2.48,;-6.61,-1.02,;-8.15,-1.02,;-8.62,-2.48,;-7.38,-3.39,;-6.09,2.89,;-6.25,4.42,;-7.76,4.74,;-8.53,3.41,;-7.5,2.26,;-7.82,.76,)|

BDBM507247

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)N1CCC1=O |(.7,.76,;-.63,-.01,;-1.97,.76,;-1.97,2.3,;-3.3,3.07,;-4.63,2.3,;-4.63,.76,;-3.3,-.01,;-3.3,-1.55,;-2.05,-2.46,;-.59,-1.98,;.5,-3.07,;.9,-4.56,;-.59,-4.16,;1.83,-2.3,;3.17,-3.07,;4.5,-2.3,;5.83,-3.07,;7.17,-2.3,;7.17,-.76,;8.5,.01,;5.83,.01,;4.5,-.76,;-2.53,-3.92,;-4.07,-3.92,;-4.55,-2.46,;-6.01,-1.98,;-6.49,-.52,;-8.03,-.52,;-8.5,-1.98,;-7.26,-2.89,;-5.97,3.07,;-6.37,4.56,;-7.85,4.16,;-7.45,2.67,;-8.22,1.34,)|

BDBM507248

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)N1CCOCC1=O |(.77,.35,;-.57,-.42,;-1.9,.35,;-1.9,1.89,;-3.23,2.66,;-4.57,1.89,;-4.57,.35,;-3.23,-.42,;-3.23,-1.96,;-1.99,-2.87,;-.52,-2.39,;.57,-3.48,;.96,-4.97,;-.52,-4.57,;1.9,-2.71,;3.23,-3.48,;4.57,-2.71,;5.9,-3.48,;7.23,-2.71,;7.23,-1.17,;8.57,-.4,;5.9,-.4,;4.57,-1.17,;-2.46,-4.33,;-4,-4.33,;-4.48,-2.87,;-5.94,-2.39,;-6.42,-.93,;-7.96,-.93,;-8.44,-2.39,;-7.19,-3.3,;-5.9,2.66,;-5.9,4.2,;-7.23,4.97,;-8.57,4.2,;-8.57,2.66,;-7.23,1.89,;-7.23,.35,)|

BDBM507249

COc1cccc(C)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(2.22,-5.44,;1.04,-6.43,;-.41,-5.89,;-.66,-4.37,;-2.11,-3.84,;-3.29,-4.82,;-3.14,-6.38,;-4.34,-7.34,;-1.59,-6.87,;-1.34,-8.39,;.04,-9.07,;1.41,-8.36,;2.74,-9.13,;1.97,-10.46,;4.07,-9.9,;3.51,-7.8,;5.05,-7.8,;5.82,-6.46,;7.36,-6.46,;8.13,-5.13,;7.36,-3.8,;8.13,-2.46,;5.82,-3.8,;5.05,-5.13,;-.18,-10.6,;-1.7,-10.86,;-2.41,-9.49,;-3.94,-9.27,;-4.65,-7.9,;-6.17,-8.16,;-6.39,-9.68,;-5.01,-10.37,)|

BDBM507251

COc1ccc(cc1-n1c(N)nnc1-c1cccs1)N1CCC1=O |(4.6,.45,;3.27,-.32,;1.93,.44,;1.93,1.98,;.6,2.75,;-.74,1.98,;-.73,.44,;.6,-.33,;.6,-1.87,;1.85,-2.77,;3.31,-2.29,;1.37,-4.24,;-.17,-4.24,;-.64,-2.77,;-2.11,-2.3,;-2.59,-.83,;-4.13,-.84,;-4.6,-2.3,;-3.35,-3.21,;-2.07,2.75,;-2.47,4.24,;-3.96,3.84,;-3.56,2.35,;-4.33,1.02,)|

BDBM507252

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2Br)nnc1-c1cccs1)N1CCC1=O |(.7,.76,;-.63,-.01,;-1.97,.76,;-1.97,2.3,;-3.3,3.07,;-4.64,2.3,;-4.64,.76,;-3.3,-.01,;-3.3,-1.55,;-2.05,-2.45,;-.59,-1.98,;.5,-3.07,;.9,-4.55,;-.59,-4.16,;1.83,-2.3,;3.17,-3.07,;4.5,-2.3,;5.83,-3.07,;7.17,-2.3,;7.17,-.76,;8.5,.01,;5.83,.01,;4.5,-.76,;3.17,.01,;-2.53,-3.92,;-4.07,-3.92,;-4.55,-2.46,;-6.01,-1.98,;-6.49,-.52,;-8.03,-.52,;-8.5,-1.98,;-7.26,-2.89,;-5.97,3.07,;-6.37,4.55,;-7.86,4.15,;-7.46,2.67,;-8.23,1.33,)|

BDBM507253

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1cccs1)N1CCC1=O |(.7,.76,;-.63,-.01,;-1.97,.76,;-1.97,2.3,;-3.3,3.07,;-4.64,2.3,;-4.64,.76,;-3.3,-.01,;-3.3,-1.55,;-2.05,-2.45,;-.59,-1.98,;.5,-3.07,;.9,-4.55,;-.59,-4.16,;1.83,-2.3,;3.17,-3.07,;4.5,-2.3,;5.83,-3.07,;7.17,-2.3,;7.17,-.76,;8.5,.01,;5.83,.01,;4.43,-.67,;3.1,.12,;1.78,.9,;-2.53,-3.92,;-4.07,-3.92,;-4.55,-2.46,;-6.01,-1.98,;-6.49,-.52,;-8.03,-.52,;-8.5,-1.98,;-7.26,-2.89,;-5.97,3.07,;-6.37,4.55,;-7.86,4.15,;-7.46,2.67,;-8.23,1.33,)|

BDBM507254

COc1ccc(Br)cc1-n1c(N)nnc1-c1cccs1 |(4.8,-.4,;3.29,-.72,;2.26,.42,;2.74,1.89,;1.71,3.03,;.2,2.71,;-.83,3.86,;-.27,1.25,;.76,.1,;.28,-1.36,;1.19,-2.61,;2.73,-2.61,;.28,-3.86,;-1.18,-3.38,;-1.18,-1.84,;-2.43,-.93,;-2.43,.61,;-3.89,1.08,;-4.8,-.16,;-3.89,-1.41,)|

BDBM507255

CCn1ccc(n1)C(=O)NN\C(NS(=O)(=O)[C@@H](C)[C@H](OC)c1ncc(F)cn1)=N\c1c(OC)cccc1OC |r|

BDBM507256

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.2,4.4,(4.97,-4.5,;4.97,-2.96,;3.64,-2.19,;3.64,-.65,;2.31,.12,;2.31,1.66,;.97,-.65,;-.12,-1.74,;2.06,-1.74,;-.36,.12,;-1.7,-.65,;-1.86,-2.18,;-3.36,-2.5,;-4.13,-1.17,;-5.66,-1,;-6.75,.08,;-8.13,-.62,;-7.88,-2.14,;-8.97,-3.23,;-6.36,-2.38,;-3.1,-.02,;-3.42,1.48,;-4.89,1.96,;-6.03,.93,;-7.5,1.41,;-5.21,3.47,;-4.06,4.5,;-2.6,4.02,;-2.28,2.52,;-.81,2.04,;.33,3.07,;4.97,.12,;6.31,-.65,;7.64,.12,;7.64,1.66,;8.97,2.43,;6.31,2.43,;4.97,1.66,)|

BDBM507257

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1nccs1 |(-5.96,-4.41,;-4.62,-5.18,;-3.29,-4.41,;-3.29,-2.87,;-1.96,-2.1,;-.62,-2.87,;-.62,-4.41,;.71,-5.18,;2.05,-4.41,;-1.96,-5.18,;-1.96,-6.72,;-.71,-7.63,;.78,-7.23,;2.11,-8,;2.88,-9.33,;1.34,-9.33,;3.45,-7.23,;4.78,-8,;6.11,-7.23,;7.45,-8,;8.78,-7.23,;8.78,-5.69,;10.11,-4.92,;7.45,-4.92,;6.11,-5.69,;-1.19,-9.09,;-2.73,-9.09,;-3.2,-7.63,;-4.69,-7.23,;-5.16,-5.77,;-6.7,-5.77,;-7.18,-7.23,;-5.93,-8.13,)|

BDBM507258

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cncs1 |(-7.42,1.23,;-6.08,.49,;-4.74,1.28,;-4.72,2.84,;-3.4,3.58,;-2.09,2.82,;-2.09,1.31,;-.75,.49,;.62,1.31,;-3.4,.52,;-3.43,-1.04,;-2.17,-1.95,;-.72,-1.48,;.62,-2.25,;-.15,-3.58,;1.39,-3.58,;1.93,-1.45,;3.33,-2.22,;4.64,-1.45,;5.96,-2.25,;7.3,-1.48,;7.33,.08,;8.64,.84,;5.96,.84,;4.62,.08,;-2.64,-3.42,;-4.2,-3.42,;-4.66,-1.97,;-6.15,-1.58,;-6.62,-.11,;-8.16,-.11,;-8.64,-1.58,;-7.39,-2.48,)|

BDBM507259

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cnco1 |(-7.42,1.23,;-6.08,.49,;-4.74,1.28,;-4.72,2.84,;-3.4,3.58,;-2.09,2.82,;-2.09,1.31,;-.75,.49,;.62,1.31,;-3.4,.52,;-3.43,-1.04,;-2.17,-1.95,;-.72,-1.48,;.62,-2.25,;-.15,-3.58,;1.39,-3.58,;1.93,-1.45,;3.33,-2.22,;4.64,-1.45,;5.96,-2.25,;7.3,-1.48,;7.33,.08,;8.64,.84,;5.96,.84,;4.62,.08,;-2.64,-3.42,;-4.2,-3.42,;-4.66,-1.97,;-6.15,-1.58,;-6.62,-.11,;-8.16,-.11,;-8.64,-1.58,;-7.39,-2.48,)|

BDBM507260

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cocn1 |(-7.42,1.45,;-6.09,.68,;-4.76,1.45,;-4.76,2.99,;-3.42,3.76,;-2.09,2.99,;-2.09,1.45,;-.75,.68,;.58,1.45,;-3.42,.68,;-3.42,-1.22,;-2.18,-2.13,;-.71,-1.65,;.62,-2.42,;-.15,-3.76,;1.39,-3.76,;1.96,-1.65,;3.29,-2.42,;4.62,-1.65,;5.96,-2.42,;7.29,-1.65,;7.29,-.11,;8.62,.66,;5.96,.66,;4.62,-.11,;-2.65,-3.59,;-4.19,-3.59,;-4.67,-2.13,;-6.13,-1.65,;-7.38,-2.56,;-8.62,-1.65,;-8.15,-.19,;-6.61,-.19,)|

BDBM507261

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2Br)nnc1-c1nccs1 |(-5.85,-9.09,;-4.52,-9.86,;-3.18,-9.09,;-3.18,-7.55,;-1.85,-6.78,;-.52,-7.55,;-.52,-9.09,;.82,-9.86,;2.15,-9.09,;-1.85,-9.86,;-1.85,-11.4,;-.6,-12.3,;.88,-11.91,;2.22,-12.68,;2.99,-14.01,;1.45,-14.01,;3.55,-11.91,;4.89,-12.68,;6.22,-11.91,;6.22,-10.37,;7.55,-9.6,;8.89,-10.37,;10.22,-9.6,;8.89,-11.91,;7.55,-12.68,;7.55,-14.22,;-1.08,-13.77,;-2.62,-13.77,;-3.1,-12.3,;-4.58,-11.91,;-5.06,-10.44,;-6.6,-10.44,;-7.07,-11.91,;-5.83,-12.81,)|

BDBM507262

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccsc1 |(-7.42,1.45,;-6.09,.68,;-4.76,1.45,;-4.76,2.99,;-3.42,3.76,;-2.09,2.99,;-2.09,1.45,;-.75,.68,;.58,1.45,;-3.42,.68,;-3.42,-1.22,;-2.18,-2.13,;-.71,-1.65,;.62,-2.42,;-.15,-3.76,;1.39,-3.76,;1.96,-1.65,;3.29,-2.42,;4.62,-1.65,;5.96,-2.42,;7.29,-1.65,;7.29,-.11,;8.62,.66,;5.96,.66,;4.62,-.11,;-2.65,-3.59,;-4.19,-3.59,;-4.67,-2.13,;-6.13,-1.65,;-6.61,-.19,;-8.15,-.19,;-8.62,-1.65,;-7.38,-2.56,)|

BDBM507263

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1nc(C)cs1 |(-7.21,1.45,;-5.87,.68,;-4.54,1.45,;-4.54,2.99,;-3.21,3.76,;-1.87,2.99,;-1.87,1.45,;-.54,.68,;.79,1.45,;-3.21,.68,;-3.21,-1.22,;-1.96,-2.13,;-.5,-1.65,;.84,-2.42,;.07,-3.76,;1.61,-3.76,;2.17,-1.65,;3.5,-2.42,;4.84,-1.65,;6.17,-2.42,;7.51,-1.65,;7.51,-.11,;8.84,.66,;6.17,.66,;4.84,-.11,;-2.44,-3.59,;-3.98,-3.59,;-4.45,-2.13,;-5.92,-1.65,;-6.39,-.19,;-7.93,-.19,;-8.84,1.06,;-8.41,-1.65,;-7.16,-2.56,)|

BDBM507264

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ncc(C)s1 |(-6.69,1.45,;-5.36,.68,;-4.02,1.45,;-4.02,2.99,;-2.69,3.76,;-1.36,2.99,;-1.36,1.45,;-.02,.68,;1.31,1.45,;-2.69,.68,;-2.69,-1.22,;-1.44,-2.13,;.02,-1.65,;1.35,-2.42,;.58,-3.76,;2.12,-3.76,;2.69,-1.65,;4.02,-2.42,;5.36,-1.65,;6.69,-2.42,;8.02,-1.65,;8.02,-.11,;9.36,.66,;6.69,.66,;5.36,-.11,;-1.92,-3.59,;-3.46,-3.59,;-3.94,-2.13,;-5.4,-1.65,;-5.88,-.19,;-7.42,-.19,;-7.89,-1.65,;-9.36,-2.13,;-6.65,-2.56,)|

BDBM507265

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ncc(Cl)s1 |(-6.69,1.45,;-5.36,.68,;-4.02,1.45,;-4.02,2.99,;-2.69,3.76,;-1.36,2.99,;-1.36,1.45,;-.02,.68,;1.31,1.45,;-2.69,.68,;-2.69,-1.22,;-1.44,-2.13,;.02,-1.65,;1.35,-2.42,;.58,-3.76,;2.12,-3.76,;2.69,-1.65,;4.02,-2.42,;5.36,-1.65,;6.69,-2.42,;8.02,-1.65,;8.02,-.11,;9.36,.66,;6.69,.66,;5.36,-.11,;-1.92,-3.59,;-3.46,-3.59,;-3.94,-2.13,;-5.4,-1.65,;-5.88,-.19,;-7.42,-.19,;-7.89,-1.65,;-9.36,-2.13,;-6.65,-2.56,)|

BDBM507266

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cc(C)on1 |(-6.69,1.45,;-5.36,.68,;-4.02,1.45,;-4.02,2.99,;-2.69,3.76,;-1.36,2.99,;-1.36,1.45,;-.02,.68,;1.31,1.45,;-2.69,.68,;-2.69,-1.22,;-1.44,-2.13,;.02,-1.65,;1.35,-2.42,;.58,-3.76,;2.12,-3.76,;2.69,-1.65,;4.02,-2.42,;5.36,-1.65,;6.69,-2.42,;8.02,-1.65,;8.02,-.11,;9.36,.66,;6.69,.66,;5.36,-.11,;-1.92,-3.59,;-3.46,-3.59,;-3.94,-2.13,;-5.4,-1.65,;-6.65,-2.56,;-7.89,-1.65,;-9.36,-2.13,;-7.42,-.19,;-5.88,-.19,)|

BDBM507267

COCc1nc(cs1)-c1nnc(NS(=O)(=O)CCc2ccc(Cl)cc2)n1-c1c(OC)cccc1OC |(-10.03,2.08,;-9.08,.75,;-7.65,1.06,;-6.74,-.19,;-5.2,-.19,;-4.73,-1.65,;-5.97,-2.56,;-7.22,-1.65,;-3.26,-2.13,;-2.79,-3.59,;-1.25,-3.59,;-.77,-2.13,;.69,-1.65,;2.03,-2.42,;1.26,-3.76,;2.8,-3.76,;3.36,-1.65,;4.69,-2.42,;6.03,-1.65,;7.36,-2.42,;8.69,-1.65,;8.69,-.11,;10.03,.66,;7.36,.66,;6.03,-.11,;-2.02,-1.22,;-2.02,.68,;-3.35,1.45,;-4.69,.68,;-6.02,1.45,;-3.35,2.99,;-2.02,3.76,;-.68,2.99,;-.68,1.45,;.65,.68,;1.98,1.45,)|

BDBM507268

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1nc(C)cs1 |(-5.85,-8.32,;-4.51,-9.09,;-3.18,-8.32,;-3.18,-6.78,;-1.85,-6.01,;-.51,-6.78,;-.51,-8.32,;.82,-9.09,;2.16,-8.32,;-1.85,-9.09,;-1.85,-10.63,;-.6,-11.53,;.89,-11.14,;2.22,-11.91,;2.99,-13.24,;1.45,-13.24,;3.56,-11.14,;4.89,-11.91,;6.22,-11.14,;6.22,-9.6,;7.56,-8.83,;8.89,-9.6,;10.22,-8.83,;8.89,-11.14,;7.56,-11.96,;7.56,-13.5,;7.56,-15.04,;-1.08,-13,;-2.62,-13,;-3.09,-11.53,;-4.58,-11.14,;-5.05,-9.67,;-6.59,-9.67,;-7.36,-8.34,;-7.07,-11.14,;-5.82,-12.04,)|

BDBM507269

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1csc(C)n1 |(.84,2.56,;-.49,1.79,;-1.83,2.56,;-1.87,4.13,;-3.21,4.9,;-4.54,4.13,;-4.54,2.59,;-5.87,1.82,;-7.05,2.81,;-3.21,1.82,;-3.21,-.62,;-1.96,-1.52,;-.5,-1.05,;.84,-1.82,;.07,-3.15,;1.61,-3.15,;2.17,-1.05,;3.5,-1.82,;4.84,-1.05,;4.84,.49,;6.17,1.26,;7.51,.49,;8.84,1.26,;7.51,-1.05,;6.17,-1.87,;6.17,-3.41,;6.17,-4.95,;-2.44,-2.99,;-3.98,-2.99,;-4.45,-1.52,;-5.92,-1.05,;-7.16,-1.95,;-8.41,-1.05,;-7.93,.42,;-8.84,1.66,;-6.39,.42,)|

BDBM507270

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1csc(C)n1 |(-7.21,1.45,;-5.87,.68,;-4.54,1.45,;-4.54,2.99,;-3.21,3.76,;-1.87,2.99,;-1.87,1.45,;-.54,.68,;.79,1.45,;-3.21,.68,;-3.21,-1.22,;-1.96,-2.13,;-.5,-1.65,;.84,-2.42,;.07,-3.76,;1.61,-3.76,;2.17,-1.65,;3.5,-2.42,;4.84,-1.65,;6.17,-2.42,;7.51,-1.65,;7.51,-.11,;8.84,.66,;6.17,.66,;4.84,-.11,;-2.44,-3.59,;-3.98,-3.59,;-4.45,-2.13,;-5.92,-1.65,;-7.16,-2.56,;-8.41,-1.65,;-7.93,-.19,;-8.84,1.06,;-6.39,-.19,)|

BDBM507271

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1nc(cs1)C(C)C |(-6.44,1.45,;-5.11,.68,;-3.77,1.45,;-3.77,2.99,;-2.44,3.76,;-1.11,2.99,;-1.11,1.45,;.23,.68,;1.56,1.45,;-2.44,.68,;-2.44,-1.22,;-1.2,-2.13,;.27,-1.65,;1.6,-2.42,;.83,-3.76,;2.37,-3.76,;2.94,-1.65,;4.27,-2.42,;5.6,-1.65,;6.94,-2.42,;8.27,-1.65,;8.27,-.11,;9.6,.66,;6.94,.66,;5.6,-.11,;-1.67,-3.59,;-3.21,-3.59,;-3.69,-2.13,;-5.15,-1.65,;-5.63,-.19,;-7.17,-.19,;-7.64,-1.65,;-6.4,-2.56,;-8.07,1.06,;-7.45,2.46,;-9.6,.9,)|

BDBM507272

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1nc(cs1)C(C)C |(-6.44,2.32,;-5.11,1.55,;-3.78,2.32,;-3.78,3.86,;-2.44,4.63,;-1.11,3.86,;-1.11,2.32,;.23,1.55,;1.56,2.32,;-2.44,1.55,;-2.44,-.35,;-1.2,-1.26,;.27,-.78,;1.6,-1.55,;.83,-2.88,;2.37,-2.88,;2.94,-.78,;4.27,-1.55,;5.6,-.78,;5.6,.76,;6.94,1.53,;8.27,.76,;9.6,1.53,;8.27,-.78,;6.94,-1.61,;6.94,-3.15,;6.94,-4.69,;-1.67,-2.72,;-3.21,-2.72,;-3.69,-1.26,;-5.15,-.78,;-5.63,.68,;-7.17,.68,;-7.64,-.78,;-6.4,-1.69,;-8.07,1.93,;-7.45,3.34,;-9.6,1.77,)|

BDBM507273

CCc1csc(n1)-c1nnc(NS(=O)(=O)CCc2ccc(Cl)cc2)n1-c1c(OC)cccc1OC |(-9.6,.9,;-8.07,1.06,;-7.17,-.19,;-7.64,-1.65,;-6.4,-2.56,;-5.15,-1.65,;-5.63,-.19,;-3.69,-2.13,;-3.21,-3.59,;-1.67,-3.59,;-1.2,-2.13,;.27,-1.65,;1.6,-2.42,;.83,-3.76,;2.37,-3.76,;2.94,-1.65,;4.27,-2.42,;5.6,-1.65,;6.94,-2.42,;8.27,-1.65,;8.27,-.11,;9.6,.66,;6.94,.66,;5.6,-.11,;-2.44,-1.22,;-2.44,.68,;-3.78,1.45,;-5.11,.68,;-6.44,1.45,;-3.78,2.99,;-2.44,3.76,;-1.11,2.99,;-1.11,1.45,;.23,.68,;1.56,1.45,)|

BDBM507274

CCc1csc(n1)-c1nnc(NS(=O)(=O)CCc2ccc(F)cc2C#N)n1-c1c(OC)cccc1OC |(-9.6,1.77,;-8.07,1.93,;-7.17,.68,;-7.64,-.78,;-6.4,-1.69,;-5.15,-.78,;-5.63,.68,;-3.69,-1.26,;-3.21,-2.72,;-1.67,-2.72,;-1.2,-1.26,;.27,-.78,;1.6,-1.55,;.83,-2.88,;2.37,-2.88,;2.94,-.78,;4.27,-1.55,;5.6,-.78,;5.6,.76,;6.94,1.53,;8.27,.76,;9.6,1.53,;8.27,-.78,;6.94,-1.61,;6.94,-3.15,;6.94,-4.69,;-2.44,-.35,;-2.44,1.55,;-3.78,2.32,;-5.11,1.55,;-6.44,2.32,;-3.78,3.86,;-2.44,4.63,;-1.11,3.86,;-1.11,2.32,;.23,1.55,;1.56,2.32,)|

BDBM507275

CCc1nc(cs1)-c1nnc(NS(=O)(=O)CCc2ccc(F)cc2C#N)n1-c1c(OC)cccc1OC |(-9.6,1.95,;-8.07,2.11,;-7.17,.87,;-5.63,.87,;-5.15,-.6,;-6.4,-1.5,;-7.64,-.6,;-3.69,-1.08,;-3.21,-2.54,;-1.67,-2.54,;-1.2,-1.08,;.27,-.6,;1.6,-1.37,;.83,-2.7,;2.37,-2.7,;2.94,-.6,;4.27,-1.37,;5.6,-.6,;5.6,.94,;6.94,1.71,;8.27,.94,;9.6,1.71,;8.27,-.6,;6.94,-1.43,;6.94,-2.97,;6.94,-4.51,;-2.44,-.17,;-2.44,1.37,;-3.78,2.14,;-5.11,1.37,;-6.44,2.14,;-3.78,3.68,;-2.44,4.45,;-1.11,3.68,;-1.11,2.14,;.23,1.37,;1.56,2.14,)|

BDBM507276

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1nc(cs1)C1CC1 |(-6.5,2.14,;-5.17,1.37,;-3.84,2.14,;-3.84,3.68,;-2.5,4.45,;-1.17,3.68,;-1.17,2.14,;.16,1.37,;1.5,2.14,;-2.5,1.37,;-2.5,-.17,;-1.26,-1.08,;.21,-.6,;1.54,-1.37,;.77,-2.7,;2.31,-2.7,;2.87,-.6,;4.21,-1.37,;5.54,-.6,;5.54,.94,;6.87,1.71,;8.21,.94,;9.54,1.71,;8.21,-.6,;6.87,-1.43,;6.87,-2.97,;6.87,-4.51,;-1.73,-2.54,;-3.27,-2.54,;-3.75,-1.08,;-5.21,-.6,;-5.69,.87,;-7.23,.87,;-7.71,-.6,;-6.46,-1.5,;-8.14,2.11,;-8.3,3.64,;-9.54,2.74,)|

BDBM507277

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1nc(cs1)C(C)C |r,wD:16.17,(-6.44,-3.89,;-5.11,-4.66,;-3.78,-3.89,;-3.78,-2.35,;-2.44,-1.58,;-1.11,-2.35,;-1.11,-3.89,;.23,-4.66,;1.56,-3.89,;-2.44,-4.66,;-2.44,-6.2,;-1.2,-7.11,;.27,-6.63,;1.6,-7.4,;.83,-8.74,;2.37,-8.74,;2.94,-6.63,;2.94,-5.09,;4.27,-7.4,;5.6,-6.63,;6.94,-7.4,;8.27,-6.63,;8.27,-5.09,;9.6,-4.32,;6.94,-4.32,;5.6,-5.09,;-1.67,-8.57,;-3.21,-8.57,;-3.69,-7.11,;-5.15,-6.63,;-5.63,-5.17,;-7.17,-5.17,;-7.64,-6.63,;-6.4,-7.54,;-8.07,-3.92,;-7.45,-2.52,;-9.6,-4.08,)|

BDBM507278

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1nc(cs1)C(C)C |r,wU:16.17,(-6.44,-3.89,;-5.11,-4.66,;-3.78,-3.89,;-3.78,-2.35,;-2.44,-1.58,;-1.11,-2.35,;-1.11,-3.89,;.23,-4.66,;1.56,-3.89,;-2.44,-4.66,;-2.44,-6.2,;-1.2,-7.11,;.27,-6.63,;1.6,-7.4,;.83,-8.74,;2.37,-8.74,;2.94,-6.63,;2.94,-5.09,;4.27,-7.4,;5.6,-6.63,;6.94,-7.4,;8.27,-6.63,;8.27,-5.09,;9.6,-4.32,;6.94,-4.32,;5.6,-5.09,;-1.67,-8.57,;-3.21,-8.57,;-3.69,-7.11,;-5.15,-6.63,;-5.63,-5.17,;-7.17,-5.17,;-7.64,-6.63,;-6.4,-7.54,;-8.07,-3.92,;-7.45,-2.52,;-9.6,-4.08,)|

BDBM507279

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1nc(cs1)C(C)C |r,wU:16.17,(-6.44,-4.32,;-5.11,-5.09,;-3.78,-4.32,;-3.78,-2.78,;-2.44,-2.01,;-1.11,-2.78,;-1.11,-4.32,;.23,-5.09,;1.56,-4.32,;-2.44,-5.09,;-2.44,-6.63,;-1.2,-7.53,;.27,-7.06,;1.6,-7.83,;.83,-9.16,;2.37,-9.16,;2.94,-7.06,;2.94,-5.52,;4.27,-7.83,;5.6,-7.06,;6.94,-7.83,;8.27,-7.06,;8.27,-5.52,;9.6,-4.75,;6.94,-4.75,;5.6,-5.52,;-1.67,-9,;-3.21,-9,;-3.69,-7.53,;-5.15,-7.06,;-5.63,-5.59,;-7.17,-5.59,;-7.64,-7.06,;-6.4,-7.96,;-8.07,-4.34,;-7.45,-2.94,;-9.6,-4.51,)|

BDBM507280

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1nc(cs1)C1CC1 |r,wU:16.17,(-6.5,-4.4,;-5.17,-5.17,;-3.84,-4.4,;-3.84,-2.86,;-2.5,-2.09,;-1.17,-2.86,;-1.17,-4.4,;.16,-5.17,;1.5,-4.4,;-2.5,-5.17,;-2.5,-6.71,;-1.26,-7.62,;.21,-7.14,;1.54,-7.91,;.77,-9.24,;2.31,-9.24,;2.87,-7.14,;2.87,-5.6,;4.21,-7.91,;5.54,-7.14,;6.87,-7.91,;8.21,-7.14,;8.21,-5.6,;9.54,-4.83,;6.87,-4.83,;5.54,-5.6,;-1.73,-9.08,;-3.27,-9.08,;-3.75,-7.62,;-5.21,-7.14,;-5.69,-5.67,;-7.23,-5.67,;-7.71,-7.14,;-6.46,-8.04,;-8.14,-4.43,;-8.3,-2.9,;-9.54,-3.8,)|

BDBM507281

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1nc(cs1)C1CC1 |r,wU:16.17,(-6.5,-4.02,;-5.17,-4.79,;-3.84,-4.02,;-3.84,-2.48,;-2.5,-1.71,;-1.17,-2.48,;-1.17,-4.02,;.16,-4.79,;1.5,-4.02,;-2.5,-4.79,;-2.5,-6.33,;-1.26,-7.23,;.21,-6.75,;1.54,-7.52,;.77,-8.86,;2.31,-8.86,;2.87,-6.75,;2.87,-5.21,;4.21,-7.52,;5.54,-6.75,;6.87,-7.52,;8.21,-6.75,;8.21,-5.21,;9.54,-4.44,;6.87,-4.44,;5.54,-5.21,;-1.73,-8.7,;-3.27,-8.7,;-3.75,-7.23,;-5.21,-6.75,;-5.69,-5.29,;-7.23,-5.29,;-7.71,-6.75,;-6.46,-7.66,;-8.14,-4.04,;-8.3,-2.51,;-9.54,-3.42,)|

BDBM507282

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1nc(cs1)C1CC1 |r,wD:16.17,(-6.5,-4.02,;-5.17,-4.79,;-3.84,-4.02,;-3.84,-2.48,;-2.5,-1.71,;-1.17,-2.48,;-1.17,-4.02,;.16,-4.79,;1.5,-4.02,;-2.5,-4.79,;-2.5,-6.33,;-1.26,-7.23,;.21,-6.75,;1.54,-7.52,;.77,-8.86,;2.31,-8.86,;2.87,-6.75,;2.87,-5.21,;4.21,-7.52,;5.54,-6.75,;6.87,-7.52,;8.21,-6.75,;8.21,-5.21,;9.54,-4.44,;6.87,-4.44,;5.54,-5.21,;-1.73,-8.7,;-3.27,-8.7,;-3.75,-7.23,;-5.21,-6.75,;-5.69,-5.29,;-7.23,-5.29,;-7.71,-6.75,;-6.46,-7.66,;-8.14,-4.04,;-8.3,-2.51,;-9.54,-3.42,)|

BDBM507283

CC[C@@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wU:2.2,(3.5,-4.99,;2.17,-5.76,;2.17,-7.3,;3.5,-8.07,;4.84,-7.3,;6.17,-8.07,;7.51,-7.3,;7.51,-5.76,;8.84,-4.99,;6.17,-4.99,;4.84,-5.76,;.84,-8.07,;.07,-9.4,;1.61,-9.4,;-.5,-7.3,;-1.96,-7.77,;-2.44,-9.24,;-3.98,-9.24,;-4.45,-7.77,;-5.92,-7.3,;-6.39,-5.83,;-7.93,-5.83,;-8.84,-4.59,;-8.41,-7.3,;-7.16,-8.2,;-3.21,-6.87,;-3.21,-5.33,;-4.54,-4.56,;-5.87,-5.33,;-7.21,-4.56,;-4.54,-3.02,;-3.21,-2.25,;-1.87,-3.02,;-1.87,-4.56,;-.54,-5.33,;.79,-4.56,)|

BDBM507284

CC[C@@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wU:2.2,(3.5,-4.41,;2.17,-5.18,;2.17,-6.72,;3.5,-7.49,;4.84,-6.72,;6.17,-7.49,;7.51,-6.72,;7.51,-5.18,;8.84,-4.41,;6.17,-4.41,;4.84,-5.18,;.84,-7.49,;.07,-8.82,;1.61,-8.82,;-.5,-6.72,;-1.96,-7.19,;-2.44,-8.66,;-3.98,-8.66,;-4.45,-7.19,;-5.92,-6.72,;-6.39,-5.25,;-7.93,-5.25,;-8.84,-4.01,;-8.41,-6.72,;-7.16,-7.62,;-3.21,-6.29,;-3.21,-4.75,;-4.54,-3.98,;-5.87,-4.75,;-7.21,-3.98,;-4.54,-2.44,;-3.21,-1.67,;-1.87,-2.44,;-1.87,-3.98,;-.54,-4.75,;.79,-3.98,)|

BDBM507285

CC[C@H](Cc1ncc(F)cn1)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC |r,wD:2.2,(3.5,-4.41,;2.17,-5.18,;2.17,-6.72,;3.5,-7.49,;4.84,-6.72,;6.17,-7.49,;7.51,-6.72,;7.51,-5.18,;8.84,-4.41,;6.17,-4.41,;4.84,-5.18,;.84,-7.49,;.07,-8.82,;1.61,-8.82,;-.5,-6.72,;-1.96,-7.19,;-2.44,-8.66,;-3.98,-8.66,;-4.45,-7.19,;-5.92,-6.72,;-6.39,-5.25,;-7.93,-5.25,;-8.84,-4.01,;-8.41,-6.72,;-7.16,-7.62,;-3.21,-6.29,;-3.21,-4.75,;-4.54,-3.98,;-5.87,-4.75,;-7.21,-3.98,;-4.54,-2.44,;-3.21,-1.67,;-1.87,-2.44,;-1.87,-3.98,;-.54,-4.75,;.79,-3.98,)|

BDBM507286

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:18.19,wD:16.17,(-7.21,1.37,;-5.87,.6,;-4.54,1.37,;-4.54,2.91,;-3.21,3.68,;-1.87,2.91,;-1.87,1.37,;-.54,.6,;.79,1.37,;-3.21,.6,;-3.21,-.94,;-1.96,-1.85,;-.5,-1.37,;.84,-2.14,;.07,-3.47,;1.61,-3.47,;2.17,-1.37,;2.17,.17,;3.5,-2.14,;3.5,-3.68,;4.84,-1.37,;6.17,-2.14,;7.51,-1.37,;7.51,.17,;8.84,.94,;6.17,.94,;4.84,.17,;-2.44,-3.31,;-3.98,-3.31,;-4.45,-1.85,;-5.92,-1.37,;-6.39,.1,;-7.93,.1,;-8.84,1.34,;-8.41,-1.37,;-7.16,-2.27,)|

BDBM507287

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,2.1,(4.85,-10.02,;3.52,-9.25,;3.52,-7.71,;2.18,-6.94,;2.18,-5.4,;.85,-7.71,;.08,-9.05,;1.62,-9.05,;-.49,-6.94,;-1.97,-7.34,;-2.45,-8.81,;-3.99,-8.81,;-4.46,-7.34,;-5.93,-6.87,;-6.41,-5.4,;-7.95,-5.4,;-8.85,-4.15,;-8.42,-6.87,;-7.18,-7.77,;-3.22,-6.44,;-3.22,-4.9,;-4.55,-4.13,;-5.89,-4.9,;-7.22,-4.13,;-4.55,-2.59,;-3.22,-1.82,;-1.89,-2.59,;-1.89,-4.13,;-.55,-4.9,;.78,-4.13,;4.85,-6.94,;6.18,-7.71,;7.52,-6.94,;7.52,-5.4,;8.85,-4.63,;6.18,-4.63,;4.85,-5.4,)|

BDBM507288

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:2.1,wD:3.3,(4.85,-10.02,;3.52,-9.25,;3.52,-7.71,;2.18,-6.94,;2.18,-5.4,;.85,-7.71,;.08,-9.05,;1.62,-9.05,;-.49,-6.94,;-1.97,-7.34,;-2.45,-8.81,;-3.99,-8.81,;-4.46,-7.34,;-5.93,-6.87,;-6.41,-5.4,;-7.95,-5.4,;-8.85,-4.15,;-8.42,-6.87,;-7.18,-7.77,;-3.22,-6.44,;-3.22,-4.9,;-4.55,-4.13,;-5.89,-4.9,;-7.22,-4.13,;-4.55,-2.59,;-3.22,-1.82,;-1.89,-2.59,;-1.89,-4.13,;-.55,-4.9,;.78,-4.13,;4.85,-6.94,;6.18,-7.71,;7.52,-6.94,;7.52,-5.4,;8.85,-4.63,;6.18,-4.63,;4.85,-5.4,)|

BDBM507289

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OCC=C)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:18.19,16.17,(1.27,-4.41,;-.06,-5.18,;-1.39,-4.41,;-1.4,-2.87,;-2.73,-2.1,;-4.06,-2.87,;-4.06,-4.41,;-5.39,-5.18,;-6.73,-4.41,;-2.73,-5.18,;-2.73,-6.72,;-1.48,-7.62,;-.01,-7.15,;1.32,-7.92,;2.09,-9.25,;.55,-9.25,;2.65,-7.15,;2.65,-5.61,;3.99,-7.92,;3.99,-9.46,;5.32,-10.23,;5.32,-11.77,;6.65,-12.54,;5.32,-7.15,;6.65,-7.92,;7.99,-7.15,;7.99,-5.61,;9.32,-4.84,;6.65,-4.84,;5.32,-5.61,;-1.95,-9.09,;-3.49,-9.09,;-3.97,-7.63,;-5.44,-7.15,;-5.91,-5.69,;-7.45,-5.69,;-8.36,-4.44,;-7.93,-7.15,;-6.68,-8.06,)|

BDBM507291

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(4.84,-10.79,;4.84,-9.25,;3.5,-8.48,;3.5,-6.94,;2.17,-6.17,;2.17,-4.63,;.84,-6.94,;.07,-8.27,;1.61,-8.27,;-.5,-6.17,;-1.96,-6.65,;-2.44,-8.11,;-3.98,-8.11,;-4.45,-6.65,;-5.92,-6.17,;-6.39,-4.71,;-7.93,-4.71,;-8.84,-3.46,;-8.41,-6.17,;-7.16,-7.08,;-3.21,-5.74,;-3.21,-4.2,;-4.54,-3.43,;-5.87,-4.2,;-7.21,-3.43,;-4.54,-1.89,;-3.21,-1.12,;-1.87,-1.89,;-1.87,-3.43,;-.54,-4.2,;.79,-3.43,;4.84,-6.17,;6.17,-6.94,;7.51,-6.17,;7.51,-4.63,;8.84,-3.86,;6.17,-3.86,;4.84,-4.63,)|

BDBM507293

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(4.84,-10.79,;4.84,-9.25,;3.5,-8.48,;3.5,-6.94,;2.17,-6.17,;2.17,-4.63,;.84,-6.94,;.07,-8.27,;1.61,-8.27,;-.5,-6.17,;-1.96,-6.65,;-2.44,-8.11,;-3.98,-8.11,;-4.45,-6.65,;-5.92,-6.17,;-7.16,-7.08,;-8.41,-6.17,;-7.93,-4.71,;-8.84,-3.46,;-6.39,-4.71,;-3.21,-5.74,;-3.21,-4.2,;-4.54,-3.43,;-5.87,-4.2,;-7.21,-3.43,;-4.54,-1.89,;-3.21,-1.12,;-1.87,-1.89,;-1.87,-3.43,;-.54,-4.2,;.79,-3.43,;4.84,-6.17,;6.17,-6.94,;7.51,-6.17,;7.51,-4.63,;8.84,-3.86,;6.17,-3.86,;4.84,-4.63,)|

BDBM507295

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(n1)C(F)F |r,wD:16.17,(-6.05,-4.72,;-4.72,-5.49,;-3.39,-4.72,;-3.39,-3.18,;-2.05,-2.41,;-.72,-3.18,;-.72,-4.72,;.61,-5.49,;1.95,-4.72,;-2.05,-5.49,;-2.05,-7.03,;-.81,-7.94,;.53,-7.17,;1.86,-7.94,;.53,-8.71,;3.19,-8.71,;3.19,-7.17,;3.19,-5.63,;4.53,-7.94,;5.86,-7.17,;7.19,-7.94,;8.53,-7.17,;8.53,-5.63,;9.86,-4.86,;7.19,-4.86,;5.86,-5.63,;-1.28,-9.4,;-2.82,-9.4,;-3.3,-7.94,;-4.84,-7.94,;-5.74,-9.18,;-7.21,-8.71,;-7.21,-7.17,;-5.74,-6.69,;-8.46,-6.26,;-8.29,-4.73,;-9.86,-6.89,)|

BDBM507296

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ncco1 |r,wD:16.17,(-7.38,-3.9,;-6.05,-4.67,;-4.71,-3.9,;-4.71,-2.36,;-3.38,-1.59,;-2.05,-2.36,;-2.05,-3.9,;-.71,-4.67,;.62,-3.9,;-3.38,-4.67,;-3.38,-6.21,;-2.13,-7.12,;-.8,-6.35,;.53,-7.12,;-.8,-7.89,;1.87,-7.89,;1.87,-6.35,;1.87,-4.81,;3.2,-7.12,;4.53,-6.35,;5.87,-7.12,;7.2,-6.35,;7.2,-4.81,;8.54,-4.04,;5.87,-4.04,;4.53,-4.81,;-2.61,-8.58,;-4.15,-8.58,;-4.63,-7.12,;-6.17,-7.12,;-7.07,-5.87,;-8.54,-6.35,;-8.54,-7.89,;-7.07,-8.37,)|

BDBM507297

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)n[nH]1 |r,wD:16.17,(-6.76,-4.43,;-5.42,-5.2,;-4.09,-4.43,;-4.09,-2.89,;-2.76,-2.12,;-1.42,-2.89,;-1.42,-4.43,;-.09,-5.2,;1.24,-4.43,;-2.76,-5.2,;-2.76,-6.74,;-1.51,-7.65,;-.18,-6.88,;1.16,-7.65,;-.18,-8.42,;2.49,-8.42,;2.49,-6.88,;2.49,-5.34,;3.82,-7.65,;5.16,-6.88,;6.49,-7.65,;7.82,-6.88,;7.82,-5.34,;9.16,-4.57,;6.49,-4.57,;5.16,-5.34,;-1.99,-9.11,;-3.53,-9.11,;-4,-7.65,;-5.54,-7.65,;-6.45,-6.4,;-7.91,-6.88,;-9.16,-5.97,;-7.91,-8.42,;-6.45,-8.89,)|

BDBM507298

COc1cncc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-8.12,-3.7,;-8.89,-5.03,;-8.12,-6.36,;-8.89,-7.7,;-8.12,-9.03,;-6.58,-9.03,;-5.81,-7.7,;-6.58,-6.36,;-4.27,-7.7,;-3.79,-9.16,;-2.25,-9.16,;-1.78,-7.7,;-.45,-6.93,;.89,-7.7,;-.45,-8.47,;2.22,-8.47,;2.22,-6.93,;2.22,-5.39,;3.56,-7.7,;4.89,-6.93,;6.22,-7.7,;7.56,-6.93,;7.56,-5.39,;8.89,-4.62,;6.22,-4.62,;4.89,-5.39,;-3.02,-6.79,;-3.02,-5.25,;-4.36,-4.48,;-5.69,-5.25,;-7.03,-4.48,;-4.36,-2.94,;-3.02,-2.17,;-1.69,-2.94,;-1.69,-4.48,;-.36,-5.25,;.98,-4.48,)|

BDBM507299

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1coc(C)n1 |r,wD:16.17,(-6.76,-4.58,;-5.42,-5.35,;-4.09,-4.58,;-4.09,-3.04,;-2.76,-2.27,;-1.42,-3.04,;-1.42,-4.58,;-.09,-5.35,;1.24,-4.58,;-2.76,-5.35,;-2.76,-6.89,;-1.51,-7.79,;-.18,-7.02,;1.16,-7.79,;-.18,-8.56,;2.49,-8.56,;2.49,-7.02,;2.49,-5.48,;3.82,-7.79,;5.16,-7.02,;6.49,-7.79,;7.82,-7.02,;7.82,-5.48,;9.16,-4.71,;6.49,-4.71,;5.16,-5.48,;-1.99,-9.26,;-3.53,-9.26,;-4,-7.79,;-5.54,-7.79,;-6.45,-9.04,;-7.91,-8.56,;-7.91,-7.02,;-9.16,-6.12,;-6.45,-6.55,)|

BDBM507300

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(n1)C(F)F |r,wD:16.17,(-6.05,-4.6,;-4.72,-5.37,;-3.39,-4.6,;-3.39,-3.06,;-2.05,-2.29,;-.72,-3.06,;-.72,-4.6,;.61,-5.37,;1.95,-4.6,;-2.05,-5.37,;-2.05,-6.91,;-.81,-7.82,;.53,-7.05,;1.86,-7.82,;.53,-8.59,;3.19,-8.59,;3.19,-7.05,;3.19,-5.51,;4.53,-7.82,;5.86,-7.05,;7.19,-7.82,;8.53,-7.05,;8.53,-5.51,;9.86,-4.74,;7.19,-4.74,;5.86,-5.51,;-1.28,-9.28,;-2.82,-9.28,;-3.3,-7.82,;-4.84,-7.82,;-5.74,-9.06,;-7.21,-8.59,;-7.21,-7.05,;-5.74,-6.57,;-8.46,-6.14,;-9.86,-6.77,;-8.29,-4.61,)|

BDBM507301

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ccn(n1)C(F)F |r,wD:16.17,(-6.05,-4.67,;-4.72,-5.44,;-3.39,-4.67,;-3.39,-3.13,;-2.05,-2.36,;-.72,-3.13,;-.72,-4.67,;.61,-5.44,;1.95,-4.67,;-2.05,-5.44,;-2.05,-6.98,;-.81,-7.89,;.53,-7.12,;1.86,-7.89,;.53,-8.66,;3.19,-8.66,;3.19,-7.12,;3.19,-5.58,;4.53,-7.89,;5.86,-7.12,;7.19,-7.89,;8.53,-7.12,;8.53,-5.58,;9.86,-4.81,;7.19,-4.81,;5.86,-5.58,;-1.28,-9.35,;-2.82,-9.35,;-3.3,-7.89,;-4.84,-7.89,;-5.74,-9.14,;-7.21,-8.66,;-7.21,-7.12,;-5.74,-6.64,;-8.46,-6.21,;-9.86,-6.84,;-8.29,-4.68,)|

BDBM507302

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cnn(C)n1 |r,wD:16.17,(-6.76,-4,;-5.42,-4.77,;-4.09,-4,;-4.09,-2.46,;-2.76,-1.69,;-1.42,-2.46,;-1.42,-4,;-.09,-4.77,;1.24,-4,;-2.76,-4.77,;-2.76,-6.31,;-1.51,-7.22,;-.18,-6.45,;1.16,-7.22,;-.18,-7.99,;2.49,-7.99,;2.49,-6.45,;2.49,-4.91,;3.82,-7.22,;5.16,-6.45,;6.49,-7.22,;7.82,-6.45,;7.82,-4.91,;9.16,-4.14,;6.49,-4.14,;5.16,-4.91,;-1.99,-8.68,;-3.53,-8.68,;-4,-7.22,;-5.54,-7.22,;-6.45,-8.46,;-7.91,-7.99,;-7.91,-6.45,;-9.16,-5.54,;-6.45,-5.97,)|

BDBM507303

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cnccn1 |r,wD:16.17,(-7.03,-4.33,;-5.69,-5.1,;-4.36,-4.33,;-4.36,-2.79,;-3.02,-2.02,;-1.69,-2.79,;-1.69,-4.33,;-.36,-5.1,;.98,-4.33,;-3.02,-5.1,;-3.02,-6.64,;-1.78,-7.54,;-.45,-6.77,;.89,-7.54,;-.45,-8.31,;2.22,-8.31,;2.22,-6.77,;2.22,-5.23,;3.56,-7.54,;4.89,-6.77,;6.22,-7.54,;7.56,-6.77,;7.56,-5.23,;8.89,-4.46,;6.22,-4.46,;4.89,-5.23,;-2.25,-9.01,;-3.79,-9.01,;-4.27,-7.54,;-5.81,-7.54,;-6.58,-8.87,;-8.12,-8.87,;-8.89,-7.54,;-8.12,-6.21,;-6.58,-6.21,)|

BDBM507304

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ncco1 |r,wD:16.17,(-7.38,-4.37,;-6.05,-5.14,;-4.71,-4.37,;-4.71,-2.83,;-3.38,-2.06,;-2.05,-2.83,;-2.05,-4.37,;-.71,-5.14,;.62,-4.37,;-3.38,-5.14,;-3.38,-6.68,;-2.13,-7.59,;-.8,-6.82,;.53,-7.59,;-.8,-8.36,;1.87,-8.36,;1.87,-6.82,;1.87,-5.28,;3.2,-7.59,;4.53,-6.82,;5.87,-7.59,;7.2,-6.82,;7.2,-5.28,;8.54,-4.51,;5.87,-4.51,;4.53,-5.28,;-2.61,-9.05,;-4.15,-9.05,;-4.63,-7.59,;-6.17,-7.59,;-7.07,-6.34,;-8.54,-6.82,;-8.54,-8.36,;-7.07,-8.83,)|

BDBM507305

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1ncco1 |r,wD:16.17,(-7.38,-4.45,;-6.05,-5.22,;-4.71,-4.45,;-4.71,-2.91,;-3.38,-2.14,;-2.05,-2.91,;-2.05,-4.45,;-.71,-5.22,;.62,-4.45,;-3.38,-5.22,;-3.38,-6.76,;-2.13,-7.66,;-.8,-6.89,;.53,-7.66,;-.8,-8.43,;1.87,-8.43,;1.87,-6.89,;1.87,-5.35,;3.2,-7.66,;4.53,-6.89,;5.87,-7.66,;7.2,-6.89,;7.2,-5.35,;8.54,-4.58,;5.87,-4.58,;4.53,-5.35,;-2.61,-9.13,;-4.15,-9.13,;-4.63,-7.66,;-6.17,-7.66,;-7.07,-6.41,;-8.54,-6.89,;-8.54,-8.43,;-7.07,-8.91,)|

BDBM507306

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cc(C)n[nH]1 |r,wD:16.17,(-6.76,-4.64,;-5.42,-5.41,;-4.09,-4.64,;-4.09,-3.1,;-2.76,-2.33,;-1.42,-3.1,;-1.42,-4.64,;-.09,-5.41,;1.24,-4.64,;-2.76,-5.41,;-2.76,-6.95,;-1.51,-7.85,;-.18,-7.08,;1.16,-7.85,;-.18,-8.62,;2.49,-8.62,;2.49,-7.08,;2.49,-5.54,;3.82,-7.85,;5.16,-7.08,;6.49,-7.85,;7.82,-7.08,;7.82,-5.54,;9.16,-4.77,;6.49,-4.77,;5.16,-5.54,;-1.99,-9.32,;-3.53,-9.32,;-4,-7.85,;-5.54,-7.85,;-6.45,-6.61,;-7.91,-7.08,;-9.16,-6.18,;-7.91,-8.62,;-6.45,-9.1,)|

BDBM507308

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cocn1 |r,wD:16.17,(-7.38,-4.64,;-6.05,-5.41,;-4.71,-4.64,;-4.71,-3.1,;-3.38,-2.33,;-2.05,-3.1,;-2.05,-4.64,;-.71,-5.41,;.62,-4.64,;-3.38,-5.41,;-3.38,-6.95,;-2.13,-7.85,;-.8,-7.08,;.53,-7.85,;-.8,-8.62,;1.87,-8.62,;1.87,-7.08,;1.87,-5.54,;3.2,-7.85,;4.53,-7.08,;5.87,-7.85,;7.2,-7.08,;7.2,-5.54,;8.54,-4.77,;5.87,-4.77,;4.53,-5.54,;-2.61,-9.32,;-4.15,-9.32,;-4.63,-7.85,;-6.17,-7.85,;-7.07,-9.1,;-8.54,-8.62,;-8.54,-7.08,;-7.07,-6.61,)|

BDBM507309

COc1cncc(n1)-c1nnc(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wD:16.17,(-8.12,-3.85,;-8.89,-5.19,;-8.12,-6.52,;-8.89,-7.85,;-8.12,-9.19,;-6.58,-9.19,;-5.81,-7.85,;-6.58,-6.52,;-4.27,-7.85,;-3.79,-9.32,;-2.25,-9.32,;-1.78,-7.85,;-.45,-7.08,;.89,-7.85,;-.45,-8.62,;2.22,-8.62,;2.22,-7.08,;2.22,-5.54,;3.56,-7.85,;4.89,-7.08,;6.22,-7.85,;7.56,-7.08,;7.56,-5.54,;8.89,-4.77,;6.22,-4.77,;4.89,-5.54,;-3.02,-6.95,;-3.02,-5.41,;-4.36,-4.64,;-5.69,-5.41,;-7.03,-4.64,;-4.36,-3.1,;-3.02,-2.33,;-1.69,-3.1,;-1.69,-4.64,;-.36,-5.41,;.98,-4.64,)|

BDBM507310

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1coc(C)n1 |r,wD:16.17,(-6.76,-4.64,;-5.42,-5.41,;-4.09,-4.64,;-4.09,-3.1,;-2.76,-2.33,;-1.42,-3.1,;-1.42,-4.64,;-.09,-5.41,;1.24,-4.64,;-2.76,-5.41,;-2.76,-6.95,;-1.51,-7.85,;-.18,-7.08,;1.16,-7.85,;-.18,-8.62,;2.49,-8.62,;2.49,-7.08,;2.49,-5.54,;3.82,-7.85,;5.16,-7.08,;6.49,-7.85,;7.82,-7.08,;7.82,-5.54,;9.16,-4.77,;6.49,-4.77,;5.16,-5.54,;-1.99,-9.32,;-3.53,-9.32,;-4,-7.85,;-5.54,-7.85,;-6.45,-9.1,;-7.91,-8.62,;-7.91,-7.08,;-9.16,-6.18,;-6.45,-6.61,)|

BDBM507312

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-10.04,-2.79,;-8.55,-3.19,;-7.46,-2.1,;-7.46,-.56,;-6,-.08,;-5.09,-1.33,;-6,-2.57,;-3.55,-1.33,;-3.08,-2.79,;-1.54,-2.79,;-1.06,-1.33,;.43,-.93,;1.51,-2.02,;1.91,-3.51,;.43,-3.11,;3,-1.62,;3.4,-.13,;4.09,-2.71,;3.69,-4.2,;5.58,-2.31,;6.67,-3.4,;8.15,-3,;8.55,-1.51,;10.04,-1.11,;7.46,-.42,;5.98,-.82,;-2.31,-.42,;-2.31,1.12,;-3.64,1.89,;-4.98,1.12,;-6.31,1.89,;-3.64,3.43,;-2.31,4.2,;-.97,3.43,;-.97,1.89,;.36,1.12,;1.69,1.89,)|

BDBM507313

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1cnn(C)n1 |r,wD:16.17,(-6.76,-4.64,;-5.42,-5.41,;-4.09,-4.64,;-4.09,-3.1,;-2.76,-2.33,;-1.42,-3.1,;-1.42,-4.64,;-.09,-5.41,;1.24,-4.64,;-2.76,-5.41,;-2.76,-6.95,;-1.51,-7.85,;-.18,-7.08,;1.16,-7.85,;-.18,-8.62,;2.49,-8.62,;2.49,-7.08,;2.49,-5.54,;3.82,-7.85,;5.16,-7.08,;6.49,-7.85,;7.82,-7.08,;7.82,-5.54,;9.16,-4.77,;6.49,-4.77,;5.16,-5.54,;-1.99,-9.32,;-3.53,-9.32,;-4,-7.85,;-5.54,-7.85,;-6.45,-9.1,;-7.91,-8.62,;-7.91,-7.08,;-9.16,-6.18,;-6.45,-6.61,)|

BDBM507315

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccn(n1)C(F)F |r,wU:18.19,16.17,(-6.31,2.13,;-4.98,1.36,;-3.64,2.13,;-3.64,3.67,;-2.31,4.44,;-.97,3.67,;-.97,2.13,;.36,1.36,;1.69,2.13,;-2.31,1.36,;-2.31,-.18,;-1.06,-1.09,;.43,-.69,;1.51,-1.78,;1.91,-3.27,;.43,-2.87,;3,-1.38,;3.4,.11,;4.09,-2.47,;3.69,-3.96,;5.58,-2.07,;6.67,-3.16,;8.15,-2.76,;8.55,-1.27,;10.04,-.88,;7.46,-.19,;5.98,-.58,;-1.54,-2.55,;-3.08,-2.55,;-3.55,-1.09,;-5.09,-1.09,;-6,.16,;-7.46,-.32,;-7.46,-1.86,;-6,-2.34,;-8.55,-2.95,;-10.04,-2.55,;-8.15,-4.44,)|

BDBM507318

COc1nccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,;.98,2.45,)|

BDBM507319

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccn(n1)C(F)F |r,wU:16.17,18.19,(-6.09,2.13,;-4.76,1.36,;-3.43,2.13,;-3.43,3.67,;-2.09,4.44,;-.76,3.67,;-.76,2.13,;.58,1.36,;1.91,2.13,;-2.09,1.36,;-2.09,-.18,;-.85,-1.09,;.49,-.32,;1.82,-1.09,;1.05,-2.42,;2.59,-2.42,;3.16,-.32,;3.16,1.22,;4.49,-1.09,;4.49,-2.63,;5.82,-.32,;7.16,-1.09,;8.49,-.32,;8.49,1.22,;9.82,1.99,;7.16,1.99,;5.82,1.22,;-1.32,-2.55,;-2.86,-2.55,;-3.34,-1.09,;-4.88,-1.09,;-5.78,.16,;-7.25,-.32,;-7.25,-1.86,;-5.78,-2.34,;-8.34,-2.95,;-9.82,-2.55,;-7.94,-4.44,)|

BDBM507320

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(n2)C(F)F)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(5.82,-4.69,;5.82,-3.15,;4.49,-2.38,;4.49,-.84,;3.16,-.07,;3.16,1.47,;1.82,-.84,;1.05,-2.17,;2.59,-2.17,;.49,-.07,;-.85,-.84,;-1.32,-2.3,;-2.86,-2.3,;-3.34,-.84,;-4.88,-.84,;-5.78,.41,;-7.25,-.07,;-7.25,-1.61,;-5.78,-2.08,;-8.34,-2.7,;-9.82,-2.3,;-7.94,-4.18,;-2.09,.07,;-2.09,1.61,;-3.43,2.38,;-4.76,1.61,;-6.09,2.38,;-3.43,3.92,;-2.09,4.69,;-.76,3.92,;-.76,2.38,;.58,1.61,;1.91,2.38,;5.82,-.07,;7.16,-.84,;8.49,-.07,;8.49,1.47,;9.82,2.24,;7.16,2.24,;5.82,1.47,)|

BDBM507321

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.2,-3.92,;3.87,-3.15,;3.87,-1.61,;2.53,-.84,;2.53,.7,;1.2,-1.61,;.43,-2.94,;1.97,-2.94,;-.13,-.84,;-1.47,-1.61,;-1.94,-3.07,;-3.48,-3.07,;-3.96,-1.61,;-5.5,-1.61,;-6.4,-.36,;-7.87,-.84,;-7.87,-2.38,;-9.2,-3.15,;-6.4,-2.85,;-2.71,-.7,;-2.71,.84,;-4.05,1.61,;-5.38,.84,;-6.71,1.61,;-4.05,3.15,;-2.71,3.92,;-1.38,3.15,;-1.38,1.61,;-.05,.84,;1.29,1.61,;5.2,-.84,;6.54,-1.61,;7.87,-.84,;7.87,.7,;9.2,1.47,;6.54,1.47,;5.2,.7,)|

BDBM507322

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(-6.71,1.22,;-5.38,.45,;-4.05,1.22,;-4.05,2.76,;-2.71,3.53,;-1.38,2.76,;-1.38,1.22,;-.05,.45,;1.29,1.22,;-2.71,.45,;-2.71,-1.09,;-1.47,-1.99,;-.13,-1.22,;1.2,-1.99,;.43,-3.33,;1.97,-3.33,;2.53,-1.22,;2.53,.32,;3.87,-1.99,;3.87,-3.53,;5.2,-1.22,;6.54,-1.99,;7.87,-1.22,;7.87,.32,;9.2,1.09,;6.54,1.09,;5.2,.32,;-1.94,-3.46,;-3.48,-3.46,;-3.96,-1.99,;-5.5,-1.99,;-6.4,-.75,;-7.87,-1.22,;-7.87,-2.76,;-9.2,-3.53,;-6.4,-3.24,)|

BDBM507323

COc1cncc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;3.56,-2.3,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,;.98,2.45,)|

BDBM507324

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(n2)C(F)F)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.82,-3.4,;4.49,-2.63,;4.49,-1.09,;3.16,-.32,;3.16,1.22,;1.82,-1.09,;1.05,-2.42,;2.59,-2.42,;.49,-.32,;-.85,-1.09,;-1.32,-2.55,;-2.86,-2.55,;-3.34,-1.09,;-4.88,-1.09,;-5.78,.16,;-7.25,-.32,;-7.25,-1.86,;-5.78,-2.34,;-8.34,-2.95,;-9.82,-2.55,;-7.94,-4.44,;-2.09,-.18,;-2.09,1.36,;-3.43,2.13,;-4.76,1.36,;-6.09,2.13,;-3.43,3.67,;-2.09,4.44,;-.76,3.67,;-.76,2.13,;.58,1.36,;1.91,2.13,;5.82,-.32,;7.16,-1.09,;8.49,-.32,;8.49,1.22,;9.82,1.99,;7.16,1.99,;5.82,1.22,)|

BDBM507325

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ncn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.2,-3.92,;3.87,-3.15,;3.87,-1.61,;2.53,-.84,;2.53,.7,;1.2,-1.61,;.43,-2.94,;1.97,-2.94,;-.13,-.84,;-1.47,-1.61,;-1.94,-3.07,;-3.48,-3.07,;-3.96,-1.61,;-5.5,-1.61,;-6.4,-2.85,;-7.87,-2.38,;-7.87,-.84,;-9.2,-.07,;-6.4,-.36,;-2.71,-.7,;-2.71,.84,;-4.05,1.61,;-5.38,.84,;-6.71,1.61,;-4.05,3.15,;-2.71,3.92,;-1.38,3.15,;-1.38,1.61,;-.05,.84,;1.29,1.61,;5.2,-.84,;6.54,-1.61,;7.87,-.84,;7.87,.7,;9.2,1.47,;6.54,1.47,;5.2,.7,)|

BDBM507326

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc3CCCn3n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.72,-3.92,;4.39,-3.15,;4.39,-1.61,;3.05,-.84,;3.05,.7,;1.72,-1.61,;.95,-2.94,;2.49,-2.94,;.38,-.84,;-.95,-1.61,;-1.42,-3.07,;-2.96,-3.07,;-3.44,-1.61,;-4.98,-1.61,;-5.89,-.36,;-7.35,-.84,;-8.82,-.36,;-9.72,-1.61,;-8.82,-2.85,;-7.35,-2.38,;-5.89,-2.85,;-2.19,-.7,;-2.19,.84,;-3.53,1.61,;-4.86,.84,;-6.2,1.61,;-3.53,3.15,;-2.19,3.92,;-.86,3.15,;-.86,1.61,;.47,.84,;1.81,1.61,;5.72,-.84,;7.05,-1.61,;8.39,-.84,;8.39,.7,;9.72,1.47,;7.05,1.47,;5.72,.7,)|

BDBM507327

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnc3[nH]ccc3n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.72,-3.83,;4.39,-3.06,;4.39,-1.52,;3.06,-.75,;3.06,.79,;1.72,-1.52,;.95,-2.86,;2.49,-2.86,;.39,-.75,;-.95,-1.52,;-1.42,-2.99,;-2.96,-2.99,;-3.44,-1.52,;-4.98,-1.52,;-5.75,-.19,;-7.29,-.19,;-8.06,-1.52,;-9.56,-1.84,;-9.72,-3.38,;-8.32,-4,;-7.29,-2.86,;-5.75,-2.86,;-2.19,-.62,;-2.19,.92,;-3.52,1.69,;-4.86,.92,;-6.19,1.69,;-3.52,3.23,;-2.19,4,;-.86,3.23,;-.86,1.69,;.48,.92,;1.81,1.69,;5.72,-.75,;7.06,-1.52,;8.39,-.75,;8.39,.79,;9.72,1.56,;7.06,1.56,;5.72,.79,)|

BDBM507328

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(n2)C(F)F)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.82,-3.4,;4.49,-2.63,;4.49,-1.09,;3.16,-.32,;3.16,1.22,;1.82,-1.09,;1.05,-2.42,;2.59,-2.42,;.49,-.32,;-.85,-1.09,;-1.32,-2.55,;-2.86,-2.55,;-3.34,-1.09,;-4.88,-1.09,;-5.78,.16,;-7.25,-.32,;-7.25,-1.86,;-5.78,-2.34,;-8.34,-2.95,;-9.82,-2.55,;-7.94,-4.44,;-2.09,-.18,;-2.09,1.36,;-3.43,2.13,;-4.76,1.36,;-6.09,2.13,;-3.43,3.67,;-2.09,4.44,;-.76,3.67,;-.76,2.13,;.58,1.36,;1.91,2.13,;5.82,-.32,;7.16,-1.09,;8.49,-.32,;8.49,1.22,;9.82,1.99,;7.16,1.99,;5.82,1.22,)|

BDBM507329

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cc2CCCn2n1 |r,wU:16.17,18.19,(-6.2,1.22,;-4.86,.45,;-3.53,1.22,;-3.53,2.76,;-2.19,3.53,;-.86,2.76,;-.86,1.22,;.47,.45,;1.81,1.22,;-2.19,.45,;-2.19,-1.09,;-.95,-1.99,;.38,-1.22,;1.72,-1.99,;.95,-3.33,;2.49,-3.33,;3.05,-1.22,;3.05,.32,;4.39,-1.99,;4.39,-3.53,;5.72,-1.22,;7.05,-1.99,;8.39,-1.22,;8.39,.32,;9.72,1.09,;7.05,1.09,;5.72,.32,;-1.42,-3.46,;-2.96,-3.46,;-3.44,-1.99,;-4.98,-1.99,;-5.89,-.75,;-7.35,-1.22,;-8.82,-.75,;-9.72,-1.99,;-8.82,-3.24,;-7.35,-2.76,;-5.89,-3.24,)|

BDBM507330

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)n1 |r,wU:16.17,18.19,(-7.03,1.79,;-5.69,1.02,;-4.36,1.79,;-4.36,3.33,;-3.02,4.1,;-1.69,3.33,;-1.69,1.79,;-.36,1.02,;.98,1.79,;-3.02,1.02,;-3.02,-.52,;-1.78,-1.43,;-.45,-.66,;.89,-1.43,;-.45,-2.2,;2.22,-2.2,;2.22,-.66,;2.22,.88,;3.56,-1.43,;3.56,-2.97,;4.89,-.66,;6.22,-1.43,;7.56,-.66,;7.56,.88,;8.89,1.65,;6.22,1.65,;4.89,.88,;-2.25,-2.89,;-3.79,-2.89,;-4.27,-1.43,;-5.81,-1.43,;-6.58,-.1,;-8.12,-.1,;-8.89,-1.43,;-8.12,-2.76,;-8.89,-4.1,;-6.58,-2.76,)|

BDBM507331

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc3CCCn3n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.72,-3.92,;4.39,-3.15,;4.39,-1.61,;3.05,-.84,;3.05,.7,;1.72,-1.61,;.38,-2.38,;3.05,-2.38,;.38,-.84,;-.95,-1.61,;-1.42,-3.07,;-2.96,-3.07,;-3.44,-1.61,;-4.98,-1.61,;-5.89,-.36,;-7.35,-.84,;-8.82,-.36,;-9.72,-1.61,;-8.82,-2.85,;-7.35,-2.38,;-5.89,-2.85,;-2.19,-.7,;-2.19,.84,;-3.53,1.61,;-4.86,.84,;-6.2,1.61,;-3.53,3.15,;-2.19,3.92,;-.86,3.15,;-.86,1.61,;.47,.84,;1.81,1.61,;5.72,-.84,;7.05,-1.61,;8.39,-.84,;8.39,.7,;9.72,1.47,;7.05,1.47,;5.72,.7,)|

BDBM507332

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccnn1C |r,wU:16.17,18.19,(-7.38,1.81,;-6.05,1.04,;-4.71,1.81,;-4.71,3.35,;-3.38,4.12,;-2.05,3.35,;-2.05,1.81,;-.71,1.04,;.62,1.81,;-3.38,1.04,;-3.38,-.5,;-2.13,-1.41,;-.8,-.64,;.53,-1.41,;-.8,-2.18,;1.87,-2.18,;1.87,-.64,;1.87,.9,;3.2,-1.41,;3.2,-2.95,;4.53,-.64,;5.87,-1.41,;7.2,-.64,;7.2,.9,;8.54,1.67,;5.87,1.67,;4.53,.9,;-2.61,-2.87,;-4.15,-2.87,;-4.63,-1.41,;-6.17,-1.41,;-7.07,-.16,;-8.54,-.64,;-8.54,-2.18,;-7.07,-2.65,;-6.59,-4.12,)|

BDBM507333

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cnn(C)c1 |r,wU:16.17,18.19,(-6.76,1.29,;-5.42,.52,;-4.09,1.29,;-4.09,2.83,;-2.76,3.6,;-1.42,2.83,;-1.42,1.29,;-.09,.52,;1.24,1.29,;-2.76,.52,;-2.76,-1.02,;-1.51,-1.92,;-.18,-1.15,;1.16,-1.92,;-.18,-2.69,;2.49,-2.69,;2.49,-1.15,;2.49,.39,;3.82,-1.92,;3.82,-3.46,;5.16,-1.15,;6.49,-1.92,;7.82,-1.15,;7.82,.39,;9.16,1.16,;6.49,1.16,;5.16,.39,;-1.99,-3.39,;-3.53,-3.39,;-4,-1.92,;-5.54,-1.92,;-6.45,-.68,;-7.91,-1.15,;-7.91,-2.69,;-9.16,-3.6,;-6.45,-3.17,)|

BDBM507334

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(2.67,2.81,;1.34,3.58,;1.34,5.12,;.01,5.89,;.01,7.43,;-1.33,5.12,;.01,4.35,;-2.66,4.35,;-2.66,5.89,;-4.15,5.49,;-4.62,4.03,;-6.16,4.03,;-6.64,5.49,;-8.18,5.49,;-8.66,6.96,;-10.2,6.96,;-10.67,5.49,;-12.16,5.09,;-9.43,4.59,;-5.39,6.4,;-5.39,7.94,;-6.73,8.71,;-8.06,7.94,;-9.4,8.71,;-6.73,10.25,;-5.39,11.02,;-4.06,10.25,;-4.06,8.71,;-2.73,7.94,;-1.39,8.71,;2.67,5.89,;4.01,5.12,;5.34,5.89,;5.34,7.43,;6.67,8.2,;4.01,8.2,;2.67,7.43,)|

BDBM507335

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.25,-4.06,;3.91,-3.29,;3.91,-1.75,;2.58,-.98,;2.58,.56,;1.25,-1.75,;-.09,-2.52,;2.58,-2.52,;-.09,-.98,;-1.55,-1.46,;-2.03,-2.93,;-3.57,-2.93,;-4.04,-1.46,;-5.58,-1.46,;-5.98,.03,;-7.47,.43,;-8.56,-.66,;-8.16,-2.15,;-9.25,-3.24,;-6.67,-2.55,;-2.8,-.56,;-2.8,.98,;-4.13,1.75,;-5.46,.98,;-6.8,1.75,;-4.13,3.29,;-2.8,4.06,;-1.46,3.29,;-1.46,1.75,;-.13,.98,;1.2,1.75,;5.25,-.98,;6.58,-1.75,;7.92,-.98,;7.92,.56,;9.25,1.33,;6.58,1.33,;5.25,.56,)|

BDBM507336

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cnn(C)c1 |r,wU:16.17,18.19,(-6.98,1.56,;-5.64,.79,;-4.31,1.56,;-4.31,3.1,;-2.98,3.87,;-1.64,3.1,;-1.64,1.56,;-.31,.79,;1.03,1.56,;-2.98,.79,;-2.98,-.75,;-1.73,-1.65,;-.27,-1.18,;1.07,-1.95,;-.27,-2.72,;2.4,-2.72,;2.4,-1.18,;2.4,.36,;3.74,-1.95,;3.74,-3.49,;5.07,-1.18,;6.4,-1.95,;7.74,-1.18,;7.74,.36,;9.07,1.13,;6.4,1.13,;5.07,.36,;-2.21,-3.12,;-3.75,-3.12,;-4.22,-1.65,;-5.76,-1.65,;-6.85,-.56,;-8.22,-1.26,;-7.98,-2.78,;-9.07,-3.87,;-6.46,-3.02,)|

BDBM507337

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc3CCCn3n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(5.78,-4.06,;4.45,-3.29,;4.45,-1.75,;3.12,-.98,;3.12,.56,;1.78,-1.75,;.45,-2.52,;3.12,-2.52,;.45,-.98,;-1.01,-1.46,;-1.49,-2.93,;-3.03,-2.93,;-3.51,-1.46,;-5.05,-1.46,;-5.95,-.21,;-7.42,-.69,;-8.88,-.21,;-9.79,-1.46,;-8.88,-2.71,;-7.42,-2.23,;-5.95,-2.71,;-2.26,-.56,;-2.26,.98,;-3.59,1.75,;-4.93,.98,;-6.26,1.75,;-3.59,3.29,;-2.26,4.06,;-.93,3.29,;-.93,1.75,;.41,.98,;1.74,1.75,;5.78,-.98,;5.78,.56,;7.12,1.33,;8.45,.56,;9.79,1.33,;8.45,-.98,;7.12,-1.75,)|

BDBM507338

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc3CCCn3n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(5.78,-4.83,;5.78,-3.29,;4.45,-2.52,;4.45,-.98,;3.12,-.21,;3.12,1.33,;1.78,-.98,;.45,-1.75,;3.12,-1.75,;.45,-.21,;-1.01,-.69,;-1.49,-2.16,;-3.03,-2.16,;-3.51,-.69,;-5.05,-.69,;-5.95,.56,;-7.42,.08,;-8.88,.56,;-9.79,-.69,;-8.88,-1.94,;-7.42,-1.46,;-5.95,-1.94,;-2.26,.21,;-2.26,1.75,;-3.59,2.52,;-4.93,1.75,;-6.26,2.52,;-3.59,4.06,;-2.26,4.83,;-.93,4.06,;-.93,2.52,;.41,1.75,;1.74,2.52,;5.78,-.21,;7.12,-.98,;8.45,-.21,;8.45,1.33,;9.79,2.1,;7.12,2.1,;5.78,1.33,)|

BDBM507339

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1ccn(n1)C(F)F |r,wU:16.17,18.19,(-6.16,1.78,;-4.82,1.01,;-3.49,1.78,;-3.49,3.32,;-2.16,4.09,;-.82,3.32,;-.82,1.78,;.51,1.01,;1.84,1.78,;-2.16,1.01,;-2.16,-.53,;-.91,-1.43,;.55,-.96,;1.89,-1.73,;.55,-2.5,;3.22,-2.5,;3.22,-.96,;3.22,.58,;4.55,-1.73,;4.55,-3.27,;5.89,-.96,;7.22,-1.73,;8.56,-.96,;8.56,.58,;9.89,1.35,;7.22,1.35,;5.89,.58,;-1.39,-2.9,;-2.93,-2.9,;-3.4,-1.43,;-4.94,-1.43,;-5.85,-.19,;-7.31,-.66,;-7.31,-2.2,;-5.85,-2.68,;-8.8,-2.6,;-9.89,-1.51,;-9.2,-4.09,)|

BDBM507340

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cc2CCCn2n1 |r,wU:16.17,18.19,(-6.26,1.37,;-4.93,.6,;-3.59,1.37,;-3.59,2.91,;-2.26,3.68,;-.93,2.91,;-.93,1.37,;.41,.6,;1.74,1.37,;-2.26,.6,;-2.26,-.94,;-1.01,-1.85,;.45,-1.37,;1.78,-2.14,;.45,-2.91,;3.12,-2.91,;3.12,-1.37,;3.12,.17,;4.45,-2.14,;4.45,-3.68,;5.78,-1.37,;7.12,-2.14,;8.45,-1.37,;8.45,.17,;9.79,.94,;7.12,.94,;5.78,.17,;-1.49,-3.31,;-3.03,-3.31,;-3.51,-1.85,;-5.05,-1.85,;-5.95,-.6,;-7.42,-1.08,;-8.88,-.6,;-9.79,-1.85,;-8.88,-3.09,;-7.42,-2.62,;-5.95,-3.09,)|

BDBM507341

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1cc2CCCn2n1 |r,wU:16.17,18.19,(-6.26,1.37,;-4.93,.6,;-3.59,1.37,;-3.59,2.91,;-2.26,3.68,;-.93,2.91,;-.93,1.37,;.41,.6,;1.74,1.37,;-2.26,.6,;-2.26,-.94,;-1.01,-1.85,;.45,-1.37,;1.78,-2.14,;.45,-2.91,;3.12,-2.91,;3.12,-1.37,;3.12,.17,;4.45,-2.14,;4.45,-3.68,;5.78,-1.37,;7.12,-2.14,;8.45,-1.37,;8.45,.17,;9.79,.94,;7.12,.94,;5.78,.17,;-1.49,-3.31,;-3.03,-3.31,;-3.51,-1.85,;-5.05,-1.85,;-5.95,-.6,;-7.42,-1.08,;-8.88,-.6,;-9.79,-1.85,;-8.88,-3.09,;-7.42,-2.62,;-5.95,-3.09,)|

BDBM507342

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cc2CCCn2n1 |r,wU:16.17,18.19,(-6.26,1.37,;-4.93,.6,;-3.59,1.37,;-3.59,2.91,;-2.26,3.68,;-.93,2.91,;-.93,1.37,;.41,.6,;1.74,1.37,;-2.26,.6,;-2.26,-.94,;-1.01,-1.85,;.45,-1.37,;1.78,-2.14,;.45,-2.91,;3.12,-2.91,;3.12,-1.37,;3.12,.17,;4.45,-2.14,;4.45,-3.68,;5.78,-1.37,;7.12,-2.14,;8.45,-1.37,;8.45,.17,;9.79,.94,;7.12,.94,;5.78,.17,;-1.49,-3.31,;-3.03,-3.31,;-3.51,-1.85,;-5.05,-1.85,;-5.95,-.6,;-7.42,-1.08,;-8.88,-.6,;-9.79,-1.85,;-8.88,-3.09,;-7.42,-2.62,;-5.95,-3.09,)|

BDBM507343

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(n1)C(F)F |r,wU:16.17,18.19,(-6.16,1.78,;-4.82,1.01,;-3.49,1.78,;-3.49,3.32,;-2.16,4.09,;-.82,3.32,;-.82,1.78,;.51,1.01,;1.84,1.78,;-2.16,1.01,;-2.16,-.53,;-.91,-1.43,;.55,-.96,;1.89,-1.73,;.55,-2.5,;3.22,-2.5,;3.22,-.96,;3.22,.58,;4.55,-1.73,;4.55,-3.27,;5.89,-.96,;7.22,-1.73,;8.56,-.96,;8.56,.58,;9.89,1.35,;7.22,1.35,;5.89,.58,;-1.39,-2.9,;-2.93,-2.9,;-3.4,-1.43,;-4.94,-1.43,;-5.85,-.19,;-7.31,-.66,;-7.31,-2.2,;-5.85,-2.68,;-8.8,-2.6,;-9.89,-1.51,;-9.2,-4.09,)|

BDBM507344

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(n2)C(F)F)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(5.93,-3.76,;4.59,-2.99,;4.59,-1.45,;3.26,-.68,;3.26,.86,;1.93,-1.45,;.59,-2.22,;3.26,-2.22,;.59,-.68,;-.87,-1.16,;-1.35,-2.62,;-2.89,-2.62,;-3.36,-1.16,;-4.9,-1.16,;-5.81,.09,;-7.27,-.39,;-7.27,-1.93,;-5.81,-2.41,;-8.52,-2.83,;-9.93,-2.21,;-8.36,-4.37,;-2.12,-.25,;-2.12,1.29,;-3.45,2.06,;-4.79,1.29,;-6.12,2.06,;-3.45,3.6,;-2.12,4.37,;-.79,3.6,;-.79,2.06,;.55,1.29,;1.88,2.06,;5.93,-.68,;5.93,.86,;7.26,1.63,;8.59,.86,;9.93,1.63,;8.59,-.68,;7.26,-1.45,)|

BDBM507345

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(cn2)C#N)nnc1-c1ccn(n1)C(F)F |r,wU:16.17,18.19,(-6.82,1.78,;-5.49,1.01,;-4.16,1.78,;-4.16,3.32,;-2.82,4.09,;-1.49,3.32,;-1.49,1.78,;-.16,1.01,;1.18,1.78,;-2.82,1.01,;-2.82,-.53,;-1.58,-1.43,;-.11,-.96,;1.22,-1.73,;-.11,-2.5,;2.55,-2.5,;2.55,-.96,;2.55,.58,;3.89,-1.73,;3.89,-3.27,;5.22,-.96,;6.55,-1.73,;7.89,-.96,;7.89,.58,;6.55,1.35,;5.22,.58,;9.22,1.35,;10.56,2.12,;-2.05,-2.9,;-3.59,-2.9,;-4.07,-1.43,;-5.61,-1.43,;-6.52,-.19,;-7.98,-.66,;-7.98,-2.2,;-6.52,-2.68,;-9.47,-2.6,;-10.56,-1.51,;-9.87,-4.09,)|

BDBM507346

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(cn2)C#N)nnc1-c1cc2CCCn2n1 |r,wU:16.17,18.19,(-6.93,1.37,;-5.59,.6,;-4.26,1.37,;-4.26,2.91,;-2.93,3.68,;-1.59,2.91,;-1.59,1.37,;-.26,.6,;1.07,1.37,;-2.93,.6,;-2.93,-.94,;-1.68,-1.85,;-.22,-1.37,;1.12,-2.14,;-.22,-2.91,;2.45,-2.91,;2.45,-1.37,;2.45,.17,;3.78,-2.14,;3.78,-3.68,;5.12,-1.37,;6.45,-2.14,;7.79,-1.37,;7.79,.17,;6.45,.94,;5.12,.17,;9.12,.94,;10.45,1.71,;-2.16,-3.31,;-3.7,-3.31,;-4.17,-1.85,;-5.71,-1.85,;-6.62,-.6,;-8.08,-1.08,;-9.55,-.6,;-10.45,-1.85,;-9.55,-3.09,;-8.08,-2.62,;-6.62,-3.09,)|

BDBM507347

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,(3.89,-3.68,;3.89,-2.14,;2.56,-1.37,;2.56,.17,;1.22,-2.14,;-.11,-2.91,;2.56,-2.91,;-.11,-1.37,;-1.58,-1.85,;-2.05,-3.31,;-3.59,-3.31,;-4.07,-1.85,;-5.61,-1.85,;-6.51,-.6,;-7.98,-1.08,;-7.98,-2.62,;-9.22,-3.52,;-6.51,-3.09,;-2.82,-.94,;-2.82,.6,;-4.16,1.37,;-5.49,.6,;-4.16,2.91,;-2.82,3.68,;-1.49,2.91,;-1.49,1.37,;-.15,.6,;5.22,-1.37,;6.56,-2.14,;7.89,-1.37,;7.89,.17,;9.22,.94,;6.56,.94,;5.22,.17,)|

BDBM507348

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:5.5,wD:4.3,(5.36,-4.83,;5.36,-3.29,;6.69,-2.52,;4.02,-2.52,;4.02,-.98,;2.69,-.21,;2.69,1.33,;1.35,-.98,;.02,-1.75,;2.69,-1.75,;.02,-.21,;-1.44,-.69,;-1.92,-2.16,;-3.46,-2.16,;-3.94,-.69,;-5.4,-.21,;-5.88,1.25,;-7.42,1.25,;-7.89,-.21,;-9.36,-.69,;-6.65,-1.12,;-2.69,.21,;-2.69,1.75,;-4.02,2.52,;-5.36,1.75,;-4.02,4.06,;-2.69,4.83,;-1.36,4.06,;-1.36,2.52,;-.02,1.75,;5.36,-.21,;6.69,-.98,;8.02,-.21,;8.02,1.33,;9.36,2.1,;6.69,2.1,;5.36,1.33,)|

BDBM507349

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1ncc(Cl)cn1 |r,wU:2.2,1.0,(4.02,-3.68,;4.02,-2.14,;2.69,-1.37,;2.69,.17,;1.35,-2.14,;.02,-2.91,;2.69,-2.91,;.02,-1.37,;-1.44,-1.85,;-1.92,-3.31,;-3.46,-3.31,;-3.94,-1.85,;-5.4,-1.37,;-5.88,.1,;-7.42,.1,;-7.89,-1.37,;-9.36,-1.85,;-6.65,-2.27,;-2.69,-.94,;-2.69,.6,;-4.02,1.37,;-5.36,.6,;-4.02,2.91,;-2.69,3.68,;-1.36,2.91,;-1.36,1.37,;-.02,.6,;5.36,-1.37,;6.69,-2.14,;8.02,-1.37,;8.02,.17,;9.36,.94,;6.69,.94,;5.36,.17,)|

BDBM507350

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.36,-4.06,;4.02,-3.29,;4.02,-1.75,;2.69,-.98,;2.69,.56,;1.35,-1.75,;.02,-2.52,;2.69,-2.52,;.02,-.98,;-1.44,-1.46,;-1.92,-2.93,;-3.46,-2.93,;-3.94,-1.46,;-5.4,-.98,;-5.88,.48,;-7.42,.48,;-7.89,-.98,;-9.36,-1.46,;-6.65,-1.89,;-2.69,-.56,;-2.69,.98,;-4.02,1.75,;-5.36,.98,;-4.02,3.29,;-2.69,4.06,;-1.36,3.29,;-1.36,1.75,;-.02,.98,;5.36,-.98,;6.69,-1.75,;8.02,-.98,;8.02,.56,;9.36,1.33,;6.69,1.33,;5.36,.56,)|

BDBM507351

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F |r,wU:10.11,8.9,(10.02,.17,;8.69,.94,;7.36,.17,;7.36,-1.37,;6.02,-2.14,;4.69,-1.37,;4.69,.17,;6.02,.94,;3.35,-2.14,;3.35,-3.68,;2.02,-1.37,;2.02,.17,;.69,-2.14,;-.65,-2.91,;2.02,-2.91,;-.65,-1.37,;-2.11,-1.85,;-2.59,-3.31,;-4.13,-3.31,;-4.6,-1.85,;-6.07,-1.37,;-6.54,.1,;-8.08,.1,;-8.56,-1.37,;-10.02,-1.85,;-7.31,-2.27,;-3.36,-.94,;-3.36,.6,;-4.69,1.37,;-6.02,.6,;-4.69,2.91,;-3.36,3.68,;-2.02,2.91,;-2.02,1.37,;-.69,.6,)|

BDBM507352

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1cnc(C)cn1 |r,wU:2.2,1.0,(4.02,-3.68,;4.02,-2.14,;2.69,-1.37,;2.69,.17,;1.35,-2.14,;.02,-2.91,;2.69,-2.91,;.02,-1.37,;-1.44,-1.85,;-1.92,-3.31,;-3.46,-3.31,;-3.94,-1.85,;-5.4,-1.37,;-5.88,.1,;-7.42,.1,;-7.89,-1.37,;-9.36,-1.85,;-6.65,-2.27,;-2.69,-.94,;-2.69,.6,;-4.02,1.37,;-5.36,.6,;-4.02,2.91,;-2.69,3.68,;-1.36,2.91,;-1.36,1.37,;-.02,.6,;5.36,-1.37,;5.36,.17,;6.69,.94,;8.02,.17,;9.36,.94,;8.02,-1.37,;6.69,-2.14,)|

BDBM507353

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1cnc(C)cn1 |r,wU:3.3,2.1,(5.36,-4.06,;4.02,-3.29,;4.02,-1.75,;2.69,-.98,;2.69,.56,;1.35,-1.75,;.02,-2.52,;2.69,-2.52,;.02,-.98,;-1.44,-1.46,;-1.92,-2.93,;-3.46,-2.93,;-3.94,-1.46,;-5.4,-.98,;-5.88,.48,;-7.42,.48,;-7.89,-.98,;-9.36,-1.46,;-6.65,-1.89,;-2.69,-.56,;-2.69,.98,;-4.02,1.75,;-5.36,.98,;-4.02,3.29,;-2.69,4.06,;-1.36,3.29,;-1.36,1.75,;-.02,.98,;5.36,-.98,;5.36,.56,;6.69,1.33,;8.02,.56,;9.36,1.33,;8.02,-.98,;6.69,-1.75,)|

BDBM507354

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.36,-4.06,;4.02,-3.29,;4.02,-1.75,;2.69,-.98,;2.69,.56,;1.35,-1.75,;.02,-2.52,;2.69,-2.52,;.02,-.98,;-1.44,-1.46,;-1.92,-2.93,;-3.46,-2.93,;-3.94,-1.46,;-5.4,-.98,;-5.88,.48,;-7.42,.48,;-7.89,-.98,;-9.36,-1.46,;-6.65,-1.89,;-2.69,-.56,;-2.69,.98,;-4.02,1.75,;-5.36,.98,;-4.02,3.29,;-2.69,4.06,;-1.36,3.29,;-1.36,1.75,;-.02,.98,;5.36,-.98,;6.69,-1.75,;8.02,-.98,;8.02,.56,;9.36,1.33,;6.69,1.33,;5.36,.56,)|

BDBM507355

COc1ccccc1NC(=O)c1cccs1

BDBM507356

COc1ccccc1NC(=O)c1ccc(F)s1

BDBM507357

COc1ccccc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(.7,1.43,;-.63,.66,;-1.97,1.43,;-1.97,2.97,;-3.3,3.74,;-4.63,2.97,;-4.63,1.43,;-3.3,.66,;-3.3,-.88,;-2.05,-1.79,;-.59,-1.31,;.5,-2.4,;-.27,-3.74,;1.27,-3.74,;1.83,-1.63,;3.17,-2.4,;4.5,-1.63,;5.83,-2.4,;7.17,-1.63,;7.17,-.09,;8.5,.68,;5.83,.68,;4.5,-.09,;-2.53,-3.25,;-4.07,-3.25,;-4.55,-1.79,;-6.01,-1.31,;-6.49,.15,;-8.03,.15,;-8.5,-1.31,;-7.26,-2.22,)|

BDBM507358

Nc1nnc(-c2cccs2)n1-c1ccccc1OC(F)F |(2.21,-2.2,;.67,-2.2,;-.23,-3.44,;-1.7,-2.97,;-1.7,-1.43,;-2.95,-.52,;-2.95,1.02,;-4.41,1.49,;-5.32,.25,;-4.41,-1,;-.23,-.95,;.24,.51,;-.79,1.66,;-.31,3.12,;1.19,3.44,;2.22,2.3,;1.75,.83,;2.78,-.31,;4.28,.01,;5.32,-1.13,;4.76,1.48,)|

BDBM507359

COc1ccccc1-n1c(NS(=O)(=O)CCc2ccccc2)nnc1-c1cccs1 |(1.37,1.43,;.03,.66,;-1.3,1.43,;-1.3,2.97,;-2.63,3.74,;-3.97,2.97,;-3.97,1.43,;-2.63,.66,;-2.63,-.88,;-1.39,-1.79,;.08,-1.31,;1.17,-2.4,;.4,-3.74,;1.94,-3.74,;2.5,-1.63,;3.83,-2.4,;5.17,-1.63,;6.5,-2.4,;7.84,-1.63,;7.84,-.09,;6.5,.68,;5.17,-.09,;-1.86,-3.25,;-3.4,-3.25,;-3.88,-1.79,;-5.34,-1.31,;-5.82,.15,;-7.36,.15,;-7.84,-1.31,;-6.59,-2.22,)|

BDBM507360

COc1ccccc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccc(F)s1 |(-6.57,1.43,;-5.23,.66,;-3.9,1.43,;-3.9,2.97,;-2.57,3.74,;-1.23,2.97,;-1.23,1.43,;-2.57,.66,;-2.57,-.88,;-1.32,-1.79,;.14,-1.31,;1.23,-2.4,;.46,-3.74,;2,-3.74,;2.57,-1.63,;3.9,-2.4,;5.23,-1.63,;6.57,-2.4,;7.9,-1.63,;7.9,-.09,;9.23,.68,;6.57,.68,;5.23,-.09,;-1.8,-3.25,;-3.34,-3.25,;-3.81,-1.79,;-5.28,-1.31,;-5.75,.15,;-7.29,.15,;-7.77,-1.31,;-9.23,-1.79,;-6.52,-2.22,)|

BDBM507361

FC(F)Oc1ccccc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(2.03,.66,;.7,1.43,;.7,2.97,;-.63,.66,;-1.97,1.43,;-1.97,2.97,;-3.31,3.73,;-4.64,2.96,;-4.64,1.42,;-3.3,.65,;-3.3,-.89,;-2.05,-1.79,;-.59,-1.31,;.5,-2.4,;1.27,-3.73,;-.27,-3.73,;1.83,-1.63,;3.17,-2.4,;4.5,-1.63,;5.83,-2.4,;7.17,-1.63,;7.17,-.09,;8.5,.68,;5.83,.68,;4.5,-.09,;-2.53,-3.25,;-4.07,-3.26,;-4.54,-1.79,;-6.01,-1.32,;-6.49,.15,;-8.03,.15,;-8.5,-1.32,;-7.25,-2.22,)|

BDBM507362

COc1ccc(Br)cc1-n1c(nnc1-c1cccs1)N(C)S(=O)(=O)CCc1ccc(Cl)cc1 |(.19,7.13,;-1.14,6.36,;-2.48,7.12,;-2.48,8.66,;-3.81,9.43,;-5.14,8.66,;-6.48,9.43,;-5.14,7.12,;-3.81,6.35,;-3.81,4.81,;-2.56,3.91,;-3.03,2.44,;-4.57,2.44,;-5.05,3.91,;-6.52,4.38,;-6.99,5.84,;-8.53,5.84,;-9.01,4.38,;-7.76,3.48,;-1.09,4.39,;.24,5.16,;-.01,3.3,;.39,1.81,;-1.09,2.21,;1.33,4.07,;2.66,3.3,;4,4.07,;5.33,3.3,;6.66,4.07,;6.66,5.61,;8,6.38,;5.33,6.38,;4,5.61,)|

BDBM507363

COc1ccccc1-n1c(NS(=O)(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2)nnc1-c1cccs1 |r,wU:14.14,wD:16.18,(.11,7.86,;-1.22,7.09,;-2.55,7.86,;-2.56,9.4,;-3.89,10.17,;-5.22,9.4,;-5.22,7.86,;-3.89,7.09,;-3.88,5.55,;-2.64,4.64,;-1.17,5.12,;-.08,4.03,;.69,2.7,;-.85,2.7,;1.25,4.8,;2.58,5.57,;2.58,4.03,;3.92,4.8,;5.25,4.03,;6.58,4.8,;6.58,6.34,;7.92,7.11,;5.25,7.11,;3.92,6.34,;-3.11,3.18,;-4.65,3.18,;-5.13,4.64,;-6.59,5.12,;-7.07,6.58,;-8.61,6.58,;-9.09,5.12,;-7.84,4.21,)|

BDBM507364

COc1ccc(Br)cc1-n1c(NS(=O)(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2)nnc1-c1cccs1 |r,wU:15.15,wD:17.19,(.11,7.86,;-1.22,7.09,;-2.55,7.86,;-2.56,9.4,;-3.89,10.17,;-5.22,9.4,;-6.56,10.16,;-5.22,7.86,;-3.89,7.09,;-3.88,5.55,;-2.64,4.64,;-1.17,5.12,;-.08,4.03,;.69,2.7,;-.85,2.7,;1.25,4.8,;2.58,5.57,;2.58,4.03,;3.92,4.8,;5.25,4.03,;6.58,4.8,;6.58,6.34,;7.92,7.11,;5.25,7.11,;3.92,6.34,;-3.11,3.18,;-4.65,3.18,;-5.13,4.64,;-6.59,5.12,;-7.07,6.58,;-8.61,6.58,;-9.09,5.12,;-7.84,4.21,)|

BDBM507365

FC(F)Oc1ccccc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccc(F)s1 |(2.76,.66,;1.43,1.43,;1.43,2.97,;.1,.66,;-1.24,1.43,;-1.24,2.97,;-2.57,3.73,;-3.91,2.96,;-3.9,1.42,;-2.57,.65,;-2.57,-.89,;-1.32,-1.79,;.14,-1.31,;1.23,-2.4,;2,-3.73,;.46,-3.73,;2.57,-1.63,;3.9,-2.4,;5.23,-1.63,;6.57,-2.4,;7.9,-1.63,;7.9,-.09,;9.23,.68,;6.57,.68,;5.23,-.09,;-1.8,-3.25,;-3.34,-3.26,;-3.81,-1.79,;-5.28,-1.32,;-5.76,.15,;-7.3,.15,;-7.77,-1.32,;-9.23,-1.8,;-6.52,-2.22,)|

BDBM507366

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)C(O)=O |(.7,.74,;-.63,-.03,;-1.97,.73,;-1.97,2.27,;-3.31,3.04,;-4.64,2.27,;-4.64,.73,;-3.3,-.04,;-3.3,-1.58,;-2.05,-2.48,;-.59,-2,;.5,-3.09,;.9,-4.58,;-.59,-4.18,;1.83,-2.32,;3.17,-3.09,;4.5,-2.32,;5.83,-3.09,;7.17,-2.32,;7.17,-.78,;8.5,-.01,;5.83,-.01,;4.5,-.78,;-2.53,-3.95,;-4.07,-3.95,;-4.54,-2.48,;-6.01,-2.01,;-6.49,-.55,;-8.03,-.55,;-8.5,-2.01,;-7.25,-2.91,;-5.97,3.04,;-7.31,2.27,;-5.98,4.58,)|

BDBM507367

Nc1nnc(-c2ccc(F)s2)n1-c1ccccc1OC(F)F |(3.38,-1.55,;1.91,-2.03,;1.44,-3.49,;-.1,-3.5,;-.58,-2.03,;-2.04,-1.56,;-2.52,-.09,;-4.06,-.09,;-4.54,-1.56,;-6,-2.04,;-3.29,-2.46,;.67,-1.12,;.66,.42,;-.67,1.18,;-.67,2.72,;.66,3.5,;2,2.73,;2,1.19,;3.33,.42,;4.66,1.19,;6,.42,;4.66,2.73,)|

BDBM507368

COc1ccc(Br)cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(-.83,8.33,;-2.17,7.56,;-3.5,8.33,;-3.5,9.87,;-4.84,10.64,;-6.17,9.87,;-7.5,10.64,;-6.17,8.33,;-4.84,7.56,;-4.84,6.02,;-3.59,5.11,;-2.1,5.51,;-.77,4.74,;-.37,3.25,;-1.86,3.65,;.56,5.51,;1.9,4.74,;3.23,5.51,;4.57,4.74,;5.9,5.51,;5.9,7.05,;7.23,7.82,;4.57,7.82,;3.23,7.05,;-4.07,3.65,;-5.61,3.65,;-6.08,5.11,;-7.62,5.11,;-8.1,6.58,;-9.64,6.58,;-10.11,5.11,;-8.87,4.21,)|

BDBM507369

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)C1=CCSCC1 |t:35,(2.05,-5.56,;.71,-6.33,;-.62,-5.56,;-.62,-4.02,;-1.96,-3.25,;-3.29,-4.02,;-3.29,-5.56,;-1.96,-6.33,;-1.96,-7.87,;-.71,-8.78,;.78,-8.38,;2.11,-9.15,;2.51,-10.64,;1.02,-10.24,;3.45,-8.38,;4.78,-9.15,;6.11,-8.38,;7.45,-9.15,;8.78,-8.38,;8.78,-6.84,;10.11,-6.07,;7.45,-6.07,;6.11,-6.84,;-1.19,-10.24,;-2.73,-10.24,;-3.2,-8.78,;-4.74,-8.78,;-5.22,-7.31,;-6.76,-7.31,;-7.23,-8.78,;-5.99,-9.68,;-4.62,-3.25,;-5.96,-4.02,;-7.29,-3.25,;-7.29,-1.71,;-5.96,-.94,;-4.62,-1.71,)|

BDBM507370

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)N1CCOC1=O |(2.05,-5.56,;.71,-6.33,;-.62,-5.56,;-.62,-4.02,;-1.96,-3.25,;-3.29,-4.02,;-3.29,-5.56,;-1.96,-6.33,;-1.96,-7.87,;-.71,-8.78,;.78,-8.38,;2.11,-9.15,;2.51,-10.64,;1.02,-10.24,;3.45,-8.38,;4.78,-9.15,;6.11,-8.38,;7.45,-9.15,;8.78,-8.38,;8.78,-6.84,;10.11,-6.07,;7.45,-6.07,;6.11,-6.84,;-1.19,-10.24,;-2.73,-10.24,;-3.2,-8.78,;-4.74,-8.78,;-5.22,-7.31,;-6.76,-7.31,;-7.23,-8.78,;-5.99,-9.68,;-4.62,-3.25,;-4.62,-1.71,;-6.09,-1.24,;-6.99,-2.48,;-6.09,-3.73,;-6.49,-5.22,)|

BDBM507371

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)C1=CCS(=O)(=O)CC1 |t:35,(1.97,-7.33,;.63,-8.1,;-.7,-7.33,;-.7,-5.79,;-2.03,-5.02,;-3.37,-5.79,;-3.37,-7.33,;-2.03,-8.1,;-2.03,-9.64,;-.79,-10.54,;.7,-10.14,;2.03,-10.91,;2.43,-12.4,;.94,-12,;3.37,-10.14,;4.7,-10.91,;6.03,-10.14,;7.37,-10.91,;8.7,-10.14,;8.7,-8.6,;10.04,-7.83,;7.37,-7.83,;6.03,-8.6,;-1.26,-12.01,;-2.8,-12.01,;-3.28,-10.54,;-4.82,-10.54,;-5.3,-9.08,;-6.84,-9.08,;-7.31,-10.54,;-6.07,-11.45,;-4.7,-5.02,;-6.03,-5.79,;-7.37,-5.02,;-7.37,-3.48,;-8.86,-3.87,;-7.77,-1.99,;-6.03,-2.71,;-4.7,-3.48,)|

BDBM507372

COc1ccc(NCCO)cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(1.43,1.51,;.1,.73,;-1.23,1.5,;-1.24,3.04,;-2.57,3.81,;-3.9,3.04,;-5.24,3.81,;-6.57,3.04,;-7.9,3.8,;-9.24,3.03,;-3.9,1.5,;-2.57,.73,;-2.56,-.81,;-1.32,-1.71,;.15,-1.23,;1.24,-2.32,;1.63,-3.81,;.15,-3.41,;2.57,-1.55,;3.9,-2.32,;5.24,-1.55,;6.57,-2.32,;7.9,-1.55,;7.9,-.01,;9.24,.76,;6.57,.76,;5.24,-.01,;-1.79,-3.18,;-3.33,-3.18,;-3.81,-1.72,;-5.27,-1.24,;-5.75,.22,;-7.29,.22,;-7.77,-1.24,;-6.52,-2.14,)|

BDBM507373

COc1ccc(cc1-n1c(N)nnc1-c1cccs1)N(C)C |(4.6,.42,;3.27,-.35,;1.93,.42,;1.93,1.96,;.6,2.73,;-.74,1.96,;-.73,.42,;.6,-.35,;.6,-1.89,;1.85,-2.8,;3.31,-2.32,;1.37,-4.26,;-.17,-4.26,;-.64,-2.8,;-2.11,-2.33,;-2.59,-.86,;-4.13,-.86,;-4.6,-2.33,;-3.35,-3.23,;-2.07,2.72,;-3.4,1.95,;-2.07,4.26,)|

BDBM507374

NS(=O)(=O)c1cncc(O)c1

BDBM507375

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.16,18.19,(.13,7.83,;-1.2,7.05,;-2.53,7.82,;-2.53,9.36,;-3.87,10.13,;-5.2,9.36,;-5.2,7.82,;-6.53,7.05,;-7.87,7.82,;-3.87,7.05,;-3.86,5.51,;-2.62,4.61,;-1.15,5.08,;-.06,4,;.71,2.66,;-.83,2.66,;1.27,4.77,;1.27,6.31,;2.6,7.08,;2.6,8.62,;3.94,6.31,;3.94,4.77,;2.6,4,;5.27,4,;5.27,2.46,;6.61,1.69,;7.94,2.46,;9.27,1.69,;7.94,4,;6.61,4.77,;-3.09,3.14,;-4.63,3.14,;-5.11,4.6,;-6.57,5.08,;-7.82,4.17,;-9.07,5.08,;-10.53,4.6,;-8.59,6.54,;-7.05,6.54,)|

BDBM507376

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.16,18.19,(.04,8.79,;-1.29,8.02,;-2.62,8.79,;-2.62,10.33,;-3.96,11.09,;-5.29,10.32,;-5.29,8.78,;-6.62,8.01,;-7.96,8.78,;-3.96,8.01,;-3.95,6.47,;-2.71,5.57,;-1.24,6.05,;-.15,4.96,;.62,3.63,;-.92,3.63,;1.18,5.73,;1.18,7.27,;2.51,8.04,;2.51,9.58,;3.85,7.27,;3.85,5.73,;2.51,4.96,;5.18,4.96,;5.18,3.42,;6.52,2.65,;7.85,3.42,;9.18,2.65,;7.85,4.96,;6.52,5.73,;-3.18,4.1,;-4.72,4.1,;-5.2,5.57,;-6.66,6.04,;-7.91,5.14,;-9.15,6.04,;-10.62,5.56,;-8.68,7.5,;-7.14,7.5,)|

BDBM507377

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1nc(C)cs1 |r,wU:16.16,wD:18.19,(.04,8.79,;-1.29,8.02,;-2.62,8.79,;-2.62,10.33,;-3.96,11.09,;-5.29,10.32,;-5.29,8.78,;-6.62,8.01,;-7.96,8.78,;-3.96,8.01,;-3.95,6.47,;-2.71,5.57,;-1.24,6.05,;-.15,4.96,;.62,3.63,;-.92,3.63,;1.18,5.73,;1.18,7.27,;2.51,8.04,;2.51,9.58,;3.85,7.27,;3.85,5.73,;2.51,4.96,;5.18,4.96,;5.18,3.42,;6.52,2.65,;7.85,3.42,;9.18,2.65,;7.85,4.96,;6.52,5.73,;-3.18,4.1,;-4.72,4.1,;-5.2,5.57,;-6.66,6.04,;-7.91,5.14,;-9.15,6.04,;-10.62,5.56,;-8.68,7.5,;-7.14,7.5,)|

BDBM507379

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:16.16,(-.37,8.79,;-1.7,8.02,;-3.04,8.79,;-3.04,10.33,;-4.38,11.09,;-5.71,10.32,;-5.71,8.78,;-7.04,8.01,;-8.37,8.78,;-4.37,8.01,;-4.37,6.47,;-3.12,5.57,;-1.66,6.05,;-.57,4.96,;.2,3.63,;-1.34,3.63,;.76,5.73,;.76,7.27,;2.1,8.04,;3.43,7.27,;3.43,5.73,;2.1,4.96,;4.76,4.96,;4.76,3.42,;6.1,2.65,;7.43,3.42,;8.77,2.65,;7.43,4.96,;6.1,5.73,;-3.6,4.1,;-5.14,4.1,;-5.61,5.57,;-6.89,6,;-7.37,7.47,;-8.91,7.47,;-9.38,6,;-10.63,5.56,;-8.13,5.1,)|

BDBM507380

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:16.16,18.19,(-.37,8.79,;-1.7,8.02,;-3.04,8.79,;-3.04,10.33,;-4.38,11.09,;-5.71,10.32,;-5.71,8.78,;-7.04,8.01,;-8.37,8.78,;-4.37,8.01,;-4.37,6.47,;-3.12,5.57,;-1.66,6.05,;-.57,4.96,;.2,3.63,;-1.34,3.63,;.76,5.73,;.76,7.27,;2.1,8.07,;2.1,9.7,;3.43,7.27,;3.43,5.73,;2.1,4.96,;4.76,4.96,;4.76,3.42,;6.1,2.65,;7.43,3.42,;8.77,2.65,;7.43,4.96,;6.1,5.73,;-3.6,4.1,;-5.14,4.1,;-5.61,5.57,;-6.89,6,;-7.37,7.47,;-8.91,7.47,;-9.38,6,;-10.63,5.56,;-8.13,5.1,)|

BDBM507381

COc1cccc(OC)c1-n1c(NS(C)(=O)=O)nnc1-c1ccn(C)n1 |(4.76,1.43,;3.43,.66,;2.1,1.43,;2.09,2.97,;.76,3.73,;-.57,2.96,;-.57,1.42,;-1.9,.65,;-3.24,1.42,;.76,.65,;.77,-.89,;2.01,-1.79,;3.48,-1.31,;4.57,-2.4,;5.9,-1.63,;5.34,-3.73,;3.8,-3.73,;1.54,-3.25,;-0,-3.26,;-.48,-1.79,;-1.94,-1.32,;-2.42,.15,;-3.96,.15,;-4.44,-1.32,;-5.9,-1.8,;-3.19,-2.22,)|

BDBM507382

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:16.16,(-.1,8.37,;-1.43,7.6,;-2.77,8.37,;-2.77,9.91,;-4.1,10.68,;-5.44,9.91,;-5.43,8.37,;-6.77,7.59,;-8.1,8.36,;-4.1,7.6,;-4.1,6.06,;-2.85,5.15,;-1.39,5.63,;-.3,4.54,;.47,3.21,;-1.07,3.21,;1.04,5.31,;1.04,6.85,;2.37,7.62,;3.71,6.85,;3.71,5.31,;2.37,4.54,;5.04,4.54,;5.04,3,;6.37,2.23,;7.71,3,;9.04,2.23,;7.71,4.54,;6.37,5.31,;-3.32,3.69,;-4.86,3.69,;-5.34,5.15,;-6.62,5.59,;-7.09,7.05,;-8.63,7.05,;-9.11,5.59,;-10.36,5.15,;-7.86,4.68,)|

BDBM507384

NS(=O)(=O)C1CCCNC1

BDBM507385

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)[C@H](C)[C@H](O)c2ccc(Br)cc2Br)cc1 |r|

BDBM507386

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1C#N)C#N |r,wD:3.3,2.1,(.27,10.58,;.27,9.04,;1.6,8.27,;1.6,6.73,;2.93,5.96,;.27,5.96,;1.04,4.62,;-.5,7.29,;-1.07,5.19,;-1.07,3.65,;.18,2.74,;-.3,1.28,;-1.84,1.28,;-2.74,.03,;-2.27,-1.43,;-3.51,-2.34,;-4.76,-1.43,;-6.22,-1.91,;-4.28,.03,;-2.31,2.74,;-3.78,3.22,;-4.1,4.72,;-2.95,5.75,;-3.27,7.26,;-5.56,5.2,;-6.71,4.17,;-6.39,2.66,;-4.92,2.19,;-4.6,.68,;-5.75,-.35,;2.93,9.04,;4.27,8.27,;5.6,9.04,;5.6,10.58,;4.27,11.35,;2.93,10.58,;1.6,11.35,;.27,12.12,;6.94,11.35,;8.27,12.12,)|

BDBM507388

CCS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |(6.57,-2.4,;5.23,-1.63,;3.9,-2.4,;3.13,-3.73,;4.67,-3.73,;2.81,-1.31,;1.35,-1.79,;.87,-3.25,;-.67,-3.26,;-1.15,-1.79,;-2.61,-1.32,;-3.09,.15,;-4.63,.15,;-5.1,-1.32,;-6.57,-1.8,;-3.86,-2.22,;.1,-.89,;.1,.65,;-1.24,1.42,;-2.57,.65,;-3.9,1.42,;-1.24,2.96,;.09,3.73,;1.43,2.97,;1.43,1.43,;2.76,.66,;4.1,1.43,)|

BDBM507389

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cc(C)[nH]n1 |r,wU:16.17,18.19,(1.04,1.85,;-.29,1.08,;-1.63,1.85,;-1.63,3.39,;-2.96,4.16,;-4.3,3.39,;-4.3,1.85,;-5.63,1.08,;-6.96,1.85,;-2.96,1.08,;-2.96,-.46,;-1.72,-1.37,;-.25,-.89,;.84,-1.98,;.07,-3.31,;1.61,-3.31,;2.32,-1.58,;2.72,-.09,;3.41,-2.67,;3.02,-4.16,;4.9,-2.27,;5.99,-3.36,;7.48,-2.96,;7.88,-1.47,;9.36,-1.08,;6.79,-.39,;5.3,-.78,;-2.19,-2.83,;-3.73,-2.83,;-4.21,-1.37,;-5.75,-1.37,;-6.65,-2.61,;-8.12,-2.14,;-9.36,-3.04,;-8.12,-.6,;-6.65,-.12,)|

BDBM507390

COc1ccccc1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1ccn(C)n1 |r,wU:14.15,16.17,(-6.96,1.85,;-5.63,1.08,;-4.3,1.85,;-4.3,3.39,;-2.96,4.16,;-1.63,3.39,;-1.63,1.85,;-2.96,1.08,;-2.96,-.46,;-1.72,-1.37,;-.25,-.89,;.84,-1.98,;.07,-3.31,;1.61,-3.31,;2.32,-1.58,;2.72,-.09,;3.41,-2.67,;3.02,-4.16,;4.9,-2.27,;5.99,-3.36,;7.48,-2.96,;7.88,-1.47,;9.36,-1.08,;6.79,-.39,;5.3,-.78,;-2.19,-2.83,;-3.73,-2.83,;-4.21,-1.37,;-5.75,-1.37,;-6.65,-.12,;-8.12,-.6,;-8.12,-2.14,;-9.36,-3.04,;-6.65,-2.61,)|

BDBM507391

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(4.1,-9.63,;3.02,-8.54,;3.41,-7.06,;2.32,-5.97,;2.72,-4.48,;.84,-6.37,;.07,-7.7,;1.61,-7.7,;-.25,-5.28,;-1.72,-5.75,;-2.19,-7.22,;-3.73,-7.22,;-4.21,-5.75,;-5.75,-5.75,;-6.65,-7,;-8.12,-6.52,;-9.36,-7.43,;-8.12,-4.98,;-6.65,-4.51,;-2.96,-4.85,;-2.96,-3.31,;-4.3,-2.54,;-5.63,-3.31,;-6.96,-2.54,;-4.3,-1,;-2.96,-.23,;-1.63,-1,;-1.63,-2.54,;-.29,-3.31,;1.04,-2.54,;4.9,-6.66,;5.3,-5.17,;6.79,-4.77,;7.88,-5.86,;9.36,-5.46,;7.48,-7.35,;5.99,-7.75,)|

BDBM507392

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(4.1,-9.83,;3.02,-8.74,;3.41,-7.26,;2.32,-6.17,;2.72,-4.68,;.84,-6.57,;.07,-7.9,;1.61,-7.9,;-.25,-5.48,;-1.72,-5.95,;-2.19,-7.42,;-3.73,-7.42,;-4.21,-5.95,;-5.75,-5.95,;-6.65,-4.71,;-8.12,-5.18,;-8.12,-6.72,;-9.36,-7.63,;-6.65,-7.2,;-2.96,-5.05,;-2.96,-3.51,;-4.3,-2.74,;-5.63,-3.51,;-6.96,-2.74,;-4.3,-1.2,;-2.96,-.43,;-1.63,-1.2,;-1.63,-2.74,;-.29,-3.51,;1.04,-2.74,;4.9,-6.86,;5.3,-5.37,;6.79,-4.97,;7.88,-6.06,;9.36,-5.66,;7.48,-7.55,;5.99,-7.95,)|

BDBM507393

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(4.1,-4.7,;3.02,-3.61,;3.41,-2.13,;2.32,-1.04,;2.72,.45,;.84,-1.44,;.07,-2.77,;1.61,-2.77,;-.25,-.35,;-1.72,-.82,;-2.19,-2.29,;-3.73,-2.29,;-4.21,-.82,;-5.75,-.82,;-6.65,.42,;-8.12,-.05,;-8.12,-1.59,;-9.36,-2.5,;-6.65,-2.07,;-2.96,.08,;-2.96,1.62,;-4.3,2.39,;-5.63,1.62,;-6.96,2.39,;-4.3,3.93,;-2.96,4.7,;-1.63,3.93,;-1.63,2.39,;-.29,1.62,;1.04,2.39,;4.9,-1.73,;5.3,-.24,;6.79,.16,;7.88,-.93,;9.36,-.53,;7.48,-2.42,;5.99,-2.82,)|

BDBM507394

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(4.1,-4.7,;3.02,-3.61,;3.41,-2.13,;2.32,-1.04,;2.72,.45,;.84,-1.44,;.07,-2.77,;1.61,-2.77,;-.25,-.35,;-1.72,-.82,;-2.19,-2.29,;-3.73,-2.29,;-4.21,-.82,;-5.75,-.82,;-6.65,.42,;-8.12,-.05,;-8.12,-1.59,;-9.36,-2.5,;-6.65,-2.07,;-2.96,.08,;-2.96,1.62,;-4.3,2.39,;-5.63,1.62,;-6.96,2.39,;-4.3,3.93,;-2.96,4.7,;-1.63,3.93,;-1.63,2.39,;-.29,1.62,;1.04,2.39,;4.9,-1.73,;5.3,-.24,;6.79,.16,;7.88,-.93,;9.36,-.53,;7.48,-2.42,;5.99,-2.82,)|

BDBM507395

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wD:3.3,2.1,(4.1,-4.7,;3.02,-3.61,;3.41,-2.13,;2.32,-1.04,;2.72,.45,;.84,-1.44,;.07,-2.77,;1.61,-2.77,;-.25,-.35,;-1.72,-.82,;-2.19,-2.29,;-3.73,-2.29,;-4.21,-.82,;-5.75,-.82,;-6.65,-2.07,;-8.12,-1.59,;-9.36,-2.5,;-8.12,-.05,;-6.65,.42,;-2.96,.08,;-2.96,1.62,;-4.3,2.39,;-5.63,1.62,;-6.96,2.39,;-4.3,3.93,;-2.96,4.7,;-1.63,3.93,;-1.63,2.39,;-.29,1.62,;1.04,2.39,;4.9,-1.73,;5.3,-.24,;6.79,.16,;7.88,-.93,;9.36,-.53,;7.48,-2.42,;5.99,-2.82,)|

BDBM507396

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wD:3.3,2.1,(4.87,-10.07,;3.78,-8.98,;4.18,-7.49,;3.09,-6.41,;3.49,-4.92,;1.61,-6.8,;.84,-8.14,;2.38,-8.14,;.52,-5.71,;-.95,-6.19,;-1.42,-7.66,;-2.96,-7.66,;-3.44,-6.19,;-4.98,-6.19,;-5.88,-7.44,;-7.35,-6.96,;-8.59,-7.87,;-7.35,-5.42,;-5.88,-4.94,;-2.19,-5.29,;-2.19,-3.75,;-3.53,-2.98,;-4.86,-3.75,;-6.19,-2.98,;-3.53,-1.44,;-2.19,-.67,;-.86,-1.44,;-.86,-2.98,;.47,-3.75,;1.81,-2.98,;5.67,-7.1,;6.92,-8,;8.16,-7.1,;7.69,-5.63,;8.59,-4.39,;6.15,-5.63,)|

BDBM507397

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(4.1,-4.7,;3.02,-3.61,;3.41,-2.13,;2.32,-1.04,;2.72,.45,;.84,-1.44,;.07,-2.77,;1.61,-2.77,;-.25,-.35,;-1.72,-.82,;-2.19,-2.29,;-3.73,-2.29,;-4.21,-.82,;-5.75,-.82,;-6.65,-2.07,;-8.12,-1.59,;-9.36,-2.5,;-8.12,-.05,;-6.65,.42,;-2.96,.08,;-2.96,1.62,;-4.3,2.39,;-5.63,1.62,;-6.96,2.39,;-4.3,3.93,;-2.96,4.7,;-1.63,3.93,;-1.63,2.39,;-.29,1.62,;1.04,2.39,;4.9,-1.73,;5.3,-.24,;6.79,.16,;7.88,-.93,;9.36,-.53,;7.48,-2.42,;5.99,-2.82,)|

BDBM507398

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wD:3.3,2.1,(4.87,-10.13,;3.78,-9.04,;4.18,-7.56,;3.09,-6.47,;3.49,-4.98,;1.6,-6.87,;.83,-8.2,;2.37,-8.2,;.51,-5.78,;-.95,-6.25,;-1.43,-7.72,;-2.97,-7.72,;-3.45,-6.25,;-4.99,-6.25,;-5.89,-7.5,;-7.36,-7.02,;-8.6,-7.93,;-7.36,-5.48,;-5.89,-5.01,;-2.2,-5.35,;-2.2,-3.81,;-3.53,-3.04,;-4.87,-3.81,;-6.2,-3.04,;-3.53,-1.5,;-2.2,-.73,;-.87,-1.5,;-.87,-3.04,;.47,-3.81,;1.8,-3.04,;5.66,-7.16,;6.91,-8.06,;8.16,-7.16,;7.68,-5.7,;8.59,-4.45,;6.14,-5.69,)|

BDBM507399

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)s1 |r,wD:3.3,2.1,(4.87,-10.19,;3.78,-9.1,;4.18,-7.62,;3.09,-6.53,;3.49,-5.04,;1.61,-6.93,;.84,-8.26,;2.38,-8.26,;.52,-5.84,;-.95,-6.31,;-1.42,-7.78,;-2.96,-7.78,;-3.44,-6.31,;-4.98,-6.31,;-5.88,-7.56,;-7.35,-7.08,;-8.59,-7.99,;-7.35,-5.54,;-5.88,-5.07,;-2.19,-5.41,;-2.19,-3.87,;-3.53,-3.1,;-4.86,-3.87,;-6.19,-3.1,;-3.53,-1.56,;-2.19,-.79,;-.86,-1.56,;-.86,-3.1,;.47,-3.87,;1.81,-3.1,;5.67,-7.22,;6.92,-8.13,;8.16,-7.22,;7.69,-5.76,;8.59,-4.51,;6.15,-5.75,)|

BDBM507400

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2cnc(C)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,18.19,(-6.96,-2.96,;-5.63,-3.73,;-4.3,-2.96,;-4.3,-1.42,;-2.96,-.65,;-1.63,-1.42,;-1.63,-2.96,;-.29,-3.73,;1.04,-2.96,;-2.96,-3.73,;-2.96,-5.27,;-1.72,-6.17,;-.25,-5.7,;.84,-6.79,;.07,-8.12,;1.61,-8.12,;2.32,-6.39,;2.72,-4.9,;3.41,-7.48,;3.02,-8.96,;4.9,-7.08,;5.3,-5.59,;6.79,-5.19,;7.88,-6.28,;9.36,-5.88,;7.48,-7.77,;5.99,-8.17,;-2.19,-7.64,;-3.73,-7.64,;-4.21,-6.17,;-5.75,-6.17,;-6.65,-4.93,;-8.12,-5.4,;-8.12,-6.94,;-9.36,-7.85,;-6.65,-7.42,)|

BDBM507401

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2cnc(C)c[n+]2[O-])nnc1-c1ccn(C)n1 |r,wD:16.17,18.19,(-6.96,-2.79,;-5.63,-3.56,;-4.3,-2.79,;-4.3,-1.25,;-2.96,-.48,;-1.63,-1.25,;-1.63,-2.79,;-.29,-3.56,;1.04,-2.79,;-2.96,-3.56,;-2.96,-5.1,;-1.72,-6.01,;-.25,-5.53,;.84,-6.62,;.07,-7.96,;1.61,-7.96,;2.32,-6.22,;2.72,-4.74,;3.41,-7.31,;3.02,-8.8,;4.9,-6.91,;5.3,-5.43,;6.79,-5.03,;7.88,-6.12,;9.36,-5.72,;7.48,-7.6,;5.99,-8,;5.59,-9.49,;-2.19,-7.47,;-3.73,-7.47,;-4.21,-6.01,;-5.75,-6.01,;-6.65,-4.76,;-8.12,-5.24,;-8.12,-6.78,;-9.36,-7.68,;-6.65,-7.26,)|

BDBM507402

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2cnc(C)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,18.19,(-6.96,1.85,;-5.63,1.08,;-4.3,1.85,;-4.3,3.39,;-2.96,4.16,;-1.63,3.39,;-1.63,1.85,;-.29,1.08,;1.04,1.85,;-2.96,1.08,;-2.96,-.46,;-1.72,-1.37,;-.25,-.89,;.84,-1.98,;.07,-3.31,;1.61,-3.31,;2.32,-1.58,;2.72,-.09,;3.41,-2.67,;3.02,-4.16,;4.9,-2.27,;5.3,-.78,;6.79,-.39,;7.88,-1.47,;9.36,-1.08,;7.48,-2.96,;5.99,-3.36,;-2.19,-2.83,;-3.73,-2.83,;-4.21,-1.37,;-5.75,-1.37,;-6.65,-.12,;-8.12,-.6,;-8.12,-2.14,;-9.36,-3.04,;-6.65,-2.61,)|

BDBM507403

COc1cnc(cn1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(9.91,-7.34,;8.82,-6.25,;7.33,-6.65,;6.93,-8.13,;5.45,-8.53,;4.36,-7.44,;4.76,-5.95,;6.24,-5.56,;2.87,-7.84,;2.47,-9.33,;1.78,-6.75,;2.18,-5.26,;.29,-7.15,;-.48,-8.48,;1.06,-8.48,;-.8,-6.06,;-2.26,-6.54,;-2.74,-8,;-4.28,-8,;-4.75,-6.54,;-6.29,-6.54,;-7.2,-5.29,;-8.66,-5.77,;-8.66,-7.31,;-9.91,-8.21,;-7.2,-7.78,;-3.51,-5.63,;-3.51,-4.09,;-4.84,-3.32,;-6.17,-4.09,;-7.51,-3.32,;-4.84,-1.78,;-3.51,-1.01,;-2.17,-1.78,;-2.17,-3.32,;-.84,-4.09,;.49,-3.32,)|

BDBM507404

COc1cnc(cn1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(9.91,-6.97,;8.82,-5.88,;7.33,-6.28,;6.93,-7.76,;5.45,-8.16,;4.36,-7.07,;4.76,-5.59,;6.24,-5.19,;2.87,-7.47,;2.47,-8.96,;1.78,-6.38,;2.18,-4.9,;.29,-6.78,;-.48,-8.12,;1.06,-8.12,;-.8,-5.69,;-2.26,-6.17,;-2.74,-7.63,;-4.28,-7.63,;-4.75,-6.17,;-6.29,-6.17,;-7.2,-4.92,;-8.66,-5.4,;-8.66,-6.94,;-9.91,-7.84,;-7.2,-7.42,;-3.51,-5.26,;-3.51,-3.72,;-4.84,-2.95,;-6.17,-3.72,;-7.51,-2.95,;-4.84,-1.41,;-3.51,-.64,;-2.17,-1.41,;-2.17,-2.95,;-.84,-3.72,;.49,-2.95,)|

BDBM507405

COc1cnc(cn1)[C@H](O)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(9.91,-7.11,;8.82,-6.03,;7.33,-6.42,;6.93,-7.91,;5.45,-8.31,;4.36,-7.22,;4.76,-5.73,;6.24,-5.34,;2.87,-7.62,;2.47,-9.11,;1.78,-6.53,;2.18,-5.04,;.29,-6.93,;-.48,-8.26,;1.06,-8.26,;-.8,-5.84,;-2.26,-6.32,;-2.74,-7.78,;-4.28,-7.78,;-4.75,-6.32,;-6.29,-6.32,;-7.2,-5.07,;-8.66,-5.55,;-8.66,-7.09,;-9.91,-7.99,;-7.2,-7.56,;-3.51,-5.41,;-3.51,-3.87,;-4.84,-3.1,;-6.17,-3.87,;-7.51,-3.1,;-4.84,-1.56,;-3.51,-.79,;-2.17,-1.56,;-2.17,-3.1,;-.84,-3.87,;.49,-3.1,)|

BDBM507406

COc1cc[nH]c(=O)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:15.16,17.18,(1.04,6.64,;-.29,5.87,;-1.63,6.64,;-1.63,8.18,;-2.96,8.95,;-4.29,8.18,;-4.29,6.64,;-5.63,5.87,;-2.96,5.87,;-2.96,4.33,;-1.71,3.43,;-.25,3.9,;.89,2.87,;.12,1.54,;1.66,1.54,;2.36,3.35,;2.68,4.85,;3.5,2.32,;3.18,.81,;4.97,2.79,;6.11,1.76,;7.58,2.24,;7.9,3.75,;9.36,4.22,;6.75,4.78,;5.29,4.3,;-2.19,1.96,;-3.73,1.96,;-4.21,3.43,;-5.75,3.43,;-6.65,4.67,;-8.12,4.2,;-8.12,2.66,;-9.36,1.75,;-6.65,2.18,)|

BDBM507407

COc1ccnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(1.04,6.84,;-.29,6.07,;-1.63,6.84,;-1.63,8.38,;-2.96,9.15,;-4.29,8.38,;-4.29,6.84,;-5.63,6.07,;-6.96,6.84,;-2.96,6.07,;-2.96,4.53,;-1.71,3.63,;-.25,4.1,;.89,3.07,;.12,1.74,;1.66,1.74,;2.36,3.55,;2.68,5.06,;3.5,2.52,;3.18,1.01,;4.97,3,;6.11,1.97,;7.58,2.44,;7.9,3.95,;9.36,4.42,;6.75,4.98,;5.29,4.5,;-2.19,2.16,;-3.73,2.16,;-4.21,3.63,;-5.75,3.63,;-6.65,4.87,;-8.12,4.4,;-8.12,2.86,;-9.36,1.95,;-6.65,2.38,)|

BDBM507408

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507409

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC)c1ccc(Cl)cn1 |r,wU:3.3,2.1,(4.33,-4.59,;3.18,-3.56,;3.5,-2.05,;2.36,-1.02,;2.68,.49,;.89,-1.49,;.12,-2.83,;1.66,-2.83,;-.25,-.46,;-1.71,-.94,;-2.19,-2.4,;-3.73,-2.4,;-4.21,-.94,;-5.75,-.94,;-6.65,.31,;-8.12,-.17,;-8.12,-1.71,;-9.36,-2.61,;-6.65,-2.19,;-2.96,-.03,;-2.96,1.51,;-1.63,2.28,;-.29,1.51,;1.04,2.28,;-1.63,3.82,;-2.96,4.59,;-4.29,3.82,;-4.29,2.28,;-5.63,1.51,;-6.96,2.28,;4.97,-1.57,;5.29,-.07,;6.75,.41,;7.9,-.62,;9.36,-.15,;7.58,-2.13,;6.11,-2.6,)|

BDBM507410

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(1.04,6.85,;-.29,6.08,;-1.63,6.85,;-1.63,8.39,;-2.96,9.16,;-4.29,8.39,;-4.29,6.85,;-5.63,6.08,;-6.96,6.85,;-2.96,6.08,;-2.96,4.54,;-1.71,3.64,;-.25,4.11,;.89,3.08,;.12,1.75,;1.66,1.75,;2.36,3.56,;2.68,5.06,;3.5,2.53,;3.18,1.02,;4.97,3,;6.11,1.97,;7.58,2.45,;7.9,3.95,;9.36,4.43,;6.75,4.99,;5.29,4.51,;-2.19,2.17,;-3.73,2.17,;-4.21,3.64,;-5.75,3.64,;-6.65,4.88,;-8.12,4.41,;-8.12,2.87,;-9.36,1.96,;-6.65,2.39,)|

BDBM507411

COc1ccnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(1.04,6.73,;-.29,5.96,;-1.63,6.73,;-1.63,8.27,;-2.96,9.04,;-4.29,8.27,;-4.29,6.73,;-5.63,5.96,;-6.96,6.73,;-2.96,5.96,;-2.96,4.42,;-1.71,3.51,;-.25,3.99,;.89,2.96,;.12,1.63,;1.66,1.63,;2.36,3.44,;2.68,4.94,;3.5,2.41,;3.18,.9,;4.97,2.88,;6.11,1.85,;7.58,2.33,;7.9,3.83,;9.36,4.31,;6.75,4.86,;5.29,4.39,;-2.19,2.05,;-3.73,2.05,;-4.21,3.51,;-5.75,3.51,;-6.65,4.76,;-8.12,4.28,;-8.12,2.74,;-9.36,1.84,;-6.65,2.27,)|

BDBM507412

COc1ccnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(1.04,6.87,;-.29,6.1,;-1.63,6.87,;-1.63,8.41,;-2.96,9.18,;-4.29,8.41,;-4.29,6.87,;-5.63,6.1,;-6.96,6.87,;-2.96,6.1,;-2.96,4.56,;-1.71,3.66,;-.25,4.13,;.89,3.1,;.12,1.77,;1.66,1.77,;2.36,3.58,;2.68,5.08,;3.5,2.55,;3.18,1.04,;4.97,3.02,;6.11,1.99,;7.58,2.47,;7.9,3.97,;9.36,4.45,;6.75,5,;5.29,4.53,;-2.19,2.19,;-3.73,2.19,;-4.21,3.66,;-5.75,3.66,;-6.65,4.9,;-8.12,4.43,;-8.12,2.89,;-9.36,1.98,;-6.65,2.41,)|

BDBM507413

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC |r,wU:10.11,8.9,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507414

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)nc[nH]c1=O |r,wU:10.11,8.9,(9.93,3.42,;8.79,4.45,;7.33,3.97,;7.01,2.47,;5.54,1.99,;4.4,3.02,;4.72,4.53,;6.18,5,;2.93,2.55,;2.61,1.04,;1.79,3.58,;2.11,5.08,;.32,3.1,;-.45,1.77,;1.09,1.77,;-.82,4.13,;-2.29,3.66,;-2.76,2.19,;-4.3,2.19,;-4.78,3.66,;-6.32,3.66,;-7.22,4.9,;-8.69,4.43,;-8.69,2.89,;-9.93,1.98,;-7.22,2.41,;-3.53,4.56,;-3.53,6.1,;-2.2,6.87,;-.87,6.1,;.47,6.87,;-2.2,8.41,;-3.53,9.18,;-4.87,8.41,;-4.87,6.87,;-6.2,6.1,)|

BDBM507415

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(1.04,1.76,;-.29,.99,;-1.63,1.76,;-1.63,3.3,;-2.96,4.07,;-4.29,3.3,;-4.29,1.76,;-5.63,.99,;-6.96,1.76,;-2.96,.99,;-2.96,-.55,;-1.71,-1.45,;-.25,-.98,;.89,-2.01,;.12,-3.34,;1.66,-3.34,;2.36,-1.53,;2.68,-.03,;3.5,-2.56,;3.18,-4.07,;4.97,-2.09,;6.11,-3.12,;7.58,-2.64,;7.9,-1.14,;9.36,-.66,;6.75,-.11,;5.29,-.58,;-2.19,-2.92,;-3.73,-2.92,;-4.21,-1.45,;-5.75,-1.45,;-6.65,-.21,;-8.12,-.68,;-8.12,-2.22,;-9.36,-3.13,;-6.65,-2.7,)|

BDBM507416

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507417

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC |r,wU:10.11,8.9,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507418

COc1cnc(nc1)[C@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC |r,wU:10.11,wD:8.9,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507419

COc1cnc(nc1)[C@@H](C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC |r,wU:8.9,wD:10.11,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507420

Cn1ccc(n1)-c1nnc(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(F)cccc1F |r,wU:14.14,16.17,(-9.45,4.15,;-8.2,5.05,;-8.2,6.59,;-6.74,7.07,;-5.83,5.82,;-6.74,4.57,;-4.29,5.82,;-3.82,4.36,;-2.28,4.36,;-1.8,5.82,;-.33,6.3,;.81,5.27,;.04,3.93,;1.58,3.93,;2.27,5.74,;2.59,7.25,;4.06,7.72,;4.38,9.23,;5.2,6.69,;4.88,5.19,;3.42,4.71,;6.03,4.16,;5.71,2.65,;6.85,1.62,;8.32,2.1,;9.46,1.07,;8.64,3.6,;7.49,4.63,;-3.05,6.73,;-3.05,8.27,;-4.38,9.04,;-5.71,8.27,;-4.38,10.58,;-3.05,11.35,;-1.71,10.58,;-1.71,9.04,;-.38,8.27,)|

BDBM507421

Cn1ccc(n1)-c1nnc(NS(=O)(=O)[C@H]2C[C@@H](O)CN(C2)c2ncc(F)cn2)n1-c1c(F)cccc1F |r,wU:14.14,16.17,(-9.45,3.8,;-8.21,4.71,;-8.21,6.25,;-6.74,6.72,;-5.84,5.48,;-6.74,4.23,;-4.3,5.48,;-3.82,4.01,;-2.28,4.01,;-1.81,5.48,;-.34,5.95,;.8,4.92,;.03,3.59,;1.57,3.59,;2.27,5.4,;2.59,6.9,;4.05,7.38,;4.37,8.89,;5.2,6.35,;4.88,4.84,;3.41,4.37,;6.02,3.81,;5.7,2.31,;6.84,1.28,;8.31,1.75,;9.45,.72,;8.63,3.26,;7.49,4.29,;-3.05,6.38,;-3.05,7.92,;-4.39,8.69,;-5.72,7.92,;-4.39,10.23,;-3.05,11,;-1.72,10.23,;-1.72,8.69,;-.39,7.92,)|

BDBM507422

COc1cnc(cn1)[C@H](C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(9.93,-1.69,;8.79,-.66,;7.33,-1.14,;7.01,-2.64,;5.54,-3.12,;4.4,-2.09,;4.72,-.58,;6.18,-.11,;2.93,-2.56,;2.61,-4.07,;1.79,-1.53,;2.11,-.03,;.32,-2.01,;-.45,-3.34,;1.09,-3.34,;-.82,-.98,;-2.29,-1.45,;-2.76,-2.92,;-4.3,-2.92,;-4.78,-1.45,;-6.32,-1.45,;-7.22,-.21,;-8.69,-.68,;-8.69,-2.22,;-9.93,-3.13,;-7.22,-2.7,;-3.53,-.55,;-3.53,.99,;-2.2,1.76,;-.87,.99,;.47,1.76,;-2.2,3.3,;-3.53,4.07,;-4.87,3.3,;-4.87,1.76,;-6.2,.99,;-7.53,1.76,)|

BDBM507423

COc1ccc(Br)cc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2)nnc1-c1cccs1 |(.7,1.51,;-.63,.73,;-1.97,1.5,;-1.97,3.04,;-3.31,3.81,;-4.64,3.04,;-5.97,3.81,;-4.64,1.5,;-3.3,.73,;-3.3,-.81,;-2.05,-1.71,;-.59,-1.23,;.5,-2.32,;.9,-3.81,;-.59,-3.41,;1.83,-1.55,;3.17,-2.32,;4.5,-1.55,;5.83,-2.32,;7.17,-1.55,;7.17,-.01,;8.5,.76,;5.83,.76,;4.5,-.01,;-2.53,-3.18,;-4.07,-3.18,;-4.54,-1.72,;-6.01,-1.24,;-6.49,.22,;-8.03,.22,;-8.5,-1.24,;-7.25,-2.14,)|

BDBM507424

COc1ccc(Br)cc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2)nnc1-c1cccs1 |(-.99,8,;-2.33,7.23,;-3.66,8,;-3.66,9.54,;-4.99,10.31,;-6.33,9.54,;-7.66,10.31,;-6.33,8,;-4.99,7.23,;-4.99,5.69,;-3.75,4.79,;-2.26,5.19,;-.93,4.42,;-.53,2.93,;-2.02,3.33,;.41,5.19,;1.74,4.42,;3.07,5.19,;4.41,4.42,;5.74,5.19,;5.74,6.73,;7.07,7.5,;4.41,7.5,;3.07,6.73,;-4.22,3.32,;-5.76,3.32,;-6.24,4.79,;-7.73,5.19,;-8.2,6.65,;-9.74,6.65,;-10.22,5.19,;-8.97,4.28,)|

BDBM507425

COc1ccc(CN(Cc2ccc(OC)cc2)S(C)(=O)=O)cc1

BDBM507426

COc1cccc(OC)c1-n1c(nnc1-c1ccn(C)n1)N(CC[Si](C)(C)C)S(C)(=O)=O |(-4.11,1.5,;-2.78,.73,;-1.44,1.5,;-1.45,3.04,;-.11,3.81,;1.22,3.04,;1.22,1.5,;2.56,.73,;3.89,1.51,;-.11,.73,;-.11,-.81,;1.14,-1.71,;.66,-3.18,;-.88,-3.18,;-1.35,-1.72,;-2.48,-1.37,;-3.04,.06,;-4.58,-.03,;-4.96,-1.52,;-6.31,-2.05,;-3.66,-2.35,;2.6,-1.23,;2.96,.26,;4.42,.48,;4.82,1.97,;6.31,2.37,;3.73,3.06,;5.22,3.46,;3.69,-2.32,;5.03,-1.55,;4.09,-3.81,;2.6,-3.41,)|

BDBM507427

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(-6.96,1.76,;-5.63,.99,;-4.29,1.76,;-4.29,3.3,;-2.96,4.07,;-1.63,3.3,;-1.63,1.76,;-.29,.99,;1.04,1.76,;-2.96,.99,;-2.96,-.55,;-1.71,-1.45,;-.25,-.98,;.89,-2.01,;1.66,-3.34,;.12,-3.34,;2.36,-1.53,;2.68,-.03,;3.5,-2.56,;3.18,-4.07,;4.97,-2.09,;5.29,-.58,;6.75,-.11,;7.9,-1.14,;9.36,-.66,;7.58,-2.64,;6.11,-3.12,;-2.19,-2.92,;-3.73,-2.92,;-4.21,-1.45,;-5.75,-1.45,;-6.65,-.21,;-8.12,-.68,;-8.12,-2.22,;-9.36,-3.13,;-6.65,-2.7,)|

BDBM507428

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1cnc(OC)cn1 |r,wU:3.3,2.1,(4.33,2.02,;3.18,3.05,;3.5,4.55,;2.36,5.58,;2.68,7.09,;.89,5.11,;1.66,3.77,;.12,3.77,;-.25,6.14,;-1.71,5.66,;-2.19,4.2,;-3.73,4.2,;-4.21,5.66,;-5.75,5.66,;-6.65,6.91,;-8.12,6.43,;-8.12,4.89,;-9.36,3.99,;-6.65,4.42,;-2.96,6.57,;-2.96,8.11,;-4.29,8.88,;-5.63,8.11,;-6.96,8.88,;-4.29,10.42,;-2.96,11.19,;-1.63,10.42,;-1.63,8.88,;-.29,8.11,;1.04,8.88,;4.97,5.03,;5.29,6.53,;6.75,7.01,;7.9,5.98,;9.36,6.46,;9.68,7.96,;7.58,4.47,;6.11,4,)|

BDBM507431

COc1ccc(Br)cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(-.89,8,;-2.22,7.23,;-3.55,8,;-3.55,9.54,;-4.89,10.31,;-6.22,9.54,;-7.56,10.31,;-6.22,8,;-4.89,7.23,;-4.89,5.69,;-3.64,4.79,;-2.16,5.19,;-.82,4.42,;-.42,2.93,;-1.91,3.33,;.51,5.19,;1.85,4.42,;3.18,5.19,;4.51,4.42,;5.85,5.19,;5.85,6.73,;7.18,7.5,;4.51,7.5,;3.18,6.73,;-4.12,3.32,;-5.66,3.32,;-6.13,4.79,;-7.62,5.19,;-8.1,6.65,;-9.64,6.65,;-10.11,5.19,;-8.87,4.28,)|

BDBM507432

COc1cccc(OC)c1-n1c(N)nnc1-c1cccs1 |(4.6,1.19,;3.27,.42,;1.93,1.19,;1.93,2.73,;.6,3.5,;-.74,2.72,;-.73,1.18,;-2.07,.41,;-3.4,1.18,;.6,.42,;.6,-1.12,;1.85,-2.03,;3.31,-1.55,;1.37,-3.49,;-.17,-3.5,;-.64,-2.03,;-2.11,-1.56,;-2.59,-.09,;-4.13,-.09,;-4.6,-1.56,;-3.35,-2.46,)|

BDBM507433

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1)S(C)(=O)=O |(.7,.96,;-.63,.19,;-1.97,.96,;-1.97,2.5,;-3.3,3.27,;-4.63,2.5,;-4.63,.96,;-3.3,.19,;-3.3,-1.35,;-2.05,-2.26,;-.59,-1.78,;.5,-2.87,;.9,-4.36,;-.59,-3.96,;1.83,-2.1,;3.17,-2.87,;4.5,-2.1,;5.83,-2.87,;7.17,-2.1,;7.17,-.56,;8.5,.21,;5.83,.21,;4.5,-.56,;-2.53,-3.72,;-4.07,-3.72,;-4.55,-2.26,;-6.01,-1.78,;-6.49,-.32,;-8.03,-.32,;-8.5,-1.78,;-7.26,-2.69,;-5.97,3.27,;-7.3,2.5,;-7.06,4.36,;-4.88,4.36,)|

BDBM507434

CO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(4.64,-8.33,;5.41,-6.99,;4.64,-5.66,;3.1,-5.66,;2.33,-4.32,;2.33,-6.99,;3.67,-7.76,;1.56,-8.33,;1,-6.22,;-.33,-6.99,;-.49,-8.52,;-2,-8.84,;-2.77,-7.51,;-4.3,-7.35,;-5.07,-6.02,;-6.58,-6.34,;-7.72,-5.31,;-6.74,-7.87,;-5.33,-8.49,;-1.74,-6.37,;-2.06,-4.86,;-.92,-3.83,;.55,-4.3,;1.69,-3.27,;-1.24,-2.32,;-2.7,-1.85,;-3.85,-2.88,;-3.53,-4.38,;-4.67,-5.41,;-6.13,-4.94,;5.41,-4.32,;6.95,-4.32,;7.72,-2.99,;6.95,-1.66,;7.72,-.32,;5.41,-1.66,;4.64,-2.99,)|

BDBM507435

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1nc(C)cs1 |r,wU:18.19,wD:16.17,(1.69,-3.27,;.55,-4.3,;-.92,-3.83,;-1.24,-2.32,;-2.7,-1.85,;-3.85,-2.88,;-3.53,-4.38,;-4.67,-5.41,;-6.13,-4.94,;-2.06,-4.86,;-1.74,-6.37,;-.33,-6.99,;1,-6.22,;2.33,-6.99,;3.67,-7.76,;1.56,-8.33,;3.1,-5.66,;2.33,-4.32,;4.64,-5.66,;5.41,-6.99,;5.41,-4.32,;6.95,-4.32,;7.72,-2.99,;6.95,-1.66,;7.72,-.32,;5.41,-1.66,;4.64,-2.99,;-.49,-8.52,;-2,-8.84,;-2.77,-7.51,;-4.3,-7.35,;-5.07,-6.02,;-6.58,-6.34,;-7.72,-5.31,;-6.74,-7.87,;-5.33,-8.49,)|

BDBM507437

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ncc(C)cn2)nnc1-c1nc(C)cs1 |r,wD:18.19,16.17,(1.69,-3.27,;.55,-4.3,;-.92,-3.83,;-1.24,-2.32,;-2.7,-1.85,;-3.85,-2.88,;-3.53,-4.38,;-4.67,-5.41,;-6.13,-4.94,;-2.06,-4.86,;-1.74,-6.37,;-.33,-6.99,;1,-6.22,;2.33,-6.99,;3.67,-7.76,;1.56,-8.33,;3.1,-5.66,;2.33,-4.32,;4.64,-5.66,;5.41,-6.99,;5.41,-4.32,;6.95,-4.32,;7.72,-2.99,;6.95,-1.66,;7.72,-.32,;5.41,-1.66,;4.64,-2.99,;-.49,-8.52,;-2,-8.84,;-2.77,-7.51,;-4.3,-7.35,;-5.07,-6.02,;-6.58,-6.34,;-7.72,-5.31,;-6.74,-7.87,;-5.33,-8.49,)|

BDBM507439

CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2nc(C)cs2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:2.1,3.3,(4.64,-8.33,;5.41,-6.99,;4.64,-5.66,;3.1,-5.66,;2.33,-4.32,;2.33,-6.99,;3.67,-7.76,;1.56,-8.33,;1,-6.22,;-.33,-6.99,;-.49,-8.52,;-2,-8.84,;-2.77,-7.51,;-4.3,-7.35,;-5.07,-6.02,;-6.58,-6.34,;-7.72,-5.31,;-6.74,-7.87,;-5.33,-8.49,;-1.74,-6.37,;-2.06,-4.86,;-.92,-3.83,;.55,-4.3,;1.69,-3.27,;-1.24,-2.32,;-2.7,-1.85,;-3.85,-2.88,;-3.53,-4.38,;-4.67,-5.41,;-6.13,-4.94,;5.41,-4.32,;6.95,-4.32,;7.72,-2.99,;6.95,-1.66,;7.72,-.32,;5.41,-1.66,;4.64,-2.99,)|

BDBM507440

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@](C)(F)c2ncc(cn2)C#N)nnc1-c1nc(C)cs1 |r,wU:18.19,wD:16.17,18.20,(-7.21,6.01,;-5.74,5.53,;-4.6,6.56,;-4.92,8.07,;-3.77,9.1,;-2.31,8.62,;-1.99,7.12,;-.52,6.64,;.62,7.67,;-3.13,6.09,;-2.81,4.58,;-1.41,3.95,;-.07,4.72,;1.26,3.95,;.49,2.62,;2.59,3.18,;2.03,5.29,;1.26,6.62,;3.57,5.29,;3.57,3.75,;4.9,4.52,;4.34,6.62,;5.88,6.62,;6.65,7.96,;5.91,9.34,;4.34,9.29,;3.57,7.96,;6.68,10.67,;7.45,12,;-1.57,2.42,;-3.07,2.1,;-3.84,3.44,;-5.38,3.6,;-6.15,4.93,;-7.65,4.61,;-8.8,5.64,;-7.81,3.08,;-6.41,2.45,)|

BDBM507441

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@](C)(F)c2ncc(cn2)C#N)nnc1-c1nc(C)cs1 |r,wU:18.20,wD:16.17,18.19,(-7.21,6.01,;-5.74,5.53,;-4.6,6.56,;-4.92,8.07,;-3.77,9.1,;-2.31,8.62,;-1.99,7.12,;-.52,6.64,;.62,7.67,;-3.13,6.09,;-2.81,4.58,;-1.41,3.95,;-.07,4.72,;1.26,3.95,;.49,2.62,;2.59,3.18,;2.03,5.29,;1.26,6.62,;3.57,5.29,;3.57,3.75,;4.9,4.52,;4.34,6.62,;5.88,6.62,;6.65,7.96,;5.91,9.34,;4.34,9.29,;3.57,7.96,;6.68,10.67,;7.45,12,;-1.57,2.42,;-3.07,2.1,;-3.84,3.44,;-5.38,3.6,;-6.15,4.93,;-7.65,4.61,;-8.8,5.64,;-7.81,3.08,;-6.41,2.45,)|

BDBM507442

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@](C)(F)c2ncc(cn2)C#N)nnc1-c1nc(C)cs1 |r,wU:16.17,18.20,wD:18.19,(-7.21,6.01,;-5.74,5.53,;-4.6,6.56,;-4.92,8.07,;-3.77,9.1,;-2.31,8.62,;-1.99,7.12,;-.52,6.64,;.62,7.67,;-3.13,6.09,;-2.81,4.58,;-1.41,3.95,;-.07,4.72,;1.26,3.95,;.49,2.62,;2.59,3.18,;2.03,5.29,;1.26,6.62,;3.57,5.29,;3.57,3.75,;4.9,4.52,;4.34,6.62,;5.88,6.62,;6.65,7.96,;5.91,9.34,;4.34,9.29,;3.57,7.96,;6.68,10.67,;7.45,12,;-1.57,2.42,;-3.07,2.1,;-3.84,3.44,;-5.38,3.6,;-6.15,4.93,;-7.65,4.61,;-8.8,5.64,;-7.81,3.08,;-6.41,2.45,)|

BDBM507444

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(3.88,-4.59,;2.73,-3.56,;3.05,-2.05,;1.91,-1.02,;2.23,.49,;.44,-1.49,;-.64,-2.58,;1.21,-2.83,;-.7,-.46,;-2.17,-.94,;-2.64,-2.4,;-4.18,-2.4,;-4.66,-.94,;-5.99,-.17,;-7.24,-1.07,;-8.48,-.17,;-8.01,1.3,;-8.91,2.54,;-6.47,1.3,;-3.41,-.03,;-3.41,1.51,;-4.74,2.28,;-6.28,2.28,;-7.62,3.05,;-4.74,3.82,;-3.41,4.59,;-2.08,3.82,;-2.08,2.28,;-.54,2.28,;.23,3.61,;4.52,-1.57,;5.66,-2.6,;7.13,-2.13,;7.45,-.62,;8.91,-.15,;6.3,.41,;4.84,-.07,)|

BDBM507445

CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,wD:2.1,(6.95,-17.95,;5.41,-17.95,;4.64,-16.62,;3.1,-16.62,;2.33,-15.28,;2.33,-17.95,;3.67,-18.72,;1.56,-19.29,;1,-17.18,;-.33,-17.95,;-.49,-19.48,;-2,-19.8,;-2.77,-18.47,;-4.3,-18.31,;-5.33,-19.45,;-6.74,-18.83,;-6.58,-17.3,;-7.72,-16.26,;-5.07,-16.98,;-1.74,-17.33,;-2.06,-15.82,;-.92,-14.79,;.55,-15.26,;1.69,-14.23,;-1.24,-13.28,;-2.7,-12.81,;-3.85,-13.84,;-3.53,-15.34,;-4.67,-16.37,;-6.13,-15.9,;5.41,-15.28,;6.95,-15.28,;7.72,-13.95,;6.95,-12.62,;7.72,-11.28,;5.41,-12.62,;4.64,-13.95,)|

BDBM507448

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:2.1,3.3,(7.74,-1.97,;6.15,-2,;5.39,-.66,;3.86,-.63,;3.09,.66,;3.06,-2,;2.3,-3.31,;4.4,-2.76,;1.75,-1.2,;.41,-1.97,;.25,-3.5,;-1.29,-3.83,;-2.05,-2.52,;-3.58,-2.3,;-4.19,-.96,;-5.74,-.77,;-6.65,-2.05,;-6.02,-3.42,;-6.92,-4.68,;-8.48,-4.54,;-4.49,-3.58,;-1.01,-1.34,;-1.42,.6,;-.3,1.64,;1.2,1.15,;2.38,2.19,;-.6,3.12,;-2.08,3.58,;-3.17,2.6,;-2.87,1.12,;-4.05,.03,;-5.55,.41,;6.15,.68,;7.71,.66,;8.48,2.02,;7.69,3.34,;8.45,4.68,;6.15,3.34,;5.39,2,)|

BDBM507449

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-7.37,.8,;-7.75,-.72,;-6.6,-1.76,;-6.77,-3.29,;-5.35,-3.89,;-4.34,-2.74,;-5.1,-1.43,;-2.81,-2.93,;-2.02,-4.27,;-.52,-3.94,;-.35,-2.39,;.98,-1.65,;2.29,-2.42,;3.66,-3.18,;1.56,-3.75,;3.08,-1.05,;2.32,.26,;4.61,-1.08,;5.4,-2.42,;6.96,-2.39,;5.38,.29,;6.93,.26,;7.7,1.6,;6.93,2.93,;7.75,4.27,;5.4,2.93,;4.61,1.6,;-1.77,-1.79,;-2.18,.18,;-1.06,1.24,;.44,.72,;1.61,1.79,;-1.36,2.72,;-2.84,3.18,;-3.93,2.2,;-3.63,.7,;-4.78,-.37,;-6.3,.01,)|

BDBM507451

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(3.69,-4.04,;4.74,-2.91,;4.34,-1.42,;2.85,-.97,;2.48,.5,;1.77,-2.1,;.7,-3.2,;2.85,-3.2,;.7,-1.02,;-.75,-1.47,;-1.25,-2.97,;-2.8,-2.97,;-3.27,-1.5,;-4.74,-1,;-5.21,.45,;-6.73,.47,;-7.23,-1.02,;-8.7,-1.52,;-5.97,-1.92,;-2.01,-.58,;-2.01,1,;-3.35,1.76,;-4.69,.97,;-6.05,1.73,;-3.35,3.31,;-2.03,4.04,;-.7,3.31,;-.7,1.79,;.64,.97,;2.01,1.79,;5.42,-.26,;6.94,-.74,;8.02,.42,;7.6,1.86,;8.7,2.97,;6.13,2.28,;5.05,1.18,)|

BDBM507452

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ncc(C)s2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.26,-4.06,;3.93,-3.29,;3.93,-1.75,;2.6,-.98,;2.6,.56,;1.26,-1.75,;-.07,-2.52,;2.6,-2.52,;-.07,-.98,;-1.54,-1.46,;-2.01,-2.93,;-3.55,-2.93,;-4.03,-1.46,;-5.49,-.99,;-6.26,.34,;-7.77,.02,;-7.93,-1.51,;-9.26,-2.28,;-6.52,-2.13,;-2.78,-.56,;-2.78,.98,;-4.12,1.75,;-5.45,.98,;-6.79,1.75,;-4.12,3.29,;-2.79,4.06,;-1.45,3.29,;-1.45,1.75,;-.12,.99,;1.22,1.76,;5.26,-.98,;6.6,-1.75,;7.93,-.98,;7.93,.56,;9.26,1.33,;6.6,1.33,;5.26,.56,)|

BDBM507453

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(C)s2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.22,-4.13,;3.89,-3.36,;3.89,-1.82,;2.56,-1.05,;2.56,.49,;1.22,-1.82,;2.56,-2.59,;-.11,-2.59,;-.03,-.92,;-1.5,-1.4,;-1.97,-2.86,;-3.51,-2.86,;-3.99,-1.4,;-5.45,-.92,;-6.22,.41,;-7.73,.09,;-7.89,-1.44,;-9.22,-2.21,;-6.48,-2.07,;-2.74,-.49,;-2.74,1.05,;-4.08,1.82,;-5.41,1.05,;-6.74,1.82,;-4.08,3.36,;-2.74,4.13,;-1.41,3.36,;-1.41,1.82,;-.08,1.05,;1.26,1.82,;5.22,-1.05,;6.56,-1.82,;7.89,-1.05,;7.89,.49,;9.22,1.26,;6.56,1.26,;5.22,.49,)|

BDBM507454

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.22,-4.13,;3.89,-3.36,;3.89,-1.82,;2.56,-1.05,;2.56,.49,;1.22,-1.82,;2.56,-2.59,;-.11,-2.59,;-.03,-.92,;-1.5,-1.4,;-1.97,-2.86,;-3.51,-2.86,;-3.99,-1.4,;-5.45,-.92,;-6.48,-2.07,;-7.89,-1.44,;-9.22,-2.21,;-7.73,.09,;-6.22,.41,;-2.74,-.49,;-2.74,1.05,;-4.08,1.82,;-5.41,1.05,;-6.74,1.82,;-4.08,3.36,;-2.74,4.13,;-1.41,3.36,;-1.41,1.82,;-.08,1.05,;1.26,1.82,;5.22,-1.05,;6.56,-1.82,;7.89,-1.05,;7.89,.49,;9.22,1.26,;6.56,1.26,;5.22,.49,)|

BDBM507455

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc(Cl)s2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(5.22,-4.13,;3.89,-3.36,;3.89,-1.82,;2.56,-1.05,;2.56,.49,;1.22,-1.82,;2.56,-2.59,;-.11,-2.59,;-.03,-.92,;-1.5,-1.4,;-1.97,-2.86,;-3.51,-2.86,;-3.99,-1.4,;-5.45,-.92,;-6.22,.41,;-7.73,.09,;-7.89,-1.44,;-9.22,-2.21,;-6.48,-2.07,;-2.74,-.49,;-2.74,1.05,;-4.08,1.82,;-5.41,1.05,;-6.74,1.82,;-4.08,3.36,;-2.74,4.13,;-1.41,3.36,;-1.41,1.82,;-.08,1.05,;1.26,1.82,;5.22,-1.05,;6.56,-1.82,;7.89,-1.05,;7.89,.49,;9.22,1.26,;6.56,1.26,;5.22,.49,)|

BDBM507456

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3CCCCc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(7.08,-1.37,;5.54,-1.37,;4.77,-.03,;3.23,-.03,;2.46,1.3,;2.46,-1.37,;1.69,-2.7,;3.8,-2.14,;1.13,-.6,;-.2,-1.37,;-.36,-2.9,;-1.87,-3.22,;-2.64,-1.88,;-4.17,-1.72,;-4.94,-.39,;-6.45,-.71,;-6.61,-2.24,;-7.85,-3.15,;-7.69,-4.68,;-6.29,-5.3,;-5.04,-4.4,;-5.2,-2.87,;-1.61,-.74,;-1.93,.77,;-3.39,1.24,;-4.54,.21,;-6,.69,;-3.71,2.75,;-2.57,3.78,;-1.11,3.3,;-.79,1.8,;.68,1.32,;1.81,2.37,;5.54,1.3,;7.08,1.3,;7.85,2.64,;7.08,3.97,;7.85,5.3,;5.54,3.97,;4.77,2.64,)|

BDBM507457

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc3cc(OC)ccc3[nH]2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(9.11,-2.41,;7.57,-2.41,;6.8,-1.07,;5.26,-1.07,;4.49,.26,;4.49,-2.41,;3.72,-3.74,;5.83,-3.18,;3.16,-1.64,;1.83,-2.41,;1.67,-3.94,;.16,-4.26,;-.61,-2.93,;-2.14,-2.77,;-3.17,-3.91,;-4.58,-3.28,;-5.99,-3.91,;-7.23,-3,;-8.64,-3.63,;-9.88,-2.73,;-7.07,-1.47,;-5.66,-.85,;-4.42,-1.75,;-2.91,-1.43,;.42,-1.78,;.1,-.28,;-1.36,.2,;-2.51,-.83,;-3.97,-.35,;-1.68,1.71,;-.54,2.74,;.92,2.26,;1.24,.75,;2.71,.28,;3.84,1.32,;7.57,.26,;9.11,.26,;9.88,1.59,;9.11,2.93,;9.88,4.26,;7.57,2.93,;6.8,1.59,)|

BDBM507458

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnccn2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(4.86,-4.05,;3.54,-3.24,;3.54,-1.7,;2.19,-.95,;2.19,.57,;.87,-1.73,;-.43,-2.49,;2.22,-2.49,;-.43,-.95,;-1.89,-1.4,;-2.38,-2.86,;-3.89,-2.86,;-4.35,-1.43,;-5.9,-1.07,;-7.06,-2.1,;-8.53,-1.61,;-8.84,-.09,;-7.59,1.06,;-6.21,.45,;-3.13,-.51,;-3.1,1.03,;-1.81,1.81,;-.48,1,;.87,1.81,;-1.81,3.3,;-3.16,4.05,;-4.43,3.32,;-4.46,1.78,;-5.8,1.01,;-7.14,1.79,;4.84,-.92,;6.16,-1.7,;7.49,-.95,;7.51,.62,;8.84,1.32,;6.13,1.35,;4.84,.59,)|

BDBM507459

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2csc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.29,-4.06,;3.94,-3.27,;3.91,-1.72,;2.61,-.96,;2.61,.56,;1.28,-1.75,;-.05,-2.51,;2.61,-2.51,;-.05,-.96,;-1.49,-1.43,;-1.98,-2.89,;-3.5,-2.89,;-3.96,-1.45,;-5.43,-.96,;-6.11,-2.32,;-7.63,-2.1,;-7.87,-.58,;-9.26,.1,;-6.52,.12,;-2.74,-.53,;-2.72,1.02,;-4.07,1.78,;-5.38,.99,;-6.73,1.75,;-4.05,3.33,;-2.74,4.06,;-1.41,3.3,;-1.44,1.81,;-.08,.99,;1.28,1.75,;5.24,-.94,;6.57,-1.72,;7.87,-.99,;7.9,.58,;9.26,1.32,;6.54,1.34,;5.24,.58,)|

BDBM507460

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2coc(C)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.31,-4.09,;3.97,-3.3,;3.97,-1.72,;2.61,-.95,;2.63,.57,;1.27,-1.75,;-.04,-2.51,;2.63,-2.51,;-.04,-.95,;-1.49,-1.42,;-1.98,-2.92,;-3.51,-2.92,;-4,-1.45,;-5.47,-.93,;-6.18,.38,;-7.68,.14,;-7.9,-1.39,;-9.29,-2.16,;-6.51,-2.07,;-2.74,-.55,;-2.74,1.04,;-4.08,1.8,;-5.39,1.01,;-6.75,1.75,;-4.05,3.33,;-2.74,4.09,;-1.43,3.33,;-1.43,1.83,;-.07,1.01,;1.27,1.83,;5.28,-.95,;6.62,-1.75,;7.93,-.98,;7.95,.6,;9.29,1.39,;6.62,1.36,;5.28,.57,)|

BDBM507461

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nc(cs2)C2CC2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:2.1,3.3,(-5.58,3.06,;-4.11,2.58,;-2.97,3.61,;-1.5,3.14,;-.36,4.17,;-1.18,1.63,;-2.69,1.31,;.32,1.95,;-.86,.12,;.6,-.35,;1.85,.55,;3.09,-.35,;2.62,-1.82,;3.52,-3.06,;3.05,-4.53,;4.29,-5.43,;5.54,-4.53,;5.06,-3.06,;4.29,-6.97,;5.06,-8.31,;3.52,-8.31,;1.08,-1.82,;.17,-3.06,;.8,-4.47,;2.33,-4.63,;2.96,-6.04,;-.11,-5.72,;-1.64,-5.56,;-2.26,-4.15,;-1.36,-2.9,;-1.98,-1.5,;-3.52,-1.33,;-3.29,5.12,;-4.75,5.59,;-5.07,7.1,;-3.93,8.13,;-4.25,9.64,;-2.46,7.65,;-2.14,6.15,)|

BDBM507462

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nccs2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(4.61,-4.04,;3.25,-3.31,;3.25,-1.76,;1.92,-.99,;1.92,.53,;.56,-1.78,;-.75,-2.55,;1.92,-2.55,;-.75,-.99,;-2.22,-1.46,;-2.68,-2.93,;-4.23,-2.93,;-4.7,-1.48,;-6.17,-.97,;-6.87,.37,;-8.4,.1,;-8.62,-1.43,;-7.26,-2.11,;-3.47,-.56,;-3.44,.99,;-4.78,1.76,;-6.11,.97,;-7.47,1.73,;-4.75,3.31,;-3.47,4.04,;-2.14,3.28,;-2.14,1.78,;-.78,.97,;.56,1.78,;4.56,-.99,;5.92,-1.76,;7.23,-.99,;7.26,.56,;8.62,1.35,;5.89,1.32,;4.59,.56,)|

BDBM507463

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cscn2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(4.61,-4.06,;3.26,-3.27,;3.23,-1.7,;1.91,-.92,;1.93,.57,;.58,-1.73,;-.72,-2.49,;1.93,-2.49,;-.72,-.95,;-2.18,-1.43,;-2.66,-2.89,;-4.18,-2.89,;-4.67,-1.46,;-6.13,-.92,;-7.18,-2.06,;-8.56,-1.41,;-8.32,.14,;-6.83,.41,;-3.42,-.54,;-3.39,1.03,;-4.77,1.79,;-6.05,1,;-7.4,1.73,;-4.72,3.33,;-3.42,4.06,;-2.1,3.3,;-2.12,1.79,;-.77,1,;.58,1.81,;4.58,-.95,;5.91,-1.73,;7.21,-.95,;7.24,.6,;8.56,1.38,;5.88,1.35,;4.58,.57,)|

BDBM507464

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.1,-4.32,;4.71,-3.53,;4.71,-1.96,;3.35,-1.21,;3.35,.3,;1.99,-1.99,;1.24,-3.32,;2.78,-3.35,;.66,-1.24,;-.81,-1.72,;-1.3,-3.2,;-2.87,-3.2,;-3.35,-1.72,;-4.8,-1.21,;-5.1,.27,;-6.61,.78,;-7.73,-.24,;-7.46,-1.72,;-8.6,-2.81,;-10.08,-2.35,;-5.98,-2.26,;-2.08,-.78,;-2.05,1.27,;-3.41,2.02,;-4.77,1.24,;-6.13,1.96,;-3.41,3.56,;-2.08,4.32,;-.72,3.53,;-.72,2.02,;.63,1.24,;1.99,1.96,;6.01,-1.21,;7.4,-1.96,;8.72,-1.21,;8.75,.36,;10.08,1.15,;7.37,1.09,;6.04,.33,)|

BDBM507465

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(4.8,-3.93,;3.45,-3.14,;3.45,-1.56,;2.1,-.8,;2.1,.72,;.77,-1.59,;.01,-2.94,;1.53,-2.94,;-.55,-.8,;-1.9,-1.56,;-2.38,-3.05,;-3.93,-3.05,;-4.41,-1.56,;-5.87,-1.08,;-6.32,.35,;-7.87,.38,;-8.77,1.65,;-8.35,-1.11,;-7.11,-2.01,;-3.14,-.66,;-3.14,.89,;-1.82,1.67,;-.32,1.22,;.44,2.6,;-1.82,3.17,;-3.14,3.93,;-4.46,3.19,;-4.46,1.65,;-5.81,.86,;-7.16,1.62,;4.74,-.8,;4.77,.75,;6.09,1.51,;7.45,.75,;8.77,1.51,;7.42,-.83,;6.09,-1.59,)|

BDBM507466

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:2.1,3.3,(4.84,-4.31,;3.53,-3.49,;3.53,-1.94,;2.14,-1.17,;2.17,.33,;.86,-1.96,;.1,-3.3,;1.62,-3.3,;-.48,-1.2,;-1.95,-1.66,;-2.41,-3.17,;-3.94,-3.17,;-4.46,-1.69,;-5.94,-1.17,;-6.37,.25,;-7.93,.27,;-8.83,1.47,;-8.39,-1.2,;-7.14,-2.13,;-3.18,-.79,;-3.18,1.26,;-4.54,2.02,;-5.85,1.26,;-7.24,1.99,;-4.52,3.57,;-3.21,4.31,;-1.87,3.55,;-1.87,2.05,;-.53,1.26,;.83,2.05,;4.84,-1.17,;6.18,-1.94,;7.49,-1.17,;7.52,.38,;8.83,1.12,;6.15,1.12,;4.84,.35,)|

BDBM507467

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cc(C)[nH]n1 |r,wU:18.19,16.17,(-7.27,1.56,;-5.91,.85,;-4.57,1.61,;-4.57,3.14,;-3.21,3.9,;-1.9,3.14,;-1.9,1.64,;-.56,.85,;.83,1.61,;-3.21,.85,;-3.23,-1.17,;-1.95,-2.07,;-.5,-1.61,;.83,-2.37,;.07,-3.68,;1.6,-3.71,;2.14,-1.58,;2.17,-.08,;3.53,-2.35,;3.51,-3.9,;4.82,-1.58,;6.18,-2.35,;7.52,-1.58,;7.55,-.03,;8.88,.74,;6.18,.71,;4.84,-.05,;-2.47,-3.55,;-4,-3.55,;-4.49,-2.1,;-5.99,-1.58,;-6.4,-.16,;-7.95,-.14,;-8.88,1.06,;-8.47,-1.61,;-7.22,-2.51,)|

BDBM507468

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2cnc(C)cn2)nnc1-c1cc(C)[nH]n1 |r,wU:16.17,18.19,(-7.21,1.36,;-5.88,.59,;-4.54,1.37,;-4.54,2.91,;-3.21,3.68,;-1.88,2.91,;-1.88,1.37,;-.54,.6,;.79,1.37,;-3.21,.6,;-3.21,-.94,;-1.96,-1.85,;-.49,-1.37,;.84,-2.14,;.07,-3.47,;1.61,-3.47,;2.17,-1.37,;2.17,.17,;3.51,-2.14,;3.51,-3.68,;4.84,-1.37,;4.84,.17,;6.17,.94,;7.51,.17,;8.84,.94,;7.51,-1.37,;6.17,-2.14,;-2.43,-3.31,;-3.97,-3.31,;-4.45,-1.85,;-5.92,-1.37,;-6.39,.09,;-7.93,.09,;-8.84,1.33,;-8.41,-1.37,;-7.16,-2.28,)|

BDBM507469

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)[nH]n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wU:2.1,3.3,(4.87,-4.31,;3.51,-3.52,;3.53,-1.94,;2.14,-1.2,;2.17,.33,;.83,-1.99,;1.6,-3.3,;.07,-3.3,;-.5,-1.2,;-1.98,-1.69,;-2.47,-3.17,;-4,-3.17,;-4.49,-1.69,;-5.96,-1.17,;-6.4,.25,;-7.95,.27,;-8.88,1.47,;-8.47,-1.2,;-7.22,-2.13,;-3.23,-.76,;-3.21,1.26,;-4.57,2.02,;-5.91,1.26,;-7.27,1.99,;-4.54,3.57,;-3.23,4.31,;-1.9,3.55,;-1.9,2.05,;-.56,1.26,;.81,2.05,;4.82,-1.17,;4.87,.35,;6.18,1.12,;7.54,.38,;8.88,1.09,;7.52,-1.2,;6.18,-1.96,)|

BDBM507470

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1-c1cc(C)n[nH]1 |r,wU:16.17,18.19,(-7.21,1.36,;-5.88,.59,;-4.54,1.37,;-4.54,2.91,;-3.21,3.68,;-1.88,2.91,;-1.88,1.37,;-.54,.6,;.79,1.37,;-3.21,.6,;-3.21,-.94,;-1.96,-1.85,;-.49,-1.37,;.84,-2.14,;.07,-3.47,;1.61,-3.47,;2.17,-1.37,;2.17,.17,;3.51,-2.14,;3.51,-3.68,;4.84,-1.37,;6.17,-2.14,;7.51,-1.37,;7.51,.17,;8.84,.94,;6.17,.94,;4.84,.17,;-2.43,-3.31,;-3.97,-3.31,;-4.45,-1.85,;-5.92,-1.37,;-6.39,.09,;-7.93,.09,;-8.84,1.33,;-8.41,-1.37,;-7.16,-2.28,)|

BDBM507471

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2cn3ccccc3n2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(-7.62,8.42,;-6.16,7.94,;-5.01,8.97,;-5.33,10.48,;-4.18,11.5,;-2.72,11.02,;-2.4,9.52,;-.94,9.04,;.21,10.07,;-3.55,8.49,;-3.23,6.98,;-1.83,6.35,;-.49,7.12,;.84,6.35,;.07,5.01,;1.61,7.68,;2.18,5.58,;2.18,4.04,;3.51,6.35,;3.51,7.89,;4.84,5.58,;5,4.05,;6.51,3.73,;7.28,2.39,;8.82,2.39,;9.59,3.73,;8.82,5.06,;7.28,5.06,;6.25,6.2,;-1.99,4.82,;-3.5,4.51,;-4.26,5.84,;-5.8,6.01,;-6.56,7.34,;-8.07,7.02,;-8.23,5.49,;-9.57,4.73,;-6.83,4.86,)|

BDBM507472

CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.2,4.4,(6.77,2.15,;5.46,1.44,;4.08,2.18,;4.11,3.94,;2.71,4.68,;2.73,6.39,;1.42,3.91,;2.73,3.14,;.07,3.14,;.07,4.68,;-1.44,4.21,;-1.88,2.73,;-3.42,2.73,;-3.94,4.19,;-5.37,4.46,;-6.06,5.78,;-7.57,5.53,;-7.79,3.99,;-9.17,3.25,;-6.42,3.31,;-2.65,5.12,;-2.68,6.69,;-4.05,7.46,;-5.35,6.66,;-6.72,7.4,;-4,9,;-2.68,9.74,;-1.36,9,;-1.36,7.49,;.01,6.66,;1.36,7.49,;5.26,4.68,;6.69,3.99,;7.96,4.82,;7.9,6.39,;9.17,7.18,;6.47,7.07,;5.24,6.22,)|

BDBM507473

CCO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,wD:4.4,(6.71,-8.95,;5.31,-9.74,;4,-8.98,;4.02,-7.23,;2.63,-6.49,;2.68,-4.79,;1.31,-7.28,;0,-8.05,;2.66,-8.05,;0,-6.49,;-1.48,-6.95,;-1.94,-8.43,;-3.5,-8.43,;-3.97,-6.95,;-5.39,-6.71,;-6.05,-5.42,;-7.61,-5.64,;-7.86,-7.17,;-9.17,-7.91,;-6.46,-7.86,;-2.74,-6.05,;-2.71,-4.49,;-4.05,-3.72,;-5.39,-4.52,;-6.73,-3.78,;-4.05,-2.19,;-2.71,-1.45,;-1.4,-2.19,;-1.4,-3.7,;-.05,-4.52,;1.31,-3.7,;5.2,-6.46,;6.6,-7.17,;7.86,-6.38,;7.83,-4.79,;9.12,-4,;6.41,-4.11,;5.12,-4.93,)|

BDBM507474

CCO[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,wD:4.4,(6.77,-8.95,;5.43,-9.74,;4.09,-8.98,;4.09,-7.25,;2.75,-6.49,;2.75,-4.82,;1.44,-7.28,;2.75,-8.05,;.1,-8.05,;.1,-6.49,;-1.38,-6.95,;-1.85,-8.43,;-3.41,-8.43,;-3.9,-6.98,;-5.32,-6.73,;-6.01,-5.42,;-7.51,-5.64,;-7.73,-7.17,;-9.16,-7.91,;-6.36,-7.86,;-2.61,-6.05,;-2.64,-4.49,;-4.01,-3.75,;-5.3,-4.52,;-6.67,-3.78,;-3.96,-2.19,;-2.64,-1.45,;-1.33,-2.19,;-1.33,-3.72,;.04,-4.52,;1.41,-3.72,;5.27,-6.49,;6.69,-7.17,;7.92,-6.38,;7.9,-4.79,;9.16,-4,;6.5,-4.11,;5.24,-4.95,)|

BDBM507475

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,4.4,(6.81,-9.05,;5.46,-9.79,;4.11,-9.02,;4.11,-7.29,;2.74,-6.52,;2.76,-4.81,;1.44,-7.32,;2.76,-8.09,;.1,-8.09,;.1,-6.52,;-1.39,-6.99,;-1.86,-8.47,;-3.4,-8.47,;-3.92,-7.01,;-5.35,-6.74,;-6.06,-5.42,;-7.55,-5.67,;-7.77,-7.21,;-9.2,-7.89,;-6.39,-7.89,;-2.63,-6.08,;-2.65,-4.51,;-4.03,-3.77,;-5.32,-4.54,;-6.7,-3.8,;-3.97,-2.2,;-2.65,-1.46,;-1.33,-2.2,;-1.33,-3.74,;.04,-4.54,;1.42,-3.77,;5.29,-6.52,;6.72,-7.21,;7.99,-6.38,;7.93,-4.81,;9.2,-4.02,;6.53,-4.13,;5.27,-4.98,)|

BDBM507476

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,wD:18.19,(2.01,2.15,;.64,1.36,;-.7,2.15,;-.7,3.67,;-1.98,4.43,;-3.29,3.7,;-3.35,2.15,;-4.66,1.36,;-6,2.1,;-2.01,1.39,;-2.01,-.18,;-.75,-1.08,;.7,-.63,;1.77,-1.71,;.7,-2.81,;2.85,-2.81,;2.85,-.6,;2.48,.87,;4.34,-1,;4.71,-2.52,;6.21,-2.91,;7.31,-1.78,;6.63,-4.43,;5.42,.08,;6.91,-.34,;7.99,.76,;7.6,2.26,;8.67,3.36,;6.1,2.65,;5.02,1.57,;-1.22,-2.57,;-2.77,-2.57,;-3.24,-1.1,;-4.71,-.6,;-5.16,.84,;-6.7,.84,;-7.18,-.63,;-8.67,-1.13,;-5.94,-1.52,)|

BDBM507477

FC(F)(F)c1ccccc1-n1c(NS(=O)(=O)Cc2ccc(Cl)cc2)nnc1-c1cccs1 |(-6.24,2.61,;-5.45,1.28,;-4.67,-.05,;-6.96,.95,;-4.13,2.06,;-4.01,3.67,;-2.66,4.42,;-1.34,3.67,;-1.34,2.16,;-2.66,1.39,;-2.68,-.59,;-1.39,-1.5,;.07,-1.03,;1.17,-2.13,;.4,-3.45,;1.97,-3.45,;2.49,-1.36,;3.89,-2.11,;5.22,-1.39,;6.56,-2.13,;6.56,-3.62,;7.94,-4.42,;5.24,-4.39,;3.89,-3.65,;-1.89,-2.96,;-3.45,-2.96,;-3.92,-1.53,;-5.44,-1,;-5.9,.4,;-7.45,.43,;-7.94,-1.03,;-6.68,-1.94,)|

BDBM507478

FC(F)(F)c1ccccc1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1cccs1 |(-6.87,2.23,;-6.11,.89,;-5.34,-.45,;-7.61,.57,;-4.77,1.66,;-4.66,3.22,;-3.31,3.99,;-1.99,3.22,;-1.99,1.68,;-3.31,.94,;-3.34,-1.1,;-2.08,-2.01,;-.62,-1.54,;.48,-2.64,;1.28,-3.99,;-.29,-3.99,;1.8,-1.87,;3.23,-2.61,;4.5,-1.87,;4.55,-.3,;5.87,.44,;7.22,-.3,;8.57,.44,;7.19,-1.87,;5.87,-2.61,;-2.57,-3.49,;-4.11,-3.49,;-4.58,-2.03,;-6.09,-1.51,;-6.53,-.08,;-8.1,-.08,;-8.57,-1.54,;-7.33,-2.47,)|

BDBM507479

COc1ccc(cc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2)nnc1-c1cccs1)S(C)(=O)=O |(.7,.92,;-.64,.1,;-2.02,.89,;-1.99,2.4,;-3.33,3.17,;-4.65,2.43,;-4.65,.89,;-3.3,.12,;-3.3,-1.91,;-2.04,-2.78,;-.59,-2.35,;.51,-3.44,;1.28,-4.76,;-.26,-4.76,;1.82,-2.65,;3.2,-3.41,;4.48,-2.65,;4.51,-1.08,;5.8,-.34,;7.17,-1.08,;8.52,-.34,;7.14,-2.65,;5.8,-3.39,;-2.54,-4.26,;-4.07,-4.26,;-4.57,-2.81,;-6.05,-2.29,;-6.49,-.86,;-8.05,-.86,;-8.52,-2.35,;-7.25,-3.25,;-5.97,3.17,;-6.02,4.76,;-5.97,1.63,;-7.31,2.4,)|

BDBM507480

COc1ccccc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2)nnc1-c1cccs1 |(.73,1.7,;-.65,.88,;-1.99,1.7,;-1.99,3.22,;-3.31,3.99,;-4.66,3.22,;-4.66,1.68,;-3.31,.93,;-3.34,-1.1,;-2.05,-2.01,;-.62,-1.54,;.48,-2.67,;-.29,-3.99,;1.28,-3.99,;1.83,-1.87,;3.2,-2.64,;4.5,-1.87,;4.52,-.33,;5.84,.44,;7.19,-.3,;8.54,.47,;7.16,-1.87,;5.84,-2.64,;-2.54,-3.49,;-4.11,-3.49,;-4.55,-2.03,;-6.06,-1.51,;-6.5,-.08,;-8.07,-.08,;-8.54,-1.57,;-7.3,-2.47,)|

BDBM507481

COc1ccc(Cl)cc1-n1c(NS(=O)(=O)CCc2ccc(F)cc2)nnc1-c1cccs1 |(.73,1.68,;-.65,.88,;-2,1.71,;-2,3.19,;-3.32,3.96,;-4.67,3.22,;-6.01,3.96,;-4.67,1.68,;-3.32,.94,;-3.34,-1.07,;-2.08,-1.98,;-.62,-1.51,;.48,-2.62,;-.29,-3.96,;1.25,-3.96,;1.8,-1.84,;3.18,-2.59,;4.47,-1.84,;4.53,-.3,;5.85,.44,;7.2,-.28,;8.55,.47,;7.17,-1.84,;5.88,-2.59,;-2.57,-3.44,;-4.12,-3.44,;-4.58,-1.98,;-6.07,-1.49,;-6.54,-.06,;-8.08,-.06,;-8.55,-1.49,;-7.31,-2.45,)|

BDBM507482

COC(=O)CCS(=O)(=O)Nc1nnc(-c2cccs2)n1-c1c(OC)cccc1OC |(7.87,-1.75,;6.52,-2.57,;5.14,-1.8,;5.17,-.23,;3.85,-2.54,;2.5,-1.77,;1.16,-2.57,;.08,-3.67,;1.57,-4.06,;.05,-1.44,;-1.37,-1.91,;-1.9,-3.4,;-3.44,-3.4,;-3.91,-1.94,;-5.39,-1.42,;-5.86,.01,;-7.4,.01,;-7.87,-1.47,;-6.63,-2.38,;-2.67,-1.03,;-2.64,1,;-3.99,1.77,;-5.34,.98,;-6.68,1.72,;-3.99,3.31,;-2.67,4.06,;-1.32,3.29,;-1.35,1.77,;.03,.98,;1.4,1.77,)|

BDBM507483

COc1cccc(OC)c1-n1c(NS(=O)(=O)CCCO)nnc1-c1cccs1 |(1.91,1.27,;.58,.5,;-.76,1.27,;-.76,2.81,;-2.09,3.58,;-3.43,2.8,;-3.42,1.26,;-4.76,.49,;-6.09,1.26,;-2.09,.5,;-2.09,-1.04,;-.84,-1.95,;.62,-1.47,;1.96,-2.24,;2.73,-3.58,;1.19,-3.58,;3.29,-1.47,;4.62,-2.24,;5.96,-1.47,;7.29,-2.24,;-1.32,-3.41,;-2.86,-3.42,;-3.33,-1.95,;-4.8,-1.48,;-5.28,-.01,;-6.82,-.01,;-7.29,-1.48,;-6.04,-2.38,)|

BDBM507484

COc1cccc(OC)c1-n1c(nnc1-c1ccn(C)n1)N(CC[Si](C)(C)C)S(=O)(=O)C[C@@H](O)c1ccc(Cl)cn1 |r,wD:32.35,(1.4,-5.72,;.02,-6.5,;-1.33,-5.72,;-1.33,-4.22,;-2.67,-3.46,;-3.96,-4.18,;-3.99,-5.72,;-5.37,-6.5,;-6.72,-5.78,;-2.64,-6.47,;-2.67,-8.51,;-1.36,-9.38,;-1.89,-10.89,;-3.43,-10.89,;-3.93,-9.42,;-5.43,-8.98,;-6,-7.6,;-7.53,-7.66,;-7.94,-9.13,;-9.41,-9.73,;-6.65,-9.98,;.08,-8.95,;.46,-7.44,;1.99,-7.32,;2.65,-5.94,;1.74,-4.72,;4.22,-5.78,;3.28,-4.53,;1.15,-10.04,;.05,-11.11,;1.55,-11.51,;2.53,-9.26,;3.87,-10.01,;3.84,-11.55,;5.19,-9.26,;5.25,-7.69,;6.54,-6.94,;7.91,-7.69,;9.23,-6.94,;7.88,-9.29,;6.54,-10.04,)|

BDBM507485

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cc2S(C)(=O)=O)nnc1-c1ccn(C)n1 |r,wU:17.18,(-7.09,7.25,;-5.77,6.45,;-4.42,7.22,;-4.36,8.76,;-3.06,9.5,;-1.71,8.73,;-1.71,7.22,;-.36,6.45,;1.03,7.25,;-3.03,6.48,;-3.06,4.45,;-1.77,3.59,;-.29,4.02,;.78,2.97,;-.32,1.87,;1.18,1.47,;2.17,3.71,;3.52,2.97,;3.49,1.44,;4.81,3.71,;4.88,5.25,;6.2,5.99,;7.55,5.25,;8.91,5.99,;7.52,3.71,;6.23,2.97,;6.2,1.44,;4.91,.64,;7.55,.67,;7.55,2.2,;-2.26,2.11,;-3.83,2.11,;-4.33,3.56,;-5.83,3.99,;-6.39,5.37,;-7.93,5.31,;-8.36,3.84,;-9.83,3.25,;-7.03,3,)|

BDBM507486

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wU:2.1,(2.59,.8,;3.92,1.51,;3.95,3.06,;2.59,3.81,;1.23,3.03,;.14,1.95,;1.66,1.57,;.14,4.12,;-1.32,3.65,;-1.81,2.19,;-3.37,2.19,;-3.86,3.65,;-5.38,4.06,;-5.91,5.45,;-7.46,5.39,;-7.89,3.9,;-9.35,3.34,;-6.56,3.09,;-2.59,4.55,;-2.56,6.54,;-3.95,7.28,;-5.29,6.51,;-6.65,7.25,;-3.89,8.8,;-2.62,9.55,;-1.26,8.8,;-1.26,7.31,;.11,6.51,;1.47,7.31,;5.29,3.81,;5.32,5.33,;6.62,6.07,;7.99,5.33,;9.35,6.07,;7.99,3.81,;6.65,3.06,;6.62,1.51,;5.26,.74,;7.99,2.29,;7.99,.77,)|

BDBM507487

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ccc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wD:17.18,(-6.35,-3.18,;-4.97,-3.9,;-3.63,-3.12,;-3.6,-1.59,;-2.28,-.84,;-.94,-1.59,;-.91,-3.12,;.44,-3.9,;1.85,-3.15,;-2.25,-3.87,;-2.28,-5.9,;-.97,-6.78,;.47,-6.31,;1.56,-7.41,;.47,-8.5,;2,-8.91,;2.91,-6.65,;4.35,-7.37,;4.28,-8.94,;5.63,-6.62,;5.69,-5.09,;6.97,-4.34,;8.35,-5.09,;9.69,-4.34,;8.32,-6.65,;7.01,-7.41,;-1.5,-8.25,;-3.06,-8.25,;-3.53,-6.81,;-5.1,-6.37,;-5.6,-4.97,;-7.16,-5.06,;-7.6,-6.53,;-9.07,-7.06,;-6.28,-7.37,)|

BDBM507488

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:17.18,(-6.53,8.09,;-5.18,7.34,;-3.83,8.12,;-3.8,9.66,;-2.51,10.39,;-1.16,9.63,;-1.16,8.12,;.2,7.34,;1.58,8.15,;-2.48,7.4,;-2.48,5.39,;-1.22,4.48,;.26,4.95,;1.33,3.85,;.23,2.78,;1.74,2.37,;2.65,4.6,;4.06,3.88,;4.03,2.34,;5.35,4.63,;5.41,6.17,;6.7,6.93,;8.08,6.17,;9.4,6.9,;8.05,4.6,;6.7,3.88,;-1.72,3.03,;-3.26,3.03,;-3.76,4.48,;-5.27,4.89,;-5.81,6.3,;-7.35,6.21,;-7.75,4.76,;-9.23,4.16,;-6.47,3.91,)|

BDBM507489

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cc2)nnc1-c1ccn(C)n1 |r,wU:17.18,(-6.47,9.1,;-5.09,8.35,;-3.71,9.13,;-3.68,10.67,;-2.37,11.43,;-1.03,10.67,;-1,9.13,;.38,8.35,;1.76,9.13,;-2.34,8.38,;-2.37,6.35,;-1.09,5.43,;.41,5.89,;1.53,4.81,;1.92,3.3,;.41,3.69,;2.84,5.56,;4.25,4.84,;4.25,3.27,;5.59,5.59,;7,4.84,;8.31,5.59,;8.34,7.13,;9.68,7.89,;6.93,7.89,;5.62,7.13,;-1.58,3.96,;-3.16,3.96,;-3.65,5.43,;-5.19,5.86,;-5.71,7.27,;-7.28,7.2,;-7.71,5.69,;-9.18,5.1,;-6.37,4.84,)|

BDBM507490

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:2.1,(1.89,2.94,;3.22,3.71,;3.22,5.25,;1.89,6.02,;.56,5.25,;.96,3.76,;-.53,4.16,;-.53,6.34,;-2,5.86,;-2.47,4.4,;-4.01,4.4,;-4.49,5.86,;-5.68,6.16,;-6.29,7.57,;-7.83,7.43,;-8.16,5.92,;-9.58,5.31,;-6.84,5.14,;-3.24,6.77,;-3.24,8.31,;-1.91,9.08,;-.58,8.31,;.76,9.08,;-1.91,10.62,;-3.25,11.39,;-4.58,10.62,;-4.58,9.08,;-5.91,8.31,;-7.25,9.07,;4.56,6.02,;4.56,7.56,;5.89,8.33,;7.23,7.56,;8.56,8.33,;7.23,6.02,;5.89,5.25,)|

BDBM507491

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ccc(F)cc2S(C)(=O)=O)nnc1-c1ccn(C)n1 |r,wD:17.18,(1.71,-3.24,;.31,-4.02,;-1.05,-3.24,;-1.02,-1.75,;-2.38,-.98,;-3.68,-1.72,;-3.75,-3.27,;-5.08,-4.02,;-6.44,-3.3,;-2.35,-4.02,;-2.38,-6.03,;-1.08,-6.9,;.37,-6.43,;1.46,-7.52,;1.86,-9,;.37,-8.6,;2.79,-6.77,;4.21,-7.52,;4.15,-9.03,;5.52,-6.74,;5.55,-5.22,;6.85,-4.48,;8.21,-5.22,;9.57,-4.48,;8.21,-6.74,;6.88,-7.48,;6.85,-9.06,;5.48,-9.84,;8.21,-8.29,;8.21,-9.81,;-1.61,-8.38,;-3.16,-8.38,;-3.62,-6.93,;-5.14,-6.49,;-5.7,-5.1,;-7.24,-5.16,;-7.68,-6.65,;-9.07,-7.24,;-6.35,-7.48,)|

BDBM507492

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cc2S(C)(=O)=O)nnc1-c1ccn(C)n1 |r,wU:17.18,(-6.73,9.04,;-5.38,8.34,;-4.02,9.11,;-4.02,10.61,;-2.64,11.35,;-1.31,10.58,;-1.34,9.11,;.04,8.34,;1.46,9.08,;-2.67,8.34,;-2.67,6.34,;-1.38,5.44,;.07,5.91,;1.18,4.83,;1.61,3.35,;.07,3.72,;2.56,5.57,;3.92,4.83,;3.89,3.29,;5.24,5.6,;5.3,7.14,;6.6,7.84,;7.98,7.14,;9.33,7.88,;7.95,5.6,;6.63,4.83,;6.6,3.29,;5.24,2.55,;7.95,2.52,;7.95,4.06,;-1.9,3.97,;-3.47,3.97,;-3.93,5.41,;-5.47,5.87,;-6.02,7.26,;-7.56,7.17,;-7.99,5.69,;-9.41,5.11,;-6.67,4.86,)|

BDBM507493

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wU:2.1,(2.85,2.37,;4.22,3.15,;4.25,4.7,;2.89,5.44,;1.52,4.67,;1.92,3.21,;.44,3.58,;.44,5.75,;-1.05,5.29,;-1.52,3.83,;-3.1,3.83,;-3.57,5.26,;-5.09,5.72,;-5.64,7.09,;-7.2,7.02,;-7.6,5.53,;-9.06,4.98,;-6.3,4.73,;-2.29,6.19,;-2.29,8.2,;-3.66,8.95,;-5.02,8.17,;-6.36,8.88,;-3.63,10.47,;-2.33,11.21,;-.96,10.44,;-.96,8.95,;.37,8.17,;1.8,8.92,;5.58,5.44,;5.62,6.96,;6.92,7.71,;8.28,6.99,;9.65,7.74,;8.25,5.44,;6.95,4.7,;6.92,3.15,;5.62,2.34,;8.28,3.92,;8.28,2.4,)|

BDBM507494

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1S(C)(=O)=O |r,wU:2.1,(2.86,2.86,;4.22,3.66,;4.25,5.18,;2.86,5.92,;1.53,5.18,;.41,4.1,;1.93,3.69,;.45,6.26,;-1.01,5.8,;-1.54,4.31,;-3.08,4.31,;-3.58,5.8,;-5.07,6.2,;-5.62,7.59,;-7.17,7.53,;-7.6,6.05,;-9,5.46,;-6.3,5.21,;-2.31,6.67,;-2.28,8.68,;-3.64,9.45,;-5,8.68,;-6.37,9.39,;-3.61,10.97,;-2.31,11.68,;-.98,10.97,;-.95,9.45,;.38,8.68,;1.78,9.45,;5.59,5.95,;5.62,7.47,;6.89,8.21,;8.28,7.47,;9.64,8.21,;8.25,5.92,;6.95,5.18,;6.92,3.63,;5.62,2.83,;8.25,4.4,;8.25,2.89,)|

BDBM507495

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cc2)nnc1-c1ccn(C)n1 |r,wU:17.18,(-6.61,8.54,;-5.23,7.8,;-3.9,8.57,;-3.87,10.11,;-2.55,10.85,;-1.2,10.11,;-1.2,8.57,;.16,7.8,;1.54,8.6,;-2.52,7.84,;-2.52,5.8,;-1.26,4.91,;.22,5.37,;1.3,4.3,;.22,3.22,;1.73,2.82,;2.68,5.07,;4.04,4.3,;4.01,2.76,;5.36,5.07,;6.78,4.33,;8.07,5.07,;8.1,6.6,;9.42,7.37,;6.71,7.34,;5.39,6.6,;-1.75,3.43,;-3.32,3.43,;-3.78,4.88,;-5.32,5.34,;-5.87,6.73,;-7.41,6.67,;-7.84,5.16,;-9.32,4.6,;-6.52,4.33,)|

BDBM507496

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cc2)nnc1-c1ccn(C)n1 |r,wU:17.18,(-6.47,8.59,;-5.11,7.87,;-3.76,8.65,;-3.73,10.16,;-2.44,10.92,;-1.06,10.16,;-1.09,8.65,;.29,7.87,;1.67,8.65,;-2.41,7.9,;-2.41,5.89,;-1.16,4.98,;.32,5.45,;1.42,4.35,;.32,3.28,;1.83,2.87,;2.77,5.14,;4.15,4.38,;4.12,2.84,;5.44,5.14,;5.51,6.67,;6.83,7.4,;8.18,6.67,;9.5,7.4,;8.15,5.14,;6.83,4.38,;-1.63,3.53,;-3.2,3.53,;-3.67,4.95,;-5.21,5.39,;-5.74,6.8,;-7.28,6.74,;-7.69,5.23,;-9.17,4.66,;-6.4,4.41,)|

BDBM507497

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:2.1,(2.92,2.41,;4.22,3.21,;4.25,4.75,;2.89,5.52,;1.54,4.75,;.46,3.64,;1.94,3.27,;.46,5.83,;-.99,5.37,;-1.48,3.89,;-3.05,3.89,;-3.51,5.37,;-5.02,5.8,;-5.54,7.18,;-7.08,7.12,;-7.51,5.61,;-8.93,5.03,;-6.22,4.78,;-2.25,6.26,;-2.25,8.29,;-3.6,9.03,;-4.96,8.26,;-6.28,8.97,;-3.57,10.57,;-2.25,11.31,;-.92,10.54,;-.92,9.03,;.4,8.26,;1.79,9.06,;5.54,5.52,;5.6,7.06,;6.9,7.8,;8.25,7.06,;9.57,7.8,;8.25,5.49,;6.9,4.72,)|

BDBM507498

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cn1 |r,wU:2.1,(3.08,1.64,;4.36,2.45,;4.39,4.02,;3.02,4.74,;1.67,3.99,;2.08,2.49,;.58,2.89,;.58,5.08,;-.89,4.61,;-1.36,3.14,;-2.93,3.14,;-3.39,4.58,;-4.93,5.05,;-5.46,6.43,;-6.99,6.36,;-7.43,4.86,;-8.9,4.3,;-6.11,4.02,;-2.14,5.52,;-2.14,7.55,;-.83,8.3,;.55,7.52,;1.92,8.3,;-.83,9.84,;-2.17,10.59,;-3.46,9.84,;-3.49,8.3,;-4.86,7.52,;-6.21,8.27,;5.67,4.77,;5.74,6.33,;7.02,7.05,;8.43,6.3,;9.74,7.08,;8.4,4.74,;7.05,3.99,)|

BDBM507499

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1ccn(C)n1 |r,wD:17.18,(1.76,-5.23,;.43,-6,;-.9,-5.23,;-.9,-3.69,;-2.24,-2.92,;-3.57,-3.69,;-3.57,-5.23,;-4.9,-6.01,;-6.24,-5.24,;-2.24,-6,;-2.23,-7.54,;-.99,-8.45,;.48,-7.97,;1.56,-9.06,;1.96,-10.55,;.48,-10.15,;2.9,-8.29,;4.23,-9.06,;4.23,-10.6,;5.57,-8.29,;5.57,-6.75,;6.9,-5.98,;8.23,-6.75,;9.57,-5.98,;8.23,-8.29,;6.9,-9.06,;6.9,-10.6,;5.57,-11.37,;8.23,-9.83,;8.23,-11.37,;-1.46,-9.91,;-3,-9.91,;-3.48,-8.45,;-4.85,-8.01,;-5.47,-6.6,;-7,-6.74,;-7.34,-8.24,;-8.75,-8.85,;-6.01,-9.03,)|

BDBM507500

COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(Cl)cc2S(C)(=O)=O)nnc1-c1ccn(C)n1 |r,wU:17.18,(-6.68,8.83,;-5.3,8.11,;-3.96,8.86,;-3.89,10.43,;-2.61,11.14,;-1.24,10.39,;-1.27,8.89,;.11,8.11,;1.52,8.89,;-2.58,8.14,;-2.58,6.11,;-1.33,5.2,;.17,5.67,;1.27,4.58,;.14,3.51,;1.67,3.11,;2.64,5.36,;3.99,4.61,;3.96,3.08,;5.3,5.36,;5.36,6.89,;6.65,7.64,;8.02,6.89,;9.37,7.64,;7.99,5.36,;6.68,4.64,;6.65,3.04,;5.3,2.32,;7.99,3.83,;7.99,2.29,;-1.8,3.76,;-3.36,3.76,;-3.86,5.2,;-5.4,5.64,;-5.93,7.02,;-7.46,6.95,;-7.9,5.48,;-9.37,4.89,;-6.58,4.64,)|

BDBM507501

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cc1S(C)(=O)=O |r,wU:2.1,(2.66,2.18,;3.95,2.98,;3.99,4.52,;2.6,5.26,;1.25,4.52,;.14,3.44,;1.65,3.04,;.17,5.59,;-1.31,5.13,;-1.8,3.66,;-3.37,3.66,;-3.86,5.13,;-5.37,5.56,;-5.92,6.92,;-7.46,6.86,;-7.89,5.38,;-9.37,4.82,;-6.57,4.55,;-2.6,6.02,;-2.57,8.02,;-3.95,8.76,;-5.31,7.99,;-6.66,8.73,;-3.92,10.3,;-2.57,11.04,;-1.25,10.27,;-1.25,8.79,;.11,7.99,;1.49,8.79,;5.31,5.29,;5.34,6.79,;6.69,7.53,;8.02,6.82,;9.37,7.56,;7.99,5.29,;6.66,4.55,;6.63,2.98,;5.34,2.18,;7.99,3.75,;7.99,2.21,)|

BDBM507502

CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC)c1ccc(Cl)cc1S(C)(=O)=O |r,wU:2.1,(2.61,2.01,;3.93,2.79,;3.96,4.35,;2.58,5.07,;1.24,4.32,;1.64,2.85,;.14,3.23,;.14,5.42,;-1.3,4.95,;-1.8,3.48,;-3.36,3.48,;-3.83,4.92,;-5.36,5.39,;-5.86,6.73,;-7.43,6.67,;-7.83,5.2,;-9.27,4.61,;-6.55,4.39,;-2.58,5.82,;-2.55,7.83,;-3.92,8.58,;-5.27,7.8,;-6.61,8.51,;-3.89,10.11,;-2.61,10.83,;-1.24,10.08,;-1.24,8.58,;.11,7.8,;1.49,8.58,;5.27,5.11,;5.3,6.61,;6.58,7.36,;7.96,6.64,;9.27,7.36,;7.93,5.07,;6.61,4.35,;6.58,2.79,;5.24,2.07,;7.93,3.54,;7.93,2.04,)|

BDBM507503

CCS(=O)(=O)N(CC[Si](C)(C)C)c1nnc2-c3cc([C@H](OOc4cccc(OC)c4-n12)c1ccc(Cl)cc1S(C)(=O)=O)n(C)n3 |r|

BDBM507504

COc1ccc(Br)cc1-n1c(NS(=O)(=O)Cc2ccc(Cl)cc2)nnc1-c1cccs1 |(3.23,2.61,;1.72,2.14,;.62,3.27,;1.08,4.72,;.07,5.85,;-1.44,5.55,;-2.59,6.51,;-1.91,4.06,;-.89,2.97,;-1.39,1.46,;-.51,.25,;1.08,.19,;1.85,-1.15,;1.85,-2.69,;.34,-1.54,;3.42,-1.13,;4.16,-2.44,;3.42,-3.76,;4.16,-5.11,;5.73,-5.13,;6.49,-6.51,;6.47,-3.76,;5.73,-2.47,;-1.39,-1.04,;-2.87,-.58,;-2.84,1.02,;-4.13,1.92,;-4.1,3.46,;-5.59,3.93,;-6.49,2.69,;-5.59,1.4,)|

BDBM507505

CCOC(=O)c1ccc(OC)c(c1)-n1c(N)nnc1-c1cccs1 |(-4.83,3.61,;-3.32,3.94,;-2.29,2.8,;-.83,3.1,;-.31,4.59,;.23,1.99,;1.72,2.29,;2.75,1.18,;2.26,-.28,;3.32,-1.45,;4.83,-1.02,;.77,-.61,;-.23,.53,;.31,-2.07,;1.18,-3.32,;2.75,-3.34,;.31,-4.59,;-1.15,-4.1,;-1.15,-2.56,;-2.42,-1.66,;-2.4,-.12,;-3.86,.37,;-4.72,-.93,;-3.86,-2.15,)|

BDBM507506

COc1ccccc1-n1c(NS(=O)(=O)Cc2ccc(Cl)cc2)nnc1-c1cccs1 |(3.23,2.92,;1.72,2.46,;.62,3.61,;1.08,5.07,;.04,6.22,;-1.44,5.92,;-1.91,4.43,;-.89,3.31,;-1.39,1.77,;-.51,.59,;1.08,.54,;1.85,-.84,;2.24,-2.32,;.34,-1.22,;3.42,-.81,;4.16,-2.13,;3.42,-3.47,;4.16,-4.79,;5.72,-4.82,;6.49,-6.22,;6.49,-3.47,;5.72,-2.16,;-1.39,-.73,;-2.84,-.26,;-2.84,1.33,;-4.16,2.27,;-4.1,3.8,;-5.59,4.27,;-6.49,3.03,;-5.59,1.72,)|

BDBM507507

COc1ccccc1-n1c(NS(=O)(=O)CCC(F)(F)F)nnc1-c1cccs1 |(2.05,1.73,;.7,.91,;-.67,1.73,;-.67,3.24,;-1.99,3.99,;-3.34,3.24,;-3.34,1.7,;-1.99,.96,;-1.99,-1.1,;-.73,-2.01,;.73,-1.51,;1.83,-2.64,;2.6,-3.99,;1.06,-3.99,;3.18,-1.84,;4.52,-2.6,;5.84,-1.81,;7.17,-1.03,;5.06,-.49,;6.63,-3.14,;-1.22,-3.46,;-2.79,-3.46,;-3.26,-2.01,;-4.74,-1.48,;-5.18,-.05,;-6.75,-.05,;-7.22,-1.54,;-5.98,-2.45,)|

BDBM507508

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-9.83,-1.53,;-8.51,-2.36,;-7.19,-1.74,;-6.86,-.23,;-5.38,-.07,;-4.73,-1.42,;-5.83,-2.47,;-3.24,-1.72,;-2.59,-3.12,;-1.05,-2.93,;-.76,-1.42,;.57,-.69,;1.86,-1.47,;1.03,-2.74,;2.73,-2.74,;3.19,-.72,;3.21,.82,;4.54,-1.47,;4.48,-3.04,;5.83,-3.85,;5.81,-.74,;5.83,.8,;7.1,1.58,;8.48,.8,;9.83,1.58,;8.46,-.74,;7.13,-1.55,;-2.11,-.69,;-2.3,.85,;-3.73,1.45,;-5.13,.93,;-5.81,2.36,;-3.86,2.96,;-2.65,3.85,;-1.27,3.28,;-1.08,1.8,;.32,1.15,;1.81,1.69,)|

BDBM507509

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-9.96,-1.9,;-8.62,-2.75,;-7.28,-2.12,;-6.95,-.62,;-5.44,-.45,;-4.81,-1.76,;-5.91,-2.86,;-3.26,-2.12,;-2.63,-3.49,;-1.09,-3.3,;-.77,-1.79,;.55,-1.05,;1.89,-1.85,;1.04,-3.13,;2.76,-3.1,;3.2,-1.08,;3.26,.42,;4.57,-1.87,;4.54,-3.41,;5.88,-1.11,;5.91,.42,;7.25,1.22,;8.59,.42,;9.96,1.14,;8.56,-1.14,;7.22,-1.93,;-2.13,-1.05,;-2.3,.48,;-3.77,1.08,;-5.22,.56,;-5.88,1.98,;-3.91,2.59,;-2.68,3.49,;-1.29,2.89,;-1.09,1.41,;.33,.78,;1.83,1.3,)|

BDBM507510

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-9.95,-1.87,;-8.62,-2.75,;-7.27,-2.12,;-6.95,-.62,;-5.44,-.45,;-4.79,-1.82,;-5.91,-2.86,;-3.25,-2.12,;-2.63,-3.49,;-1.09,-3.32,;-.77,-1.79,;.55,-1.05,;1.89,-1.85,;1.04,-3.13,;2.76,-3.1,;3.2,-1.11,;3.25,.42,;4.57,-1.87,;4.54,-3.4,;5.88,-1.13,;7.22,-1.93,;8.56,-1.13,;8.59,.42,;9.95,1.19,;7.25,1.22,;5.91,.4,;-2.13,-1.05,;-2.3,.48,;-3.77,1.08,;-5.22,.56,;-5.85,1.98,;-3.91,2.58,;-2.71,3.49,;-1.29,2.89,;-1.09,1.41,;.33,.78,;1.83,1.3,)|

BDBM507511

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@](O)(c2ncc(C)cn2)C(F)(F)F)n1-c1c(OC)cccc1OC |r,wU:17.18,wD:17.17,15.16,(-1.89,14.44,;-2.51,13.03,;-1.61,11.79,;-.07,11.79,;.41,10.32,;-.84,9.42,;-2.08,10.32,;-.84,7.88,;-2.08,6.97,;-1.61,5.51,;-.07,5.51,;.84,4.26,;.21,2.85,;-1.2,3.48,;1.62,2.23,;-.42,1.45,;-1.95,1.29,;.49,.2,;1.73,1.11,;-.76,-.7,;-.6,-2.23,;-1.84,-3.14,;-3.25,-2.51,;-4.49,-3.42,;-3.41,-.98,;-2.16,-.08,;1.39,-1.04,;2.3,-2.29,;.15,-1.95,;2.64,-.14,;.41,6.97,;1.87,7.45,;2.19,8.95,;1.05,9.98,;1.37,11.49,;3.66,9.43,;4.8,8.4,;4.48,6.89,;3.02,6.42,;2.7,4.91,;3.84,3.88,)|

BDBM507512

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-9.88,4.22,;-8.55,3.38,;-7.19,4.01,;-6.9,5.52,;-5.37,5.69,;-4.74,4.33,;-5.86,3.26,;-3.24,4.04,;-2.57,2.63,;-1.04,2.8,;-.75,4.33,;.58,5.08,;1.88,4.3,;1.04,3,;2.74,3.03,;3.21,5.05,;3.24,6.58,;4.56,4.27,;4.53,2.71,;5.86,1.9,;5.89,5.02,;7.19,4.22,;8.52,5,;8.55,6.56,;9.88,7.31,;7.19,7.36,;5.89,6.56,;-2.11,5.08,;-2.31,6.61,;-3.73,7.22,;-5.17,6.7,;-5.81,8.14,;-3.9,8.72,;-2.66,9.65,;-1.27,9.07,;-1.1,7.57,;.35,6.93,;1.82,7.45,)|

BDBM507513

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)n[nH]2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,4.4,(4.93,-4.64,;4.93,-3.08,;3.61,-2.31,;3.64,-.74,;2.29,.03,;2.32,1.57,;.95,-.74,;1.83,-2,;.1,-2,;-.37,.05,;-1.72,-.69,;-2.02,-2.2,;-3.56,-2.39,;-4.22,-.99,;-5.75,-.66,;-6.38,.69,;-7.92,.52,;-8.99,1.59,;-8.22,-1.02,;-6.85,-1.76,;-3.09,.05,;-3.28,1.59,;-4.71,2.22,;-6.17,1.68,;-6.8,3.13,;-4.85,3.73,;-3.64,4.64,;-2.24,4.04,;-2.05,2.53,;-.59,1.89,;.89,2.44,;4.98,,;6.3,-.8,;7.65,,;7.68,1.54,;8.99,2.31,;6.25,2.33,;4.98,1.54,)|

BDBM507514

CCn1ccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:17.18,15.16,(-9.9,-1.58,;-8.65,-2.4,;-7.26,-1.77,;-6.96,-.27,;-5.43,-.08,;-4.78,-1.45,;-5.89,-2.54,;-3.27,-1.75,;-2.62,-3.17,;-1.06,-2.97,;-.79,-1.45,;.55,-.71,;1.88,-1.5,;1.04,-2.78,;2.76,-2.78,;3.19,-.74,;3.25,.82,;4.56,-1.5,;4.53,-3.08,;5.87,-3.9,;5.87,-.76,;7.2,-1.58,;8.54,-.76,;8.57,.79,;9.9,1.56,;7.2,1.58,;5.89,.79,;-2.13,-.71,;-2.32,.85,;-3.77,1.45,;-5.18,.93,;-5.87,2.37,;-3.9,2.97,;-2.67,3.9,;-1.28,3.3,;-1.09,1.8,;.33,1.15,;1.83,1.69,)|

BDBM507515

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(CC)n2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.2,4.4,(5.85,-4.64,;5.85,-3.05,;4.53,-2.29,;4.56,-.73,;3.22,.04,;3.25,1.57,;1.88,-.73,;2.75,-1.99,;1,-1.99,;.53,.1,;-.78,-.64,;-1.11,-2.18,;-2.64,-2.37,;-3.3,-.97,;-4.81,-.67,;-5.46,.7,;-6.97,.53,;-7.3,-.97,;-8.67,-1.63,;-9.93,-.73,;-5.93,-1.74,;-2.15,.07,;-2.34,1.6,;-3.79,2.2,;-5.25,1.68,;-5.88,3.14,;-3.93,3.74,;-2.73,4.64,;-1.3,4.04,;-1.14,2.56,;.31,1.9,;1.82,2.45,;5.9,.01,;7.22,-.78,;8.56,.01,;8.59,1.55,;9.93,2.31,;7.16,2.34,;5.88,1.55,)|

BDBM507516

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2c(C)nc3ccccn23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.13,6.78,;.26,5.51,;-1.27,5.63,;-2.16,4.34,;-3.16,5.66,;-2.06,2.69,;-3.66,2.97,;-.5,3.01,;-1.71,1.03,;-1.15,-.6,;.31,-.12,;1.22,-1.37,;.31,-2.61,;.79,-4.08,;-.12,-5.32,;-1.85,-5.4,;.79,-6.57,;2.25,-6.09,;3.59,-6.86,;4.92,-6.09,;4.92,-4.55,;3.59,-3.78,;2.25,-4.55,;-1.15,-2.14,;-2.4,-3.04,;-3.8,-2.41,;-5.1,-1.42,;-6.4,-.57,;-5.05,-3.32,;-4.89,-4.85,;-3.48,-5.48,;-2.24,-4.57,;-1.46,-6.26,;-1.59,-7.92,;-1.94,7.02,;-3.47,7.15,;-4.13,8.54,;-3.26,9.8,;-3.92,11.19,;-1.72,9.68,;-1.06,8.29,)|

BDBM507517

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.55,4.02,;.14,3.4,;-1.1,4.3,;-2.51,3.68,;-3.76,4.58,;-2.67,2.15,;-4.2,2.31,;-1.14,1.98,;-2.83,.61,;-1.59,-.29,;-.12,.18,;.78,-1.06,;-.12,-2.31,;.35,-3.77,;-.55,-5.02,;.35,-6.26,;1.82,-5.79,;3.15,-6.56,;4.49,-5.79,;4.49,-4.25,;3.15,-3.48,;1.82,-4.25,;-1.59,-1.83,;-2.83,-2.74,;-4.24,-2.11,;-4.4,-.58,;-5.81,.05,;-5.49,-3.02,;-5.33,-4.55,;-3.92,-5.17,;-2.67,-4.27,;-1.27,-4.89,;-1.1,-6.43,;-.94,5.84,;-2.19,6.74,;-2.03,8.27,;-.62,8.9,;-.46,10.43,;.62,7.99,;.46,6.46,)|

BDBM507518

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3ccc(Cl)cc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.24,4.71,;-.17,4.09,;-1.42,4.99,;-2.82,4.36,;-4.07,5.27,;-2.99,2.83,;-4.52,2.99,;-1.45,2.67,;-3.15,1.3,;-1.9,.4,;-.44,.87,;.47,-.37,;-.44,-1.62,;.04,-3.08,;-.87,-4.33,;.04,-5.58,;1.5,-5.1,;2.84,-5.87,;4.17,-5.1,;4.17,-3.56,;5.51,-2.79,;2.84,-2.79,;1.5,-3.56,;-1.9,-1.14,;-3.15,-2.05,;-4.55,-1.42,;-4.71,.11,;-6.12,.74,;-5.8,-2.33,;-5.64,-3.86,;-4.23,-4.49,;-2.99,-3.58,;-1.58,-4.21,;-1.42,-5.74,;-1.26,6.52,;-2.5,7.43,;-2.34,8.96,;-.93,9.59,;-.77,11.12,;.31,8.68,;.15,7.15,)|

BDBM507519

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2=CNC3N=CC=CC23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,c:17,19,t:13,(1.55,4.02,;.14,3.4,;-1.1,4.3,;-2.51,3.68,;-3.76,4.58,;-2.67,2.15,;-4.2,2.31,;-1.14,1.98,;-2.83,.61,;-1.59,-.29,;-.12,.18,;.78,-1.06,;-.12,-2.31,;.35,-3.77,;-.55,-5.02,;.35,-6.26,;1.82,-5.79,;3.15,-6.56,;4.49,-5.79,;4.49,-4.25,;3.15,-3.48,;1.82,-4.25,;-1.59,-1.83,;-2.83,-2.74,;-4.24,-2.11,;-4.4,-.58,;-5.81,.05,;-5.49,-3.02,;-5.33,-4.55,;-3.92,-5.17,;-2.67,-4.27,;-1.27,-4.89,;-1.1,-6.43,;-.94,5.84,;-2.19,6.74,;-2.03,8.27,;-.62,8.9,;-.46,10.43,;.62,7.99,;.46,6.46,)|

BDBM507520

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccc(Br)cc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.24,4.71,;-.17,4.09,;-1.42,4.99,;-2.82,4.36,;-4.07,5.27,;-2.99,2.83,;-4.52,2.99,;-1.45,2.67,;-3.15,1.3,;-1.9,.4,;-.44,.87,;.47,-.37,;-.44,-1.62,;.04,-3.08,;-.87,-4.33,;.04,-5.58,;1.5,-5.1,;2.84,-5.87,;4.17,-5.1,;4.17,-3.56,;5.51,-2.79,;2.84,-2.79,;1.5,-3.56,;-1.9,-1.14,;-3.15,-2.05,;-4.55,-1.42,;-4.71,.11,;-6.12,.74,;-5.8,-2.33,;-5.64,-3.86,;-4.23,-4.49,;-2.99,-3.58,;-1.58,-4.21,;-1.42,-5.74,;-1.26,6.52,;-2.5,7.43,;-2.34,8.96,;-.93,9.59,;-.77,11.12,;.31,8.68,;.15,7.15,)|

BDBM507521

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.55,4.02,;.14,3.4,;-1.1,4.3,;-2.51,3.68,;-3.76,4.58,;-2.67,2.15,;-4.2,2.31,;-1.14,1.98,;-2.83,.61,;-1.59,-.29,;-.12,.18,;.78,-1.06,;-.12,-2.31,;.35,-3.77,;-.55,-5.02,;.35,-6.26,;1.82,-5.79,;3.15,-6.56,;4.49,-5.79,;4.49,-4.25,;3.15,-3.48,;1.82,-4.25,;-1.59,-1.83,;-2.83,-2.74,;-4.24,-2.11,;-4.4,-.58,;-5.81,.05,;-5.49,-3.02,;-5.33,-4.55,;-3.92,-5.17,;-2.67,-4.27,;-1.27,-4.89,;-1.1,-6.43,;-.94,5.84,;-2.19,6.74,;-2.03,8.27,;-.62,8.9,;-.46,10.43,;.62,7.99,;.46,6.46,)|

BDBM507522

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3ccc(C)cc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(1.24,4.71,;-.17,4.09,;-1.42,4.99,;-2.82,4.36,;-4.07,5.27,;-2.99,2.83,;-4.52,2.99,;-1.45,2.67,;-3.15,1.3,;-1.9,.4,;-.44,.87,;.47,-.37,;-.44,-1.62,;.04,-3.08,;-.87,-4.33,;.04,-5.58,;1.5,-5.1,;2.84,-5.87,;4.17,-5.1,;4.17,-3.56,;5.51,-2.79,;2.84,-2.79,;1.5,-3.56,;-1.9,-1.14,;-3.15,-2.05,;-4.55,-1.42,;-4.71,.11,;-6.12,.74,;-5.8,-2.33,;-5.64,-3.86,;-4.23,-4.49,;-2.99,-3.58,;-1.58,-4.21,;-1.42,-5.74,;-1.26,6.52,;-2.5,7.43,;-2.34,8.96,;-.93,9.59,;-.77,11.12,;.31,8.68,;.15,7.15,)|

BDBM507523

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccnc3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-4.28,6.1,;-3.38,4.85,;-1.85,5.01,;-.94,3.77,;.59,3.93,;-1.57,2.36,;-.16,1.73,;-2.97,2.99,;-2.19,.95,;-1.29,-.29,;.25,-.29,;.73,-1.76,;-.52,-2.66,;-.52,-4.2,;-1.85,-4.97,;-1.85,-6.51,;-.52,-7.28,;.81,-6.51,;2.15,-7.28,;3.48,-6.51,;3.48,-4.97,;2.15,-4.2,;.81,-4.97,;-1.76,-1.76,;-3.23,-2.23,;-4.37,-1.2,;-4.05,.3,;-5.2,1.33,;-5.84,-1.68,;-6.16,-3.19,;-5.01,-4.22,;-3.55,-3.74,;-2.41,-4.77,;-2.73,-6.28,;-1.22,6.42,;-2.13,7.66,;-1.5,9.07,;.03,9.23,;.66,10.64,;.94,7.99,;.31,6.58,)|

BDBM507524

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nnc3ccc(C)cn23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.24,4.71,;-.17,4.09,;-1.42,4.99,;-2.82,4.36,;-4.07,5.27,;-2.99,2.83,;-4.52,2.99,;-1.45,2.67,;-3.15,1.3,;-1.9,.4,;-.44,.87,;.47,-.37,;-.44,-1.62,;.04,-3.08,;-.86,-4.33,;.04,-5.58,;1.5,-5.1,;2.84,-5.87,;4.17,-5.1,;4.17,-3.56,;5.51,-2.79,;2.84,-2.79,;1.5,-3.56,;-1.9,-1.14,;-3.15,-2.05,;-4.55,-1.42,;-4.71,.11,;-6.12,.74,;-5.8,-2.33,;-5.64,-3.86,;-4.23,-4.49,;-2.99,-3.58,;-1.58,-4.21,;-1.42,-5.74,;-1.26,6.52,;-2.5,7.43,;-2.34,8.96,;-.93,9.59,;-.77,11.12,;.31,8.68,;.15,7.15,)|

BDBM507525

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2=CNC3N=CC=CC23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,c:17,19,t:13,(1.55,4.02,;.14,3.4,;-1.1,4.3,;-2.51,3.68,;-3.76,4.58,;-2.67,2.15,;-4.2,2.31,;-1.14,1.98,;-2.83,.61,;-1.59,-.29,;-.12,.18,;.78,-1.06,;-.12,-2.31,;.35,-3.77,;-.55,-5.02,;.35,-6.26,;1.82,-5.79,;3.15,-6.56,;4.49,-5.79,;4.49,-4.25,;3.15,-3.48,;1.82,-4.25,;-1.59,-1.83,;-2.83,-2.74,;-4.24,-2.11,;-4.4,-.58,;-5.81,.05,;-5.49,-3.02,;-5.33,-4.55,;-3.92,-5.17,;-2.67,-4.27,;-1.27,-4.89,;-1.1,-6.43,;-.94,5.84,;-2.19,6.74,;-2.03,8.27,;-.62,8.9,;-.46,10.43,;.62,7.99,;.46,6.46,)|

BDBM507526

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccccc23)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.53,3.88,;.13,3.25,;-1.12,4.15,;-2.53,3.53,;-3.77,4.43,;-2.69,2,;-4.22,2.16,;-1.16,1.84,;-2.85,.47,;-1.6,-.44,;-.14,.04,;.77,-1.21,;-.14,-2.46,;.34,-3.92,;-.57,-5.17,;.34,-6.41,;1.8,-5.94,;3.14,-6.71,;4.47,-5.94,;4.47,-4.4,;3.14,-3.63,;1.8,-4.4,;-1.6,-1.98,;-2.85,-2.89,;-4.26,-2.26,;-4.42,-.73,;-5.82,-.1,;-5.5,-3.16,;-5.34,-4.7,;-3.93,-5.32,;-2.69,-4.42,;-1.28,-5.04,;-1.12,-6.57,;-.96,5.69,;-2.2,6.59,;-2.04,8.12,;-.64,8.75,;-.48,10.28,;.61,7.84,;.45,6.31,)|

BDBM507527

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.56,3.8,;.16,3.17,;-1.09,4.08,;-2.49,3.45,;-3.74,4.36,;-2.66,1.92,;-4.19,2.08,;-1.12,1.76,;-2.82,.39,;-1.57,-.52,;-.11,-.04,;.8,-1.29,;-.11,-2.53,;.37,-4,;-.54,-5.24,;.37,-6.49,;1.83,-6.01,;3.17,-6.78,;4.5,-6.01,;4.5,-4.47,;3.17,-3.7,;1.83,-4.47,;-1.57,-2.06,;-2.82,-2.96,;-2.66,-4.49,;-1.25,-5.12,;-1.09,-6.65,;-3.9,-5.4,;-5.31,-4.77,;-5.47,-3.24,;-4.22,-2.33,;-4.38,-.8,;-3,-.13,;-.93,5.61,;-2.17,6.52,;-2.01,8.05,;-.61,8.67,;-.44,10.21,;.64,7.77,;.48,6.24,)|

BDBM507528

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3ccc(Cl)cc23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.36,4.33,;-.05,3.7,;-1.29,4.61,;-2.7,3.98,;-3.95,4.89,;-2.86,2.45,;-4.39,2.61,;-1.33,2.29,;-3.02,.92,;-1.78,.01,;-.31,.49,;.59,-.76,;-.31,-2,;.16,-3.47,;-.74,-4.71,;.16,-5.96,;1.63,-5.48,;2.96,-6.25,;4.3,-5.48,;4.3,-3.94,;5.63,-3.17,;2.96,-3.17,;1.63,-3.94,;-1.78,-1.53,;-3.02,-2.43,;-4.43,-1.8,;-4.59,-.27,;-6,.35,;-5.67,-2.71,;-5.51,-4.24,;-4.11,-4.87,;-2.86,-3.96,;-1.45,-4.59,;-1.56,-6.12,;-1.13,6.14,;-2.38,7.05,;-2.22,8.58,;-.81,9.2,;-.65,10.74,;.44,8.3,;.27,6.77,)|

BDBM507529

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.56,3.8,;.16,3.17,;-1.09,4.08,;-2.49,3.45,;-3.74,4.36,;-2.66,1.92,;-4.19,2.08,;-1.12,1.76,;-2.82,.39,;-1.57,-.52,;-.11,-.04,;.8,-1.29,;-.11,-2.53,;.37,-4,;-.54,-5.24,;.37,-6.49,;1.83,-6.01,;3.17,-6.78,;4.5,-6.01,;4.5,-4.47,;3.17,-3.7,;1.83,-4.47,;-1.57,-2.06,;-2.82,-2.96,;-2.66,-4.49,;-1.25,-5.12,;-1.09,-6.65,;-3.9,-5.4,;-5.31,-4.77,;-5.47,-3.24,;-4.22,-2.33,;-4.38,-.8,;-3,-.13,;-.93,5.61,;-2.17,6.52,;-2.01,8.05,;-.61,8.67,;-.44,10.21,;.64,7.77,;.48,6.24,)|

BDBM507530

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(on2)C2CC2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(1.22,6.02,;1.22,4.48,;2.55,3.71,;2.55,2.17,;3.88,1.4,;1.22,1.4,;.45,2.74,;1.99,.07,;-.12,.63,;-.12,-.91,;1.13,-1.81,;.65,-3.28,;-.89,-3.28,;-1.79,-4.52,;-1.32,-5.99,;-2.56,-6.89,;-3.81,-5.99,;-3.33,-4.52,;-2.56,-8.43,;-1.79,-9.76,;-3.33,-9.76,;-1.36,-1.81,;-2.83,-1.33,;-3.97,-2.37,;-3.65,-3.87,;-4.8,-4.9,;-5.44,-1.89,;-5.76,-.38,;-4.61,.65,;-3.15,.17,;-2,1.2,;-.64,.48,;3.88,4.48,;3.88,6.02,;5.22,6.79,;6.55,6.02,;7.88,6.79,;6.55,4.48,;5.22,3.71,)|

BDBM507531

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)on2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(5.74,.23,;4.28,-.24,;3.96,-1.75,;2.49,-2.22,;2.17,-3.73,;1.35,-1.19,;2.38,-.05,;.32,-2.34,;.21,-.16,;-1.26,-.64,;-1.74,-2.1,;-3.28,-2.1,;-3.75,-.64,;-5.22,-.16,;-6.46,-1.07,;-7.71,-.16,;-9.17,-.64,;-7.23,1.3,;-5.69,1.3,;-2.51,.27,;-2.51,1.81,;-3.84,2.58,;-5.17,1.81,;-6.51,2.58,;-3.84,4.12,;-2.51,4.89,;-1.17,4.12,;-1.17,2.58,;.16,1.81,;-.11,.29,;5.1,-2.78,;6.57,-2.3,;7.71,-3.33,;7.39,-4.84,;8.54,-5.87,;5.93,-5.31,;4.78,-4.28,)|

BDBM507532

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1n[nH]c2ccccc12 |r,wU:16.17,18.19,(1.16,2.32,;-.17,1.55,;-1.5,2.32,;-1.55,3.88,;-2.88,4.65,;-4.22,3.88,;-4.22,2.34,;-5.55,1.57,;-6.73,2.56,;-2.88,1.57,;-2.88,.03,;-1.64,-.87,;-.15,-.47,;1.18,-1.24,;-.15,-2.01,;2.52,-2.01,;2.52,-.47,;2.52,1.07,;3.85,-1.24,;3.85,-2.78,;5.18,-.47,;6.52,-1.24,;7.85,-.47,;7.85,1.07,;9.18,1.84,;6.52,1.84,;5.18,1.07,;-2.11,-2.34,;-3.65,-2.34,;-4.13,-.87,;-5.67,-.87,;-6.58,.37,;-8.04,-.1,;-8.04,-1.64,;-9.18,-2.67,;-8.86,-4.18,;-7.4,-4.65,;-6.26,-3.62,;-6.58,-2.12,)|

BDBM507533

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1n[nH]c2ccccc12 |r,wU:16.17,18.19,(1.16,2.32,;-.17,1.55,;-1.5,2.32,;-1.55,3.88,;-2.88,4.65,;-4.22,3.88,;-4.22,2.34,;-5.55,1.57,;-6.73,2.56,;-2.88,1.57,;-2.88,.03,;-1.64,-.87,;-.15,-.47,;1.18,-1.24,;-.15,-2.01,;2.52,-2.01,;2.52,-.47,;2.52,1.07,;3.85,-1.24,;3.85,-2.78,;5.18,-.47,;6.52,-1.24,;7.85,-.47,;7.85,1.07,;9.18,1.84,;6.52,1.84,;5.18,1.07,;-2.11,-2.34,;-3.65,-2.34,;-4.13,-.87,;-5.67,-.87,;-6.58,.37,;-8.04,-.1,;-8.04,-1.64,;-9.18,-2.67,;-8.86,-4.18,;-7.4,-4.65,;-6.26,-3.62,;-6.58,-2.12,)|

BDBM507534

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2c(C)nc3ccccn23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.68,5.37,;.42,4.48,;-.98,5.12,;-2.26,4.21,;-3.55,5.2,;-2.43,2.6,;-4.06,2.9,;-.77,2.74,;-2.17,.97,;-1.38,-.51,;.08,-.04,;.99,-1.28,;.08,-2.53,;.56,-3.99,;-.35,-5.24,;-2.01,-4.67,;.56,-6.49,;2.02,-6.01,;3.35,-6.78,;4.69,-6.01,;4.69,-4.47,;3.35,-3.7,;2.02,-4.47,;-1.38,-2.05,;-2.63,-2.96,;-4.04,-2.33,;-5.23,-1.15,;-6.48,-.21,;-5.28,-3.24,;-5.12,-4.77,;-3.71,-5.4,;-2.68,-4.43,;-1.64,-5.96,;-1.69,-7.71,;-1.12,6.65,;-2.52,7.29,;-2.67,8.83,;-1.41,9.72,;-1.56,11.25,;-.01,9.08,;.13,7.55,)|

BDBM507535

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1n[nH]c2ccccc12 |r,wU:16.17,18.19,(1.16,2.32,;-.17,1.55,;-1.5,2.32,;-1.55,3.88,;-2.88,4.65,;-4.22,3.88,;-4.22,2.34,;-5.55,1.57,;-6.73,2.56,;-2.88,1.57,;-2.88,.03,;-1.64,-.87,;-.15,-.47,;1.18,-1.24,;-.15,-2.01,;2.52,-2.01,;2.52,-.47,;2.52,1.07,;3.85,-1.24,;3.85,-2.78,;5.18,-.47,;6.52,-1.24,;7.85,-.47,;7.85,1.07,;9.18,1.84,;6.52,1.84,;5.18,1.07,;-2.11,-2.34,;-3.65,-2.34,;-4.13,-.87,;-5.67,-.87,;-6.58,.37,;-8.04,-.1,;-8.04,-1.64,;-9.18,-2.67,;-8.86,-4.18,;-7.4,-4.65,;-6.26,-3.62,;-6.58,-2.12,)|

BDBM507536

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(Cl)cn2)nnc1-c1n[nH]c2ccccc12 |r,wD:16.17,18.19,(1.16,2.32,;-.17,1.55,;-1.5,2.32,;-1.55,3.88,;-2.88,4.65,;-4.22,3.88,;-4.22,2.34,;-5.55,1.57,;-6.73,2.56,;-2.88,1.57,;-2.88,.03,;-1.64,-.87,;-.15,-.47,;1.18,-1.24,;-.15,-2.01,;2.52,-2.01,;2.52,-.47,;2.52,1.07,;3.85,-1.24,;3.85,-2.78,;5.18,-.47,;6.52,-1.24,;7.85,-.47,;7.85,1.07,;9.18,1.84,;6.52,1.84,;5.18,1.07,;-2.11,-2.34,;-3.65,-2.34,;-4.13,-.87,;-5.67,-.87,;-6.58,.37,;-8.04,-.1,;-8.04,-1.64,;-9.18,-2.67,;-8.86,-4.18,;-7.4,-4.65,;-6.26,-3.62,;-6.58,-2.12,)|

BDBM507537

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(C)cn2)nnc1-c1n[nH]c2ccccc12 |r,wD:16.17,18.19,(1.16,2.32,;-.17,1.55,;-1.5,2.32,;-1.55,3.88,;-2.88,4.65,;-4.22,3.88,;-4.22,2.34,;-5.55,1.57,;-6.73,2.56,;-2.88,1.57,;-2.88,.03,;-1.64,-.87,;-.15,-.47,;1.18,-1.24,;-.15,-2.01,;2.52,-2.01,;2.52,-.47,;2.52,1.07,;3.85,-1.24,;3.85,-2.78,;5.18,-.47,;6.52,-1.24,;7.85,-.47,;7.85,1.07,;9.18,1.84,;6.52,1.84,;5.18,1.07,;-2.11,-2.34,;-3.65,-2.34,;-4.13,-.87,;-5.67,-.87,;-6.58,.37,;-8.04,-.1,;-8.04,-1.64,;-9.18,-2.67,;-8.86,-4.18,;-7.4,-4.65,;-6.26,-3.62,;-6.58,-2.12,)|

BDBM507538

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1nn(C)c2ccc(C)cc12 |r,wU:16.17,18.19,(1.22,3.07,;-.12,2.3,;-1.45,3.07,;-1.5,4.64,;-2.83,5.41,;-4.17,4.64,;-4.17,3.1,;-5.5,2.33,;-6.68,3.32,;-2.83,2.33,;-2.83,.79,;-1.59,-.12,;-.1,.28,;1.23,-.49,;-.1,-1.26,;2.57,-1.26,;2.57,.28,;2.57,1.82,;3.9,-.49,;3.9,-2.03,;5.23,.28,;6.57,-.49,;7.9,.28,;7.9,1.82,;9.24,2.59,;6.57,2.59,;5.23,1.82,;-2.06,-1.58,;-3.6,-1.58,;-4.08,-.12,;-5.62,-.12,;-6.52,1.13,;-7.99,.65,;-9.24,1.56,;-7.99,-.89,;-9.13,-1.92,;-8.81,-3.42,;-7.35,-3.9,;-7.03,-5.41,;-6.2,-2.87,;-6.52,-1.36,)|

BDBM507539

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1nn(C)c2ccc(C)cc12 |r,wU:16.17,18.19,(1.22,3.07,;-.12,2.3,;-1.45,3.07,;-1.5,4.64,;-2.83,5.41,;-4.17,4.64,;-4.17,3.1,;-5.5,2.33,;-6.68,3.32,;-2.83,2.33,;-2.83,.79,;-1.59,-.12,;-.1,.28,;1.23,-.49,;-.1,-1.26,;2.57,-1.26,;2.57,.28,;2.57,1.82,;3.9,-.49,;3.9,-2.03,;5.23,.28,;6.57,-.49,;7.9,.28,;7.9,1.82,;9.24,2.59,;6.57,2.59,;5.23,1.82,;-2.06,-1.58,;-3.6,-1.58,;-4.08,-.12,;-5.62,-.12,;-6.52,1.13,;-7.99,.65,;-9.24,1.56,;-7.99,-.89,;-9.13,-1.92,;-8.81,-3.42,;-7.35,-3.9,;-7.03,-5.41,;-6.2,-2.87,;-6.52,-1.36,)|

BDBM507540

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ncnc3cc[nH]c23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(1.78,5.73,;.88,4.48,;-.66,4.65,;-1.56,3.4,;-3.09,3.56,;-.93,1.99,;-2.34,1.37,;.47,2.62,;-.31,.59,;-1.21,-.66,;-2.75,-.66,;-3.23,-2.13,;-1.98,-3.03,;-1.98,-4.57,;-.65,-5.34,;-.65,-6.88,;-1.98,-7.65,;-3.32,-6.88,;-4.78,-7.36,;-5.69,-6.11,;-4.78,-4.86,;-3.32,-5.34,;-.74,-2.13,;.73,-2.6,;1.05,-4.11,;-.1,-5.14,;.22,-6.64,;2.51,-4.58,;3.66,-3.55,;3.34,-2.05,;1.87,-1.57,;1.55,-.06,;2.86,.75,;-1.28,6.05,;-2.81,6.21,;-3.44,7.62,;-2.54,8.87,;-3.16,10.27,;-1,8.7,;-.38,7.3,)|

BDBM507541

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ncnc3cc[nH]c23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-4.78,2.84,;-3.25,2.68,;-2.34,3.93,;-.81,3.76,;.1,5.01,;-.18,2.36,;1.22,2.98,;-1.59,1.73,;.44,.95,;-.46,-.29,;-2,-.29,;-2.48,-1.76,;-1.23,-2.66,;-1.23,-4.2,;.1,-4.97,;.1,-6.51,;-1.23,-7.28,;-2.57,-6.51,;-4.03,-6.99,;-4.94,-5.74,;-4.03,-4.5,;-2.57,-4.97,;.01,-1.76,;1.48,-2.24,;1.8,-3.74,;.65,-4.77,;.97,-6.28,;3.26,-4.22,;4.41,-3.19,;4.09,-1.68,;2.62,-1.2,;2.3,.3,;3.61,1.12,;-2.97,5.33,;-4.5,5.49,;-5.13,6.9,;-4.22,8.15,;-4.85,9.55,;-2.69,7.99,;-2.06,6.58,)|

BDBM507542

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nn(C)c3ccccc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-5.8,4.99,;-4.56,4.08,;-3.15,4.71,;-1.9,3.8,;-.5,4.43,;-2.07,2.27,;-.53,2.11,;-3.6,2.43,;-2.23,.74,;-.98,-.17,;.48,.31,;1.39,-.94,;.48,-2.18,;.96,-3.65,;.05,-4.89,;.96,-6.14,;.48,-7.6,;2.42,-5.66,;3.76,-6.43,;5.09,-5.66,;5.09,-4.12,;3.76,-3.35,;2.42,-4.12,;-.98,-1.71,;-2.23,-2.61,;-3.63,-1.99,;-3.79,-.45,;-5.2,.17,;-4.88,-2.89,;-4.72,-4.42,;-3.31,-5.05,;-2.07,-4.14,;-.66,-4.77,;-.5,-6.3,;-2.99,6.24,;-4.24,7.14,;-4.07,8.67,;-2.67,9.3,;-2.51,10.83,;-1.42,8.4,;-1.58,6.86,)|

BDBM507543

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3ccc(F)cc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-5.95,5.47,;-4.7,4.56,;-3.29,5.19,;-2.05,4.28,;-.64,4.91,;-2.21,2.75,;-.68,2.59,;-3.74,2.91,;-2.37,1.22,;-1.12,.31,;.34,.79,;1.25,-.46,;.34,-1.7,;.82,-3.17,;-.09,-4.41,;.82,-5.66,;2.28,-5.18,;3.62,-5.95,;4.95,-5.18,;4.95,-3.64,;6.28,-2.87,;3.62,-2.87,;2.28,-3.64,;-1.12,-1.23,;-2.37,-2.13,;-3.78,-1.51,;-3.94,.03,;-5.34,.65,;-5.02,-2.41,;-4.86,-3.94,;-3.45,-4.57,;-2.21,-3.66,;-.8,-4.29,;-.64,-5.82,;-3.13,6.72,;-4.38,7.62,;-4.22,9.15,;-2.81,9.78,;-2.65,11.31,;-1.56,8.88,;-1.72,7.34,)|

BDBM507544

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1n[nH]c2CCCCc12 |r,wU:16.17,18.19,(-6.8,2.34,;-5.47,1.57,;-4.14,2.34,;-4.14,3.88,;-2.8,4.65,;-1.47,3.88,;-1.47,2.34,;-.13,1.57,;1.2,2.34,;-2.8,1.57,;-2.8,.03,;-1.56,-.87,;-.23,-.11,;1.1,-.88,;-.23,-1.65,;2.43,-1.65,;2.43,-.11,;2.43,1.43,;3.77,-.88,;3.77,-2.42,;5.1,-.11,;6.43,-.88,;7.77,-.11,;7.77,1.43,;9.1,2.2,;6.43,2.2,;5.1,1.43,;-2.03,-2.34,;-3.57,-2.34,;-4.05,-.87,;-5.59,-.87,;-6.49,.37,;-7.96,-.1,;-7.96,-1.64,;-9.1,-2.67,;-8.78,-4.18,;-7.32,-4.65,;-6.17,-3.62,;-6.49,-2.12,)|

BDBM507545

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3ccccc23)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(-5.45,4.42,;-4.21,3.51,;-2.8,4.14,;-1.56,3.23,;-.15,3.86,;-1.72,1.7,;-.19,1.54,;-3.25,1.86,;-1.88,.17,;-.63,-.74,;.83,-.26,;1.74,-1.51,;.83,-2.75,;1.31,-4.22,;.4,-5.46,;1.31,-6.71,;2.77,-6.23,;4.11,-7,;5.44,-6.23,;5.44,-4.69,;4.11,-3.92,;2.77,-4.69,;-.63,-2.28,;-1.88,-3.18,;-3.28,-2.55,;-3.45,-1.02,;-4.85,-.4,;-4.53,-3.46,;-4.37,-4.99,;-2.96,-5.62,;-1.72,-4.71,;-.31,-5.34,;-.42,-6.87,;-2.64,5.67,;-3.89,6.57,;-3.73,8.11,;-2.32,8.73,;-2.16,10.26,;-1.07,7.83,;-1.23,6.3,)|

BDBM507546

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cnn2ccccc12 |r,wU:16.17,18.19,(1.18,2.32,;-.16,1.55,;-1.49,2.32,;-1.54,3.88,;-2.87,4.65,;-4.21,3.88,;-4.21,2.34,;-5.54,1.57,;-6.72,2.56,;-2.87,1.57,;-2.87,.03,;-1.63,-.87,;-.16,-.4,;1.17,-1.17,;-.16,-1.94,;2.5,-1.94,;2.5,-.4,;2.5,1.14,;3.84,-1.17,;3.84,-2.71,;5.17,-.4,;6.51,-1.17,;7.84,-.4,;7.84,1.14,;9.17,1.91,;6.51,1.91,;5.17,1.14,;-2.1,-2.34,;-3.64,-2.34,;-4.12,-.87,;-5.66,-.87,;-6.56,.37,;-8.03,-.1,;-8.03,-1.64,;-9.17,-2.67,;-8.85,-4.18,;-7.39,-4.65,;-6.24,-3.62,;-6.56,-2.12,)|

BDBM507547

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1noc2CCCCc12 |r,wU:16.17,18.19,(-6.8,2.34,;-5.47,1.57,;-4.14,2.34,;-4.14,3.88,;-2.8,4.65,;-1.47,3.88,;-1.47,2.34,;-.13,1.57,;1.2,2.34,;-2.8,1.57,;-2.8,.03,;-1.56,-.87,;-.23,-.11,;1.1,-.88,;-.23,-1.65,;2.43,-1.65,;2.43,-.11,;2.43,1.43,;3.77,-.88,;3.77,-2.42,;5.1,-.11,;6.43,-.88,;7.77,-.11,;7.77,1.43,;9.1,2.2,;6.43,2.2,;5.1,1.43,;-2.03,-2.34,;-3.57,-2.34,;-4.05,-.87,;-5.59,-.87,;-6.49,.37,;-7.96,-.1,;-7.96,-1.64,;-9.1,-2.67,;-8.78,-4.18,;-7.32,-4.65,;-6.17,-3.62,;-6.49,-2.12,)|

BDBM507548

CO[C@@H]1CCC[C@H](OC)C1n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cnn2ccccc12 |r|

BDBM507549

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wD:16.17,18.19,(1.23,1.34,;-.11,.57,;-1.44,1.34,;-1.49,2.91,;-2.82,3.68,;-4.16,2.91,;-4.16,1.37,;-5.49,.6,;-6.67,1.59,;-2.82,.6,;-2.82,-.94,;-1.58,-1.85,;-.11,-1.37,;1.22,-2.14,;-.11,-2.91,;2.56,-2.91,;2.56,-1.37,;2.56,.17,;3.89,-2.14,;3.89,-3.68,;5.22,-1.37,;6.56,-2.14,;7.89,-1.37,;7.89,.17,;9.22,.94,;6.56,.94,;5.22,.17,;-2.05,-3.31,;-3.59,-3.31,;-4.07,-1.85,;-5.61,-1.85,;-6.51,-3.09,;-7.98,-2.62,;-7.98,-1.08,;-9.22,-.17,;-6.51,-.6,)|

BDBM507550

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(-5.22,4.13,;-3.97,3.22,;-2.56,3.85,;-1.32,2.95,;.09,3.57,;-1.48,1.41,;.05,1.25,;-3.01,1.58,;-1.64,-.12,;-.39,-1.02,;1.07,-.55,;1.98,-1.79,;1.07,-3.04,;1.55,-4.5,;.64,-5.75,;1.55,-6.99,;3.01,-6.52,;4.48,-6.99,;5.38,-5.75,;4.48,-4.5,;3.01,-4.98,;-.39,-2.56,;-1.64,-3.47,;-3.05,-2.84,;-3.21,-1.31,;-4.61,-.68,;-4.29,-3.75,;-4.13,-5.28,;-2.72,-5.9,;-1.48,-5,;-.07,-5.63,;-.18,-7.16,;-2.4,5.38,;-3.65,6.29,;-3.49,7.82,;-2.08,8.45,;-1.92,9.98,;-.83,7.54,;-1,6.01,)|

BDBM507551

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cnn2CCCc12 |r,wU:16.17,18.19,(1.06,2.06,;-.28,1.29,;-1.61,2.06,;-1.66,3.62,;-2.99,4.39,;-4.33,3.62,;-4.33,2.08,;-5.66,1.31,;-6.84,2.3,;-2.99,1.31,;-2.99,-.23,;-1.75,-1.13,;-.28,-.66,;1.05,-1.43,;-.28,-2.2,;2.39,-2.2,;2.39,-.66,;2.39,.88,;3.72,-1.43,;3.72,-2.97,;5.05,-.66,;6.39,-1.43,;7.72,-.66,;7.72,.88,;9.05,1.65,;6.39,1.65,;5.05,.88,;-2.22,-2.6,;-3.76,-2.6,;-4.24,-1.13,;-5.78,-1.13,;-6.68,.11,;-8.15,-.36,;-8.15,-1.9,;-9.05,-3.15,;-8.15,-4.39,;-6.68,-3.92,;-6.68,-2.38,)|

BDBM507552

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1cnn2CCCc12 |r,wU:16.17,wD:18.19,(1.06,2.5,;-.28,1.73,;-1.61,2.5,;-1.66,4.06,;-2.99,4.83,;-4.33,4.06,;-4.33,2.52,;-5.66,1.75,;-6.84,2.74,;-2.99,1.75,;-2.99,.21,;-1.75,-.69,;-.28,-.21,;1.05,-.98,;-.28,-1.75,;2.39,-1.75,;2.39,-.21,;2.39,1.33,;3.72,-.98,;3.72,-2.52,;5.05,-3.29,;5.05,-4.83,;6.39,-2.52,;5.05,-.21,;6.39,-.98,;7.72,-.21,;7.72,1.33,;9.05,2.1,;6.39,2.1,;5.05,1.33,;-2.22,-2.16,;-3.76,-2.16,;-4.24,-.69,;-5.78,-.69,;-6.68,.56,;-8.15,.08,;-8.15,-1.46,;-9.05,-2.71,;-8.15,-3.95,;-6.68,-3.48,;-6.68,-1.94,)|

BDBM507553

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1cnn2CCCc12 |r,wU:16.17,wD:18.19,(1.06,2.5,;-.28,1.73,;-1.61,2.5,;-1.66,4.06,;-2.99,4.83,;-4.33,4.06,;-4.33,2.52,;-5.66,1.75,;-6.84,2.74,;-2.99,1.75,;-2.99,.21,;-1.75,-.69,;-.28,-.21,;1.05,-.98,;-.28,-1.75,;2.39,-1.75,;2.39,-.21,;2.39,1.33,;3.72,-.98,;3.72,-2.52,;5.05,-3.29,;5.05,-4.83,;6.39,-2.52,;5.05,-.21,;6.39,-.98,;7.72,-.21,;7.72,1.33,;9.05,2.1,;6.39,2.1,;5.05,1.33,;-2.22,-2.16,;-3.76,-2.16,;-4.24,-.69,;-5.78,-.69,;-6.68,.56,;-8.15,.08,;-8.15,-1.46,;-9.05,-2.71,;-8.15,-3.95,;-6.68,-3.48,;-6.68,-1.94,)|

BDBM507554

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1nn(C)c2ccc(C)cc12 |r|

BDBM507555

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1nn(C)c2ccccc12 |r|

BDBM507556

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(4.49,-4.77,;3.32,-3.72,;3.65,-2.23,;2.46,-1.23,;2.81,.26,;1.05,-1.69,;.29,-3.02,;1.81,-3.02,;-.08,-.66,;-1.55,-1.15,;-2.01,-2.61,;-3.55,-2.61,;-4.01,-1.18,;-5.48,-.64,;-5.95,.83,;-7.49,.83,;-7.97,-.64,;-9.44,-1.11,;-6.72,-1.54,;-2.76,-.26,;-2.76,1.74,;-4.09,2.5,;-5.41,1.72,;-6.77,2.47,;-4.09,4.02,;-2.76,4.77,;-1.44,4.02,;-1.44,2.5,;-.11,1.72,;1.24,2.5,;5.08,-1.74,;5.41,-.28,;6.84,.2,;8.03,-.8,;9.44,-.37,;7.68,-2.31,;6.22,-2.77,)|

BDBM507557

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507558

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507559

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507560

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507561

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC)c1ccc(OC)cn1 |r,wU:3.3,2.1,(3.89,-4.59,;2.74,-3.56,;3.06,-2.05,;1.92,-1.02,;2.24,.49,;.45,-1.49,;-.32,-2.83,;1.22,-2.83,;-.69,-.46,;-2.15,-.94,;-2.63,-2.4,;-4.17,-2.4,;-4.65,-.94,;-6.11,-.46,;-6.59,1,;-8.13,1,;-8.6,-.46,;-10.07,-.94,;-7.36,-1.37,;-3.4,-.03,;-3.4,1.51,;-2.07,2.28,;-.73,1.51,;.6,2.28,;-2.07,3.82,;-3.4,4.59,;-4.73,3.82,;-4.73,2.28,;-6.07,1.51,;-7.4,2.28,;4.53,-1.57,;4.85,-.07,;6.31,.41,;7.46,-.62,;8.92,-.15,;10.07,-1.18,;7.14,-2.13,;5.67,-2.6,)|

BDBM507562

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,wD:18.19,(1.18,3.18,;-.15,2.41,;-1.48,3.18,;-1.48,4.72,;-2.82,5.49,;-4.15,4.72,;-4.15,3.18,;-5.49,2.41,;-6.82,3.18,;-2.82,2.41,;-2.82,.87,;-1.57,-.04,;-.08,.36,;1,-.73,;1.77,-2.06,;.23,-2.06,;2.49,-.33,;2.89,1.16,;3.58,-1.42,;3.18,-2.91,;4.27,-4,;5.76,-3.6,;3.87,-5.49,;5.07,-1.02,;6.16,-2.11,;7.64,-1.71,;8.04,-.23,;9.53,.17,;6.95,.86,;5.47,.47,;-2.05,-1.5,;-3.59,-1.5,;-4.06,-.04,;-5.55,.36,;-6.03,1.82,;-7.57,1.82,;-8.04,.36,;-9.53,-.04,;-6.8,-.55,)|

BDBM507563

COc1cnc(nc1)[C@H](C)[C@@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wD:10.11,8.9,(10.07,-1.69,;8.92,-.66,;7.46,-1.14,;7.14,-2.64,;5.67,-3.12,;4.53,-2.09,;4.85,-.58,;6.31,-.11,;3.06,-2.56,;2.74,-4.07,;1.92,-1.53,;2.24,-.03,;.45,-2.01,;-.32,-3.34,;1.22,-3.34,;-.69,-.98,;-2.15,-1.45,;-2.63,-2.92,;-4.17,-2.92,;-4.65,-1.45,;-6.11,-.98,;-6.59,.49,;-8.13,.49,;-8.6,-.98,;-10.07,-1.45,;-7.36,-1.88,;-3.4,-.55,;-3.4,.99,;-2.07,1.76,;-.73,.99,;.6,1.76,;-2.07,3.3,;-3.4,4.07,;-4.73,3.3,;-4.73,1.76,;-6.07,.99,;-7.4,1.76,)|

BDBM507564

COc1ccc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC |r,wU:10.11,8.9,(10.08,-2.2,;8.99,-1.11,;7.5,-1.51,;6.41,-.42,;4.92,-.82,;4.52,-2.31,;5.61,-3.4,;7.1,-3,;3.04,-2.71,;2.64,-4.2,;1.95,-1.62,;2.35,-.13,;.46,-2.02,;1.23,-3.35,;-.31,-3.35,;-.63,-.93,;-2.12,-1.33,;-2.59,-2.79,;-4.13,-2.79,;-4.61,-1.33,;-6.1,-.93,;-6.57,.53,;-8.11,.53,;-8.59,-.93,;-10.08,-1.33,;-7.34,-1.84,;-3.36,-.42,;-3.36,1.12,;-2.03,1.89,;-.7,1.12,;.64,1.89,;-2.03,3.43,;-3.36,4.2,;-4.7,3.43,;-4.7,1.89,;-6.03,1.12,;-7.36,1.89,)|

BDBM507565

COc1ccc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(10.08,-2.2,;8.99,-1.11,;7.5,-1.51,;6.41,-.42,;4.92,-.82,;4.52,-2.31,;5.61,-3.4,;7.1,-3,;3.04,-2.71,;2.64,-4.2,;1.95,-1.62,;2.35,-.13,;.46,-2.02,;1.23,-3.35,;-.31,-3.35,;-.63,-.93,;-2.12,-1.33,;-2.59,-2.79,;-4.13,-2.79,;-4.61,-1.33,;-6.1,-.93,;-6.57,.53,;-8.11,.53,;-8.59,-.93,;-10.08,-1.33,;-7.34,-1.84,;-3.36,-.42,;-3.36,1.12,;-2.03,1.89,;-.7,1.12,;.64,1.89,;-2.03,3.43,;-3.36,4.2,;-4.7,3.43,;-4.7,1.89,;-6.03,1.12,;-7.36,1.89,)|

BDBM507566

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1-c1c(OC)ncnc1OC)c1cnc(OC)cn1 |r,wU:3.3,2.1,(3.73,-4.74,;2.64,-3.65,;3.04,-2.16,;1.95,-1.08,;2.35,.41,;.46,-1.47,;1.23,-2.81,;-.31,-2.81,;-.63,-.39,;-2.12,-.78,;-2.59,-2.25,;-4.13,-2.25,;-4.61,-.78,;-6.1,-.39,;-6.57,1.08,;-8.11,1.08,;-8.59,-.39,;-10.08,-.78,;-7.34,-1.29,;-3.36,.12,;-3.36,1.66,;-2.03,2.43,;-.7,1.66,;.64,2.43,;-2.03,3.97,;-3.36,4.74,;-4.7,3.97,;-4.7,2.43,;-6.03,1.66,;-7.36,2.43,;4.52,-1.77,;4.92,-.28,;6.41,.12,;7.5,-.97,;8.99,-.57,;10.08,-1.66,;7.1,-2.46,;5.61,-2.86,)|

BDBM507567

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,wD:18.19,(1.18,3.18,;-.15,2.41,;-1.48,3.18,;-1.48,4.72,;-2.82,5.49,;-4.15,4.72,;-4.15,3.18,;-5.49,2.41,;-6.82,3.18,;-2.82,2.41,;-2.82,.87,;-1.57,-.04,;-.08,.36,;1,-.73,;1.77,-2.06,;.23,-2.06,;2.49,-.33,;2.89,1.16,;3.58,-1.42,;3.18,-2.91,;4.27,-4,;5.76,-3.6,;3.87,-5.49,;5.07,-1.02,;5.47,.47,;6.95,.86,;8.04,-.23,;9.53,.17,;7.64,-1.71,;6.16,-2.11,;-2.05,-1.5,;-3.59,-1.5,;-4.06,-.04,;-5.55,.36,;-6.03,1.82,;-7.57,1.82,;-8.04,.36,;-9.53,-.04,;-6.8,-.55,)|

BDBM507568

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507569

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2cnc(Cl)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507570

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM507571

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cnn2CCCc12 |r,wU:16.17,18.19,(-6.72,1.44,;-5.39,.67,;-4.06,1.44,;-4.06,2.98,;-2.72,3.75,;-1.39,2.98,;-1.39,1.44,;-.05,.67,;1.28,1.44,;-2.72,.67,;-2.72,-.87,;-1.48,-1.78,;-.14,-1.01,;1.19,-1.78,;-.14,-2.55,;2.52,-2.55,;2.52,-1.01,;2.52,.53,;3.86,-1.78,;3.86,-3.32,;5.19,-1.01,;6.53,-1.78,;7.86,-1.01,;7.86,.53,;9.19,1.3,;6.53,1.3,;5.19,.53,;-1.95,-3.24,;-3.49,-3.24,;-3.97,-1.78,;-5.46,-1.38,;-5.93,.09,;-7.47,.09,;-7.95,-1.38,;-9.19,-2.28,;-8.72,-3.75,;-7.18,-3.75,;-6.7,-2.28,)|

BDBM507572

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cnn2CCCc12 |r,wU:16.17,18.19,(-6.72,1.44,;-5.39,.67,;-4.06,1.44,;-4.06,2.98,;-2.72,3.75,;-1.39,2.98,;-1.39,1.44,;-.05,.67,;1.28,1.44,;-2.72,.67,;-2.72,-.87,;-1.48,-1.78,;-.14,-1.01,;1.19,-1.78,;-.14,-2.55,;2.52,-2.55,;2.52,-1.01,;2.52,.53,;3.86,-1.78,;3.86,-3.32,;5.19,-1.01,;6.53,-1.78,;7.86,-1.01,;7.86,.53,;9.19,1.3,;6.53,1.3,;5.19,.53,;-1.95,-3.24,;-3.49,-3.24,;-3.97,-1.78,;-5.46,-1.38,;-5.93,.09,;-7.47,.09,;-7.95,-1.38,;-9.19,-2.28,;-8.72,-3.75,;-7.18,-3.75,;-6.7,-2.28,)|

BDBM507573

COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cnn2CCCc12 |r|

BDBM507574

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(F)cn2)nnc1-c1cnn2CCCc12 |r,wU:16.17,wD:18.19,(1.33,2.35,;-.01,1.58,;-1.34,2.35,;-1.39,3.92,;-2.72,4.69,;-4.06,3.92,;-4.06,2.38,;-5.39,1.61,;-6.57,2.6,;-2.72,1.61,;-2.72,.07,;-1.48,-.84,;-.14,-.07,;1.19,-.84,;-.14,-1.61,;2.52,-1.61,;2.52,-.07,;2.52,1.47,;3.86,-.84,;3.86,-2.38,;5.19,-3.15,;6.53,-2.38,;5.19,-4.69,;5.19,-.07,;6.53,-.84,;7.86,-.07,;7.86,1.47,;9.19,2.24,;6.53,2.24,;5.19,1.47,;-1.95,-2.3,;-3.49,-2.3,;-3.97,-.84,;-5.46,-.44,;-5.93,1.03,;-7.47,1.03,;-7.95,-.44,;-9.19,-1.34,;-8.72,-2.81,;-7.18,-2.81,;-6.7,-1.34,)|

BDBM507575

C[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1-c1c(F)cccc1F)c1ncc(C)cn1 |r,wU:2.2,1.0,(3.86,-3.32,;3.86,-1.78,;2.52,-1.01,;2.52,.53,;1.19,-1.78,;-.14,-2.55,;2.52,-2.55,;-.14,-1.01,;-1.48,-1.78,;-1.95,-3.24,;-3.49,-3.24,;-3.97,-1.78,;-5.46,-1.38,;-5.93,.09,;-7.47,.09,;-7.95,-1.38,;-9.19,-2.28,;-8.72,-3.75,;-7.18,-3.75,;-6.7,-2.28,;-2.72,-.87,;-2.72,.67,;-4.06,1.44,;-5.39,.67,;-4.06,2.98,;-2.72,3.75,;-1.39,2.98,;-1.39,1.44,;-.05,.67,;5.19,-1.01,;6.53,-1.78,;7.86,-1.01,;7.86,.53,;9.19,1.3,;6.53,1.3,;5.19,.53,)|

BDBM507576

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1-c1c(F)cccc1F)c1cnc(C)cn1 |r,wU:5.5,wD:4.3,(6.53,-2.38,;5.19,-3.15,;5.19,-4.69,;3.86,-2.38,;3.86,-.84,;2.52,-.07,;2.52,1.47,;1.19,-.84,;-.14,-1.61,;2.52,-1.61,;-.14,-.07,;-1.48,-.84,;-1.95,-2.3,;-3.49,-2.3,;-3.97,-.84,;-5.46,-.44,;-5.93,1.03,;-7.47,1.03,;-7.95,-.44,;-9.19,-1.34,;-8.72,-2.81,;-7.18,-2.81,;-6.7,-1.34,;-2.72,.07,;-2.72,1.61,;-4.06,2.38,;-5.39,1.61,;-4.06,3.92,;-2.72,4.69,;-1.39,3.92,;-1.39,2.38,;-.05,1.61,;5.19,-.07,;5.19,1.47,;6.53,2.24,;7.86,1.47,;9.19,2.24,;7.86,-.07,;6.53,-.84,)|

BDBM507577

COc1cnc(nc1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1-c1c(OC)cccc1OC |r,wU:10.11,8.9,(9.33,2.85,;9.31,1.31,;7.97,.55,;7.86,-1.01,;6.53,-1.78,;5.19,-1.01,;5.19,.53,;6.53,1.3,;3.86,-1.78,;3.86,-3.32,;2.52,-1.01,;2.52,.53,;1.19,-1.78,;-.14,-2.55,;2.52,-2.55,;-.14,-1.01,;-1.48,-1.78,;-1.95,-3.24,;-3.49,-3.24,;-3.97,-1.78,;-5.46,-1.38,;-5.93,.09,;-7.47,.09,;-7.95,-1.38,;-9.19,-2.28,;-8.72,-3.75,;-7.18,-3.75,;-6.7,-2.28,;-2.72,-.87,;-2.72,.67,;-1.34,1.41,;-.01,.64,;1.33,1.41,;-1.39,2.98,;-2.72,3.75,;-4.06,2.98,;-4.06,1.44,;-5.39,.67,;-6.57,1.66,)|

BDBM507578

COc1cnc(cn1)[C@@H](C)[C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1-c1c(OC)cccc1OC |r,wU:8.9,10.11,(-.41,-11.6,;-1.82,-10.98,;-1.98,-9.44,;-.74,-8.54,;-.9,-7.01,;-2.3,-6.38,;-3.55,-7.29,;-3.39,-8.82,;-2.47,-4.85,;-3.87,-4.22,;-1.22,-3.95,;.19,-4.57,;-1.38,-2.41,;-2.91,-2.57,;.15,-2.25,;-1.54,-.88,;-.3,.02,;1.17,-.45,;2.07,.79,;1.17,2.04,;1.64,3.5,;.74,4.75,;1.64,6,;3.11,5.52,;4.57,6,;5.48,4.75,;4.57,3.5,;3.11,3.98,;-.3,1.56,;-1.54,2.47,;-2.95,1.84,;-3.11,.31,;-4.52,-.32,;-4.19,2.75,;-4.03,4.28,;-2.63,4.91,;-1.38,4,;.03,4.63,;.19,6.16,)|

BDBM507579

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cnn2CCCc12 |r,wU:18.19,16.17,(-4.8,-.63,;-3.4,-.01,;-3.24,1.52,;-4.48,2.43,;-4.32,3.96,;-2.91,4.59,;-1.67,3.68,;-.26,4.31,;-.1,5.84,;-1.83,2.15,;-.58,1.25,;-.58,-.29,;-1.83,-1.2,;-1.67,-2.73,;-3.2,-2.89,;-.14,-2.57,;-1.51,-4.26,;-.1,-4.89,;-2.75,-5.17,;-4.16,-4.54,;-2.59,-6.7,;-3.84,-7.61,;-3.68,-9.14,;-2.27,-9.76,;-2.11,-11.29,;-1.02,-8.86,;-1.19,-7.33,;.88,-.77,;1.79,.48,;.88,1.72,;1.36,3.19,;.45,4.43,;1.36,5.68,;2.82,5.2,;4.29,5.68,;5.19,4.43,;4.29,3.19,;2.82,3.66,)|

BDBM507580

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3CCCc23)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-4.15,-2.83,;-3.98,-4.36,;-2.58,-4.99,;-1.33,-4.08,;.07,-4.71,;-1.49,-2.55,;-3.02,-2.71,;.04,-2.39,;-1.65,-1.02,;-.41,-.12,;1.06,-.59,;1.96,.65,;1.06,1.9,;1.53,3.37,;.63,4.61,;1.53,5.86,;3,5.38,;4.46,5.86,;5.37,4.61,;4.46,3.37,;3,3.84,;-.41,1.42,;-1.65,2.33,;-3.06,1.7,;-3.22,.17,;-4.63,-.45,;-4.31,2.61,;-4.15,4.14,;-2.74,4.77,;-1.49,3.86,;-.09,4.49,;.07,6.02,;-2.42,-6.52,;-3.66,-7.43,;-3.5,-8.96,;-2.1,-9.58,;-1.93,-11.12,;-.85,-8.68,;-1.01,-7.15,)|

BDBM507581

COCC1(CCC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1n[nH]c2CCCc12 |r|

BDBM507582

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3CCCc23)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM507583

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1n[nH]c2CCCCc12 |r|

BDBM507584

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2n[nH]c3CCCc23)n1C1(C)CCC1)c1ncc(Cl)cn1 |r|

BDBM507585

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1n[nH]c2ccc(C)cc12 |r|

BDBM507586

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1nn(C)c2ccccc12 |r|

BDBM507587

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1n[nH]c2ccccc12 |r|

BDBM507588

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cc(C)on2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:3.3,2.1,(2.16,-5.83,;1.26,-4.58,;-.27,-4.74,;-1.18,-3.5,;-2.71,-3.66,;-.55,-2.09,;.85,-2.72,;-1.96,-1.46,;.07,-.68,;-.83,.56,;-2.37,.56,;-2.85,2.03,;-1.6,2.93,;-1.6,4.47,;-2.85,5.38,;-2.37,6.84,;-3.28,8.09,;-.83,6.84,;-.36,5.38,;-.36,2.03,;1.11,2.5,;1.43,4.01,;.28,5.04,;.6,6.55,;2.89,4.49,;4.04,3.46,;3.72,1.95,;2.25,1.47,;1.93,-.03,;3.08,-1.06,;-.9,-6.15,;-2.43,-6.31,;-3.06,-7.72,;-2.15,-8.96,;-2.78,-10.37,;-.62,-8.8,;0,-7.39,)|

BDBM507589

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cc(C)on1 |r,wU:18.19,wD:16.17,(.84,7.42,;.52,5.92,;1.67,4.89,;3.13,5.36,;4.28,4.33,;3.96,2.83,;2.49,2.35,;2.17,.84,;3.32,-.19,;1.35,3.38,;-.12,2.9,;-.59,1.44,;.31,.19,;-.31,-1.21,;1.09,-1.84,;-1.72,-.59,;-.94,-2.62,;-2.47,-2.78,;-.03,-3.87,;1.5,-3.71,;2.4,-4.95,;3.93,-4.79,;1.78,-6.36,;-.66,-5.27,;-2.19,-5.43,;-2.82,-6.84,;-1.91,-8.09,;-2.54,-9.49,;-.38,-7.93,;.24,-6.52,;-2.13,1.44,;-2.61,2.9,;-1.36,3.81,;-1.36,5.35,;-2.61,6.25,;-2.13,7.72,;-3.04,8.96,;-.59,7.72,;-.12,6.25,)|

BDBM507590

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1cc(C)on1 |r,wD:18.19,16.17,(.5,6.11,;.18,4.61,;1.32,3.58,;2.79,4.05,;3.93,3.02,;3.61,1.51,;2.15,1.04,;1.83,-.47,;2.97,-1.5,;1,2.07,;-.46,1.59,;-.94,.13,;-.03,-1.12,;-.66,-2.52,;.75,-3.15,;-2.07,-1.9,;-1.29,-3.93,;-2.82,-4.09,;-.38,-5.18,;1.15,-5.02,;-1.01,-6.58,;-2.54,-6.75,;-3.16,-8.15,;-2.26,-9.4,;-2.89,-10.8,;-.73,-9.24,;-.1,-7.83,;-2.48,.13,;-2.95,1.59,;-1.71,2.5,;-1.71,4.04,;-.46,4.94,;-.94,6.41,;-.03,7.65,;-2.48,6.41,;-2.95,4.94,)|

BDBM507591

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn(C)c2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:2.1,3.3,(2.51,-6.5,;1.13,-5.69,;-.37,-5.04,;-1.74,-4.2,;-3.33,-4.18,;-1.18,-2.75,;.41,-3.1,;-2.65,-2.16,;-.99,-1.19,;-1.11,.38,;-2.65,.38,;-3.13,1.85,;-1.88,2.75,;-1.88,4.29,;-3.13,5.2,;-2.65,6.66,;-1.11,6.66,;-.9,8.27,;-.64,5.2,;1.1,4.74,;-.64,1.85,;.83,2.32,;1.15,3.83,;.65,5.58,;1.49,7.02,;2.61,4.3,;3.76,3.27,;3.44,1.77,;1.97,1.29,;2.99,-.02,;4.09,-1.17,;-1.18,-6.33,;-2.71,-6.49,;-3.34,-7.9,;-2.43,-9.15,;-3.08,-10.61,;-.9,-8.98,;-.28,-7.58,)|

BDBM507592

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn(C)c2C(C)C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wD:2.1,3.3,(2.1,-6.77,;.68,-5.99,;-.79,-5.27,;-2.2,-4.45,;-3.82,-4.39,;-1.56,-2.99,;0,-3.39,;-3.05,-2.46,;-1.44,-1.42,;-1.53,.16,;-3.07,.16,;-3.54,1.62,;-2.3,2.53,;-2.3,4.07,;-3.54,4.97,;-3.07,6.44,;-1.53,6.44,;-1.49,8.06,;-1.05,4.97,;.81,4.58,;1.29,2.74,;1.97,5.83,;-1.05,1.62,;.41,2.1,;1.56,1.07,;2.64,-.22,;3.73,-1.42,;3.02,1.54,;3.34,3.05,;2.2,4.08,;.73,3.6,;.15,5.3,;.56,6.92,;-1.6,-6.55,;-3.13,-6.72,;-3.75,-8.12,;-2.85,-9.37,;-3.49,-10.84,;-1.32,-9.21,;-.69,-7.8,)|

BDBM507593

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1noc2ccccc12 |r|

BDBM507594

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccccc23)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM507595

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn3ccccc23)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM507596

COCC1(CCC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cnn2ccccc12 |r|

BDBM507597

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cnn2ccccc12 |r|

BDBM507598

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc3ccccc23)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM507599

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nn(C)c3CCCCc23)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM507600

COCC1(CC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1nn(C)c2CCCCc12 |r|

BDBM507601

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2nn(C)c3CCCCc23)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM507602

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc(C)c2C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-2.71,-3.37,;-2.09,-4.77,;-.55,-4.93,;.35,-3.69,;1.88,-3.85,;-.28,-2.28,;1.13,-1.66,;-1.68,-2.91,;-.9,-.87,;0,.37,;1.54,.37,;2.02,1.84,;.77,2.74,;.77,4.28,;-.47,5.19,;0,6.65,;1.54,6.65,;2.45,7.9,;2.02,5.19,;3.48,4.71,;-.47,1.84,;-1.94,2.31,;-3.08,1.28,;-2.76,-.23,;-3.91,-1.26,;-4.55,1.76,;-4.87,3.26,;-3.72,4.29,;-2.26,3.82,;-1.11,4.85,;.25,4.13,;.07,-6.34,;1.6,-6.5,;2.23,-7.91,;1.33,-9.16,;1.95,-10.56,;-.21,-8.99,;-.83,-7.59,)|

BDBM507603

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2noc(C)c2C)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:3.3,2.1,(-2.71,-3.37,;-2.09,-4.77,;-.55,-4.93,;.35,-3.69,;1.88,-3.85,;-.28,-2.28,;1.13,-1.66,;-1.68,-2.91,;-.9,-.87,;0,.37,;1.54,.37,;2.02,1.84,;.77,2.74,;.77,4.28,;-.47,5.19,;0,6.65,;1.54,6.65,;2.45,7.9,;2.02,5.19,;3.48,4.71,;-.47,1.84,;-1.94,2.31,;-3.08,1.28,;-2.76,-.23,;-3.91,-1.26,;-4.55,1.76,;-4.87,3.26,;-3.72,4.29,;-2.26,3.82,;-1.11,4.85,;.25,4.13,;.07,-6.34,;1.6,-6.5,;2.23,-7.91,;1.33,-9.16,;1.95,-10.56,;-.21,-8.99,;-.83,-7.59,)|

BDBM507604

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)nnc1-c1noc(C)c1C |r,wU:16.17,wD:18.19,(1.42,2.44,;.09,1.67,;-1.24,2.44,;-1.29,4.01,;-2.62,4.78,;-3.96,4.01,;-3.96,2.47,;-5.29,1.7,;-6.47,2.69,;-2.62,1.7,;-2.62,-.02,;-1.38,-.93,;-.04,-.16,;1.29,-.93,;-.04,-1.7,;2.62,-1.7,;2.62,-.16,;2.62,1.38,;3.96,-.93,;3.96,-2.47,;5.29,-3.24,;5.29,-4.78,;6.62,-2.47,;5.29,-.16,;6.62,-.93,;7.96,-.16,;7.96,1.38,;9.29,2.15,;6.62,2.15,;5.29,1.38,;-1.85,-2.39,;-3.39,-2.39,;-3.87,-.93,;-5.33,-.45,;-5.81,1.01,;-7.35,1.01,;-7.83,-.45,;-9.29,-.93,;-6.58,-1.36,;-6.58,-2.9,)|

BDBM507605

COCC1(CCC1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1nn(C)c2CCCCc12 |r|

BDBM507606

CCc1onc(c1C)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(1.68,8.97,;2.31,7.57,;1.4,6.32,;-.14,6.32,;-.61,4.86,;.63,3.95,;1.88,4.86,;3.34,4.38,;.63,2.41,;1.88,1.51,;1.4,.04,;-.14,.04,;-1.04,-1.2,;-.42,-2.61,;.99,-1.98,;-1.82,-3.24,;.21,-4.02,;1.74,-4.18,;-.69,-5.26,;-2.23,-5.1,;-2.85,-3.7,;-.07,-6.67,;1.46,-6.83,;2.09,-8.24,;1.18,-9.48,;1.81,-10.89,;-.35,-9.32,;-.97,-7.92,;-.61,1.51,;-2.08,1.98,;-3.22,.95,;-2.9,-.55,;-4.05,-1.58,;-4.69,1.43,;-5.01,2.93,;-3.86,3.96,;-2.4,3.49,;-1.25,4.52,;.11,3.8,)|

BDBM507607

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2c[nH]cn2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(-2.85,-2.99,;-2.23,-4.4,;-.7,-4.56,;.21,-3.31,;1.74,-3.47,;-.42,-1.91,;.99,-1.28,;-1.82,-2.53,;-1.04,-.5,;-.14,.75,;1.4,.75,;1.88,2.21,;.63,3.12,;.63,4.66,;-.61,5.56,;-.14,7.03,;1.4,7.03,;1.88,5.56,;-.61,2.21,;-2.08,2.69,;-3.22,1.66,;-2.9,.15,;-4.05,-.88,;-4.69,2.13,;-5.01,3.64,;-3.86,4.67,;-2.4,4.19,;-1.26,5.22,;.1,4.5,;-.07,-5.97,;1.46,-6.13,;2.09,-7.53,;1.18,-8.78,;1.81,-10.19,;-.35,-8.62,;-.98,-7.21,)|

BDBM507608

COC[C@@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507609

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM507610

COC[C@H](C)n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1-c1ccn(C)n1 |r|

BDBM507611

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1ccn(C)n1 |r,wU:16.17,18.19,(-6.83,1.76,;-5.5,.99,;-4.16,1.76,;-4.16,3.3,;-2.83,4.07,;-1.49,3.3,;-1.49,1.76,;-.16,.99,;1.17,1.76,;-2.83,.99,;-2.83,-.55,;-1.58,-1.45,;-.12,-.98,;1.03,-2.01,;.26,-3.34,;1.8,-3.34,;2.49,-1.53,;2.81,-.03,;3.64,-2.56,;3.32,-4.07,;5.1,-2.09,;5.42,-.58,;6.89,-.11,;8.03,-1.14,;9.49,-.66,;7.71,-2.64,;6.25,-3.12,;-2.06,-2.92,;-3.6,-2.92,;-4.07,-1.45,;-5.54,-.98,;-6.01,.49,;-7.55,.49,;-8.03,-.98,;-9.49,-1.45,;-6.78,-1.88,)|

BDBM507612

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)nnc1-c1cnn(C)c1 |r,wU:16.17,18.19,(-6.83,1.76,;-5.5,.99,;-4.16,1.76,;-4.16,3.3,;-2.83,4.07,;-1.49,3.3,;-1.49,1.76,;-.16,.99,;1.17,1.76,;-2.83,.99,;-2.83,-.55,;-1.58,-1.45,;-.12,-.98,;1.03,-2.01,;.26,-3.34,;1.8,-3.34,;2.49,-1.53,;2.81,-.03,;3.64,-2.56,;3.32,-4.07,;5.1,-2.09,;5.42,-.58,;6.89,-.11,;8.03,-1.14,;9.49,-.66,;7.71,-2.64,;6.25,-3.12,;-2.06,-2.92,;-3.6,-2.92,;-4.07,-1.45,;-5.54,-.98,;-6.01,.49,;-7.55,.49,;-8.03,-.98,;-9.49,-1.45,;-6.78,-1.88,)|

BDBM507613

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cnn(C)c2)n1C1CC1)c1ncc(Cl)cn1 |r|

BDBM507614

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1C(C)C)c1ncc(Cl)cn1 |r|

BDBM507615

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccn(C)n2)n1C1(C)CC1)c1ncc(Cl)cn1 |r|

BDBM521471

COC[C@H]1COc2ccccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c3ncc(OC)cn3)n12 |r|

BDBM521473

COC[C@@H]1COc2ccc(OC)nc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c3ncc(OC)cn3)n12 |r|

BDBM521474

COC[C@@H]1COc2ccccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521478

COC[C@@H]1COc2c(OC)cccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c3ncc(OC)cn3)n12 |r|

BDBM521480

COC[C@@H]1COc2ccc(OC)nc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c3ncc(C)cn3)n12 |r|

BDBM521481

COC[C@@H]1COc2ccc(OC)nc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521486

COC[C@@H]1COc2cc(F)c(F)cc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521487

CC(C)O[C@H]([C@H](C)S(=O)(=O)N(CC[Si](C)(C)C)c1nnc2-c3ccccc3OCC(=C)n12)c1ncc(C)cn1 |r|

BDBM521488

COc1ccc2OC[C@@H](CO)n3c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c4ncc(C)cn4)nnc3-c2n1 |r|

BDBM521490

COC[C@@H]1COc2cc(F)c(F)nc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521492

CC(C)O[C@H]([C@H](C)S(=O)(=O)N(CC[Si](C)(C)C)c1nnc2-c3ccccc3OC[C@@H](CO)n12)c1ncc(C)cn1 |r|

BDBM521493

COC[C@@H]1COc2ccc(F)cc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521494

COC[C@@H]1COc2ccc(F)cc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c3ncc(C)cn3)n12 |r|

BDBM521499

Cc1cnc(CCS(=O)(=O)N\C(NNC(=O)c2cccnc2Br)=N/C2COC(C)(C)OC2)nc1

BDBM521500

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cccnc3OC[C@@H](CO)n12)c1ncc(C)cn1 |r|

BDBM521501

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cccnc3OC[C@@H](CO)n12)c1ncc(Cl)cn1 |r|

BDBM521502

COC[C@@H]1COc2ncccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521503

COC[C@@H]1COc2c(OC)cccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521504

COC[C@@H]1COc2ncccc2-c2nnc(NS(=O)(=O)CCc3ncc(C)cn3)n12 |r|

BDBM521506

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cccnc3OC[C@@H](CO)n12)c1ncc(C)cn1 |r|

BDBM521507

COC[C@@H]1COc2ncccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(Cl)cn3)n12 |r|

BDBM521512

COC[C@@H]1COc2ccc(F)cc2-c2nnc(NS(=O)(=O)CCc3ncc(C)cn3)n12 |r|

BDBM521513

COC[C@@H]1COc2cnccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521516

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2CC\C=C/c3ccccc3-n12)c1ncc(C)cn1 |r,c:17|

BDBM521517

CC(C)O[C@H]([C@H](C)S(=O)(=O)N\C(NN)=N/c1c(F)cccc1C=C)c1ncc(C)cn1 |r|

BDBM521518

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2CC\C=C/c3cccc(F)c3-n12)c1ncc(C)cn1 |r,c:17|

BDBM521519

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2[C@@H](C)C\C=C/c3cccc(F)c3-n12)c1ncc(C)cn1 |r,c:18|

BDBM521523

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cccnc3OC[C@@H](COC(C)C)n12)c1ncc(C)cn1 |r|

BDBM521524

CC(C)O[C@@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cccnc3OC[C@@H](CO)n12)c1ncc(C)cn1 |r|

BDBM521525

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3ncccc3OC[C@@H](CO)n12)c1ncc(C)cn1 |r|

BDBM521526

COC[C@@H]1COc2ncccc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521527

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cccnc3OCC(=C)n12)c1ncc(Cl)cn1 |r|

BDBM521528

COC[C@@H]1COc2cccnc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521529

CC(C)OC[C@@H]1COc2ccc(F)cc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521538

COc1ccc2CO[C@@H](CO)n3c(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c4ncc(C)cn4)nnc3-c2c1 |r|

BDBM521540

COC[C@@H]1OCc2ccc(OC)cc2-c2nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c3ncc(C)cn3)n12 |r|

BDBM521542

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cc(OC(F)(F)F)ccc3CO[C@@H](CO)n12)c1ncc(C)cn1 |r|

BDBM521544

CC(C)O[C@H]([C@H](C)S(=O)(=O)Nc1nnc2-c3cc(ccc3CO[C@@H](CO)n12)C(F)(F)F)c1ncc(C)cn1 |r|

BDBM528356

COc1ncnc(OC)c1-n1c(CC(C)(C)C)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:24.26,26.28,(1.28,1.54,;-.06,.77,;-1.39,1.54,;-1.39,3.08,;-2.72,3.85,;-4.06,3.08,;-4.06,1.54,;-5.39,.77,;-6.72,1.54,;-2.72,.77,;-2.72,-.77,;-3.97,-1.67,;-5.46,-1.28,;-6.54,-2.36,;-6.15,-3.85,;-8.03,-1.97,;-7.63,-3.45,;-3.49,-3.14,;-1.95,-3.14,;-1.48,-1.67,;.01,-1.28,;1.1,-2.36,;1.87,-3.7,;.33,-3.7,;2.19,-1.28,;1.79,.21,;3.68,-1.67,;4.08,-3.16,;4.77,-.58,;6.25,-.98,;7.34,.11,;6.94,1.59,;8.03,2.68,;5.46,1.99,;4.37,.9,)|

BDBM528357

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H](C)OC(C)C |r,wU:16.17,18.19,wD:30.33,(-5.29,2.72,;-4.2,1.63,;-2.71,2.03,;-2.31,3.52,;-.82,3.92,;.26,2.83,;-.13,1.34,;.83,.15,;2.34,.47,;-1.62,.94,;-2.02,-.54,;-1.05,-1.74,;.44,-1.34,;1.53,-2.43,;2.3,-3.76,;.76,-3.76,;2.86,-1.66,;2.46,-.17,;4.19,-2.43,;4.59,-3.92,;5.53,-1.66,;7.01,-2.06,;8.1,-.97,;7.7,.52,;8.79,1.61,;6.22,.92,;5.13,-.17,;-1.89,-3.03,;-3.38,-2.63,;-3.46,-1.1,;-4.79,-.33,;-4.79,1.21,;-6.13,-1.1,;-7.46,-.33,;-8.79,-1.1,;-7.46,1.21,)|

BDBM528359

CO[C@H](C)c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wU:12.12,14.14,wD:2.2,(-8.13,-.33,;-6.79,-1.1,;-5.46,-.33,;-5.46,1.21,;-4.13,-1.1,;-4.04,-2.63,;-2.56,-3.03,;-1.72,-1.74,;-.23,-1.34,;.86,-2.43,;1.63,-3.76,;.09,-3.76,;2.19,-1.66,;1.79,-.17,;3.53,-2.43,;3.92,-3.92,;4.86,-1.66,;6.35,-2.06,;7.44,-.97,;7.04,.52,;8.13,1.61,;5.55,.92,;4.46,-.17,;-2.69,-.54,;-2.29,.94,;-3.38,2.03,;-4.87,1.63,;-5.95,2.72,;-2.98,3.52,;-1.49,3.92,;-.4,2.83,;-.8,1.34,;.17,.15,;1.67,.47,)|

BDBM528361

CC[C@@H](OC)c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wU:13.13,15.15,wD:2.2,(-6.79,1.98,;-5.46,1.21,;-5.46,-.33,;-6.79,-1.1,;-8.13,-.33,;-4.13,-1.1,;-4.04,-2.63,;-2.56,-3.03,;-1.72,-1.74,;-.23,-1.34,;.86,-2.43,;1.63,-3.76,;.09,-3.76,;2.19,-1.66,;1.79,-.17,;3.53,-2.43,;3.92,-3.92,;4.86,-1.66,;6.35,-2.06,;7.44,-.97,;7.04,.52,;8.13,1.61,;5.55,.92,;4.46,-.17,;-2.69,-.54,;-2.29,.94,;-3.38,2.03,;-4.87,1.63,;-5.95,2.72,;-2.98,3.52,;-1.49,3.92,;-.4,2.83,;-.8,1.34,;.17,.15,;1.67,.47,)|

BDBM528365

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,13.13,(-8.03,-2.04,;-6.54,-2.44,;-5.46,-1.35,;-3.97,-1.75,;-3.49,-3.22,;-1.95,-3.22,;-1.48,-1.75,;.01,-1.35,;1.1,-2.44,;1.87,-3.77,;.33,-3.77,;2.19,-1.35,;1.79,.14,;3.68,-1.75,;4.08,-3.24,;4.77,-.66,;4.37,.83,;5.46,1.91,;6.94,1.52,;8.03,2.61,;7.34,.03,;6.25,-1.06,;-2.72,-.85,;-2.72,.69,;-1.39,1.46,;-.06,.69,;1.28,1.46,;-1.39,3,;-2.72,3.77,;-4.06,3,;-4.06,1.46,;-5.39,.69,;-6.72,1.46,)|

BDBM528366

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(C)cn2)n1-c1c(OC)ncnc1OC |r,wU:11.11,13.13,(-8.03,-2.04,;-6.54,-2.44,;-5.46,-1.35,;-3.97,-1.75,;-3.49,-3.22,;-1.95,-3.22,;-1.48,-1.75,;.01,-1.35,;1.1,-2.44,;1.87,-3.77,;.33,-3.77,;2.19,-1.35,;1.79,.14,;3.68,-1.75,;4.08,-3.24,;4.77,-.66,;4.37,.83,;5.46,1.91,;6.94,1.52,;8.03,2.61,;7.34,.03,;6.25,-1.06,;-2.72,-.85,;-2.72,.69,;-1.39,1.46,;-.06,.69,;1.28,1.46,;-1.39,3,;-2.72,3.77,;-4.06,3,;-4.06,1.46,;-5.39,.69,;-6.72,1.46,)|

BDBM528367

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,13.13,(-8.03,-2.04,;-6.54,-2.44,;-5.46,-1.35,;-3.97,-1.75,;-3.49,-3.22,;-1.95,-3.22,;-1.48,-1.75,;.01,-1.35,;1.1,-2.44,;1.87,-3.77,;.33,-3.77,;2.19,-1.35,;1.79,.14,;3.68,-1.75,;4.08,-3.24,;4.77,-.66,;6.25,-1.06,;7.34,.03,;6.94,1.52,;8.03,2.61,;5.46,1.91,;4.37,.83,;-2.72,-.85,;-2.72,.69,;-1.39,1.46,;-.06,.69,;1.28,1.46,;-1.39,3,;-2.72,3.77,;-4.06,3,;-4.06,1.46,;-5.39,.69,;-6.72,1.46,)|

BDBM528368

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |r,wU:11.11,13.13,(-8.03,-2.04,;-6.54,-2.44,;-5.46,-1.35,;-3.97,-1.75,;-3.49,-3.22,;-1.95,-3.22,;-1.48,-1.75,;.01,-1.35,;1.1,-2.44,;1.87,-3.77,;.33,-3.77,;2.19,-1.35,;1.79,.14,;3.68,-1.75,;4.08,-3.24,;4.77,-.66,;6.25,-1.06,;7.34,.03,;6.94,1.52,;8.03,2.61,;5.46,1.91,;4.37,.83,;-2.72,-.85,;-2.72,.69,;-1.39,1.46,;-.06,.69,;1.28,1.46,;-1.39,3,;-2.72,3.77,;-4.06,3,;-4.06,1.46,;-5.39,.69,;-6.72,1.46,)|

BDBM528369

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,13.13,(-8.03,-1.77,;-6.54,-2.16,;-5.46,-1.08,;-3.97,-1.47,;-3.49,-2.94,;-1.95,-2.94,;-1.48,-1.47,;.01,-1.08,;1.1,-2.16,;1.87,-3.5,;.33,-3.5,;2.19,-1.08,;1.79,.41,;3.68,-1.47,;4.08,-2.96,;2.99,-4.05,;4.77,-.39,;6.25,-.78,;7.34,.31,;6.94,1.79,;8.03,2.88,;5.46,2.19,;4.37,1.1,;-2.72,-.57,;-2.72,.97,;-1.39,1.74,;-.06,.97,;1.28,1.74,;-1.39,3.28,;-2.72,4.05,;-4.06,3.28,;-4.06,1.74,;-5.39,.97,;-6.72,1.74,)|

BDBM528370

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@@H](O)c1ccccc1 |wU:16.17,30.33,wD:18.19,(8.48,-6.42,;7.34,-5.39,;7.66,-3.88,;9.12,-3.41,;9.44,-1.9,;8.3,-.87,;6.83,-1.35,;5.69,-.32,;6.01,1.19,;6.51,-2.85,;5.05,-3.33,;3.8,-2.42,;3.8,-.88,;2.47,-.11,;1.7,-1.45,;3.24,1.22,;1.13,.66,;-.2,-.11,;1.13,2.2,;-.2,2.97,;2.47,2.97,;3.8,2.2,;5.14,2.97,;5.14,4.51,;6.47,5.28,;3.8,5.28,;2.47,4.51,;2.56,-3.33,;3.03,-4.79,;4.57,-4.79,;5.48,-6.04,;7.01,-5.88,;4.85,-7.45,;5.76,-8.69,;5.13,-10.1,;3.6,-10.26,;2.69,-9.02,;3.32,-7.61,)|

BDBM528371

COc1cccc(OC)c1\N=C(\NNC(=O)Cc1ccccc1)NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r|

BDBM528372

COc1cccc(OC)c1-n1c(Cc2cccnc2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(C)cn1 |wD:26.29,28.31,(9.14,-3.96,;7.8,-4.73,;6.47,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;5.14,-4.73,;5.14,-6.27,;3.89,-7.18,;2.42,-6.7,;1.28,-7.73,;-.18,-7.26,;-1.33,-8.29,;-1.01,-9.8,;.46,-10.27,;1.6,-9.24,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,)|

BDBM528373

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccc2NC(=O)Cc12 |wD:16.17,18.19,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.98,-6.71,;3.79,-7.96,;1.76,-8.74,;.22,-8.9,;2.66,-9.99,;4.19,-9.82,;2.03,-11.39,;2.94,-12.64,;2.31,-14.04,;.78,-14.21,;.16,-15.61,;-.12,-12.96,;.5,-11.55,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;1.33,2.31,;,1.54,;-1.46,2.02,;-2.37,.77,;-3.91,.77,;-1.46,-.48,;)|

BDBM528375

CO[C@@H](c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC)c1ccccc1 |wU:2.1,wD:11.11,13.13,(.64,-4.72,;2.1,-5.2,;2.42,-6.7,;3.89,-7.18,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;1.28,-7.73,;1.6,-9.24,;.46,-10.27,;-1.01,-9.8,;-1.33,-8.29,;-.18,-7.26,)|

BDBM528376

CO[C@H](c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC)c1ccccc1 |wD:2.1,11.11,13.13,(.64,-4.72,;2.1,-5.2,;2.42,-6.7,;3.89,-7.18,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;1.28,-7.73,;1.6,-9.24,;.46,-10.27,;-1.01,-9.8,;-1.33,-8.29,;-.18,-7.26,)|

BDBM528377

COc1cccc(OC)c1-n1c(Cc2ccc(C)cn2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(C)cn1 |wD:27.30,29.32,(9.14,-3.96,;7.8,-4.73,;6.47,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;5.14,-4.73,;5.14,-6.27,;3.89,-7.18,;2.42,-6.7,;1.28,-7.73,;-.18,-7.26,;-1.33,-8.29,;-1.01,-9.8,;-2.15,-10.83,;.46,-10.27,;1.6,-9.24,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,)|

BDBM528378

COc1ncnc(OC)c1-n1c(Cc2ccccc2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |wD:26.29,28.31,(-.87,1.3,;-.55,-.2,;-1.7,-1.23,;-3.16,-.76,;-4.31,-1.79,;-3.99,-3.29,;-2.52,-3.77,;-2.2,-5.28,;-3.35,-6.31,;-1.38,-2.74,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;5.33,,;4,-.77,;2.58,-3.22,;2.1,-4.68,;.56,-4.68,;-.34,-5.93,;.28,-7.33,;-1.12,-7.96,;1.69,-6.71,;.91,-8.74,;.01,-9.99,;2.44,-8.9,;3.35,-7.65,;3.07,-10.31,;4.6,-10.47,;5.23,-11.88,;4.32,-13.12,;4.95,-14.53,;2.79,-12.96,;2.16,-11.55,)|

BDBM528379

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(Cc2ccccc2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |wD:2.1,3.3,(4.88,-7.82,;3.35,-7.65,;2.44,-8.9,;.91,-8.74,;.01,-9.99,;.28,-7.33,;-1.12,-7.96,;1.69,-6.71,;-.34,-5.93,;.56,-4.68,;2.1,-4.68,;2.58,-3.22,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;5.33,,;4,-.77,;.09,-3.22,;-1.38,-2.74,;-1.7,-1.23,;-.55,-.2,;-.87,1.3,;-3.16,-.76,;-4.31,-1.79,;-3.99,-3.29,;-2.52,-3.77,;-2.2,-5.28,;-3.35,-6.31,;3.07,-10.31,;4.6,-10.47,;5.23,-11.88,;4.32,-13.12,;4.95,-14.53,;2.79,-12.96,;2.16,-11.55,)|

BDBM528380

COc1ncnc(OC)c1-n1c(Cc2ccccc2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(C)cn1 |wD:26.29,28.31,(-.87,1.3,;-.55,-.2,;-1.7,-1.23,;-3.16,-.76,;-4.31,-1.79,;-3.99,-3.29,;-2.52,-3.77,;-2.2,-5.28,;-3.35,-6.31,;-1.38,-2.74,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;4,2.31,;5.33,1.54,;5.33,,;4,-.77,;2.58,-3.22,;2.1,-4.68,;.56,-4.68,;-.34,-5.93,;.28,-7.33,;-1.12,-7.96,;1.69,-6.71,;.91,-8.74,;.01,-9.99,;2.44,-8.9,;3.35,-7.65,;3.07,-10.31,;4.6,-10.47,;5.23,-11.88,;4.32,-13.12,;4.95,-14.53,;2.79,-12.96,;2.16,-11.55,)|

BDBM528381

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC2CCC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-1.88,-1.42,;-.97,-.17,;-1.6,1.24,;-.69,2.48,;-1.32,3.89,;.84,2.32,;.68,.79,;1,3.85,;2.37,2.16,;3,.75,;2.23,-.58,;3.26,-1.73,;4.66,-1.1,;6,-1.87,;6,-3.41,;7.09,-4.5,;6,-5.59,;4.91,-4.5,;4.5,.43,;5.65,1.46,;7.11,.99,;7.43,-.52,;8.9,-1,;8.26,2.02,;7.94,3.52,;6.47,4,;5.33,2.97,;3.86,3.44,;3.54,4.95,;-3.13,1.4,;-3.76,2.8,;-5.29,2.96,;-6.19,1.72,;-7.72,1.88,;-5.57,.31,;-4.03,.15,)|

BDBM528382

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC2CCC2)n1C1CCOCC1)c1ncc(Cl)cn1

BDBM528383

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |wD:2.1,3.3,(13.38,-6.31,;11.92,-6.78,;11.6,-8.29,;10.13,-8.77,;9.81,-10.27,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;7.85,-6.7,;6.38,-7.18,;5.91,-8.64,;4.37,-8.64,;3.89,-7.18,;2.42,-6.7,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,)|

BDBM528384

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC2CC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(2.87,-3.9,;3.96,-2.81,;3.56,-1.33,;2.22,-.56,;2.22,.98,;.89,-1.33,;-.44,-2.1,;2.22,-2.1,;-.44,-.56,;-1.78,-1.33,;-2.25,-2.79,;-3.79,-2.79,;-4.27,-1.33,;-5.81,-1.33,;-6.58,-2.66,;-7.91,-3.43,;-6.58,-4.2,;-3.02,-.42,;-3.02,1.12,;-4.36,1.89,;-5.69,1.12,;-7.02,1.89,;-4.36,3.43,;-3.02,4.2,;-1.69,3.43,;-1.69,1.89,;-.36,1.12,;.98,1.89,;4.65,-.24,;6.13,-.64,;7.22,.45,;6.82,1.94,;7.91,3.03,;5.34,2.34,;4.25,1.25,)|

BDBM528385

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC2CCCC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(3.13,-3.45,;4.21,-2.36,;3.82,-.88,;2.48,-.11,;2.48,1.43,;1.15,-.88,;-.18,-1.65,;2.48,-1.65,;-.18,-.11,;-1.52,-.88,;-1.99,-2.34,;-3.53,-2.34,;-4.01,-.88,;-5.55,-.88,;-6.32,-2.21,;-7.85,-2.37,;-8.17,-3.88,;-6.84,-4.65,;-5.69,-3.62,;-2.76,.03,;-2.76,1.57,;-4.1,2.34,;-5.43,1.57,;-6.77,2.34,;-4.1,3.88,;-2.76,4.65,;-1.43,3.88,;-1.43,2.34,;-.1,1.57,;1.24,2.34,;4.91,.21,;6.39,-.19,;7.48,.9,;7.08,2.39,;8.17,3.48,;5.6,2.79,;4.51,1.7,)|

BDBM528386

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC2CCCCC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(3.35,-3.34,;4.44,-2.25,;4.05,-.76,;2.71,.01,;2.71,1.55,;1.38,-.76,;.04,-1.53,;2.71,-1.53,;.04,.01,;-1.29,-.76,;-1.77,-2.23,;-3.31,-2.23,;-3.78,-.76,;-5.32,-.76,;-6.09,-2.1,;-7.63,-2.1,;-8.4,-3.43,;-7.63,-4.76,;-6.09,-4.76,;-5.32,-3.43,;-2.54,.14,;-2.54,1.68,;-3.87,2.45,;-5.2,1.68,;-6.54,2.45,;-3.87,3.99,;-2.54,4.76,;-1.2,3.99,;-1.2,2.45,;.13,1.68,;1.47,2.45,;5.13,.33,;6.62,-.07,;7.71,1.02,;7.31,2.5,;8.4,3.59,;5.82,2.9,;4.74,1.81,)|

BDBM528387

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(F)cccc1F |r,wU:11.11,wD:13.13,(-8.51,-2.17,;-6.97,-2.17,;-6.2,-.84,;-4.66,-.84,;-4.18,-2.3,;-2.64,-2.3,;-2.16,-.84,;-.83,-.07,;.5,-.84,;-.83,-1.61,;1.84,-1.61,;1.84,-.07,;1.84,1.47,;3.17,-.84,;3.17,-2.38,;4.5,-3.15,;4.5,-4.69,;5.84,-2.38,;4.5,-.07,;5.84,-.84,;7.17,-.07,;7.17,1.47,;8.51,2.24,;5.84,2.24,;4.5,1.47,;-3.41,.07,;-3.41,1.61,;-4.74,2.38,;-6.08,1.61,;-4.74,3.92,;-3.41,4.69,;-2.08,3.92,;-2.08,2.38,;-.74,1.61,)|

BDBM528388

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC(C)C)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(4.5,-3.74,;3.17,-2.97,;3.17,-1.43,;1.84,-.66,;1.84,.88,;.5,-1.43,;-.83,-2.2,;1.84,-2.2,;-.83,-.66,;-2.16,-1.43,;-2.64,-2.89,;-4.18,-2.89,;-4.66,-1.43,;-6.2,-1.43,;-6.97,-2.76,;-8.51,-2.76,;-6.2,-4.1,;-3.41,-.52,;-3.41,1.02,;-4.74,1.79,;-6.08,1.02,;-7.41,1.79,;-4.74,3.33,;-3.41,4.1,;-2.08,3.33,;-2.08,1.79,;-.74,1.02,;.59,1.79,;4.5,-.66,;5.84,-1.43,;7.17,-.66,;7.17,.88,;8.51,1.65,;5.84,1.65,;4.5,.88,)|

BDBM528389

COCCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:14.14,12.12,(-8.98,-.03,;-8.66,-1.53,;-7.2,-2.01,;-6.05,-.98,;-4.59,-1.45,;-4.11,-2.92,;-2.57,-2.92,;-2.1,-1.45,;-.63,-.98,;.51,-2.01,;-.26,-3.34,;1.28,-3.34,;1.98,-1.53,;2.3,-.03,;3.12,-2.56,;2.8,-4.07,;4.59,-2.09,;5.73,-3.12,;7.2,-2.64,;7.52,-1.14,;8.98,-.66,;6.37,-.11,;4.91,-.58,;-3.34,-.55,;-3.34,.99,;-4.68,1.76,;-6.01,.99,;-7.34,1.76,;-4.68,3.3,;-3.34,4.07,;-2.01,3.3,;-2.01,1.76,;-.67,.99,;.66,1.76,)|

BDBM528390

COc1ncnc(OC)c1-n1c(CC2COC2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:26.29,24.27,(-7.46,1.76,;-6.13,.99,;-4.8,1.76,;-4.8,3.3,;-3.46,4.07,;-2.13,3.3,;-2.13,1.76,;-.8,.99,;.54,1.76,;-3.46,.99,;-3.46,-.55,;-4.71,-1.45,;-6.17,-.98,;-7.32,-2.01,;-8.86,-2.01,;-8.86,-3.55,;-7.32,-3.55,;-4.23,-2.92,;-2.69,-2.92,;-2.22,-1.45,;-.75,-.98,;.39,-2.01,;-.38,-3.34,;1.16,-3.34,;1.86,-1.53,;2.18,-.03,;3,-2.56,;2.68,-4.07,;4.46,-2.09,;5.61,-3.12,;7.07,-2.64,;7.39,-1.14,;8.86,-.66,;6.25,-.11,;4.79,-.58,)|

BDBM528391

COc1cccc(OC)c1-n1c(CC2COC2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:26.29,24.27,(-7.46,1.76,;-6.13,.99,;-4.8,1.76,;-4.8,3.3,;-3.46,4.07,;-2.13,3.3,;-2.13,1.76,;-.8,.99,;.54,1.76,;-3.46,.99,;-3.46,-.55,;-4.71,-1.45,;-6.17,-.98,;-7.32,-2.01,;-8.86,-2.01,;-8.86,-3.55,;-7.32,-3.55,;-4.23,-2.92,;-2.69,-2.92,;-2.22,-1.45,;-.75,-.98,;.39,-2.01,;-.38,-3.34,;1.16,-3.34,;1.86,-1.53,;2.18,-.03,;3,-2.56,;2.68,-4.07,;4.46,-2.09,;5.61,-3.12,;7.07,-2.64,;7.39,-1.14,;8.86,-.66,;6.25,-.11,;4.79,-.58,)|

BDBM528392

COc1cccc(OC)c1-n1c(Cc2ccccn2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:28.31,26.29,(-6.93,2,;-5.6,1.23,;-4.26,2,;-4.26,3.54,;-2.93,4.31,;-1.6,3.54,;-1.6,2,;-.26,1.23,;1.07,2,;-2.93,1.23,;-2.93,-.31,;-4.18,-1.22,;-5.64,-.74,;-6.78,-1.77,;-8.25,-1.3,;-9.39,-2.33,;-9.07,-3.83,;-7.61,-4.31,;-6.46,-3.28,;-3.7,-2.68,;-2.16,-2.68,;-1.68,-1.22,;-.22,-.74,;.93,-1.77,;.16,-3.11,;1.7,-3.11,;2.39,-1.3,;2.71,.21,;3.53,-2.33,;3.21,-3.83,;5,-1.85,;6.14,-2.88,;7.61,-2.4,;7.93,-.9,;9.39,-.42,;6.78,.13,;5.32,-.34,)|

BDBM528393

COc1cccc(OC)c1-n1c(CCc2ccco2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:28.31,26.29,(-6.26,1.76,;-4.92,.99,;-3.59,1.76,;-3.59,3.3,;-2.26,4.07,;-.92,3.3,;-.92,1.76,;.41,.99,;1.75,1.76,;-2.26,.99,;-2.26,-.55,;-3.5,-1.45,;-4.97,-.98,;-6.11,-2.01,;-7.58,-1.53,;-8.05,-.07,;-9.59,-.07,;-10.07,-1.53,;-8.82,-2.44,;-3.03,-2.92,;-1.49,-2.92,;-1.01,-1.45,;.45,-.98,;1.6,-2.01,;.83,-3.34,;2.37,-3.34,;3.06,-1.53,;3.38,-.03,;4.21,-2.56,;3.89,-4.07,;5.67,-2.09,;6.82,-3.12,;8.28,-2.64,;8.6,-1.14,;10.07,-.66,;7.46,-.11,;5.99,-.58,)|

BDBM528394

COc1cccc(OC)c1-n1c(CS(C)(=O)=O)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:26.28,24.26,(-7.5,1.76,;-6.17,.99,;-4.84,1.76,;-4.84,3.3,;-3.5,4.07,;-2.17,3.3,;-2.17,1.76,;-.83,.99,;.5,1.76,;-3.5,.99,;-3.5,-.55,;-4.75,-1.45,;-6.21,-.98,;-7.36,-2.01,;-8.82,-1.53,;-7.76,-3.5,;-6.27,-3.1,;-4.27,-2.92,;-2.73,-2.92,;-2.26,-1.45,;-.79,-.98,;.35,-2.01,;-.42,-3.34,;1.12,-3.34,;1.82,-1.53,;2.14,-.03,;2.96,-2.56,;2.64,-4.07,;4.43,-2.09,;5.57,-3.12,;7.04,-2.64,;7.36,-1.14,;8.82,-.66,;6.21,-.11,;4.75,-.58,)|

BDBM528395

COc1cccc(OC)c1-n1c(Cc2ccsc2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:27.30,25.28,(-7.1,1.81,;-5.76,1.04,;-4.43,1.81,;-4.43,3.35,;-3.1,4.12,;-1.76,3.35,;-1.76,1.81,;-.43,1.04,;.91,1.81,;-3.1,1.04,;-3.1,-.5,;-4.34,-1.41,;-5.81,-.93,;-6.95,-1.96,;-8.46,-1.64,;-9.23,-2.97,;-8.2,-4.12,;-6.79,-3.49,;-3.87,-2.87,;-2.33,-2.87,;-1.85,-1.41,;-.39,-.93,;.76,-1.96,;-.01,-3.29,;1.53,-3.29,;2.22,-1.49,;2.54,.02,;3.37,-2.52,;3.05,-4.02,;4.83,-2.04,;5.98,-3.07,;7.44,-2.59,;7.76,-1.09,;9.23,-.61,;6.62,-.06,;5.15,-.53,)|

BDBM528396

COc1cccc(OC)c1-n1c(Cc2cc[nH]n2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:27.30,25.28,(-7.1,1.81,;-5.76,1.04,;-4.43,1.81,;-4.43,3.35,;-3.1,4.12,;-1.76,3.35,;-1.76,1.81,;-.43,1.04,;.91,1.81,;-3.1,1.04,;-3.1,-.5,;-4.34,-1.41,;-5.81,-.93,;-6.95,-1.96,;-8.46,-1.64,;-9.23,-2.97,;-8.2,-4.12,;-6.79,-3.49,;-3.87,-2.87,;-2.33,-2.87,;-1.85,-1.41,;-.39,-.93,;.76,-1.96,;-.01,-3.29,;1.53,-3.29,;2.22,-1.49,;2.54,.02,;3.37,-2.52,;3.05,-4.02,;4.83,-2.04,;5.98,-3.07,;7.44,-2.59,;7.76,-1.09,;9.23,-.61,;6.62,-.06,;5.15,-.53,)|

BDBM528397

COc1cccc(OC)c1-n1c(CC(C)(C)OC)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:27.29,25.27,(-7.34,1.76,;-6.01,.99,;-4.68,1.76,;-4.68,3.3,;-3.34,4.07,;-2.01,3.3,;-2.01,1.76,;-.67,.99,;.66,1.76,;-3.34,.99,;-3.34,-.55,;-4.59,-1.45,;-6.05,-.98,;-7.2,-2.01,;-6.88,-3.52,;-8.34,-3.04,;-8.66,-1.53,;-8.98,-.03,;-4.11,-2.92,;-2.57,-2.92,;-2.1,-1.45,;-.63,-.98,;.51,-2.01,;-.26,-3.34,;1.28,-3.34,;1.98,-1.53,;2.3,-.03,;3.12,-2.56,;2.8,-4.07,;4.59,-2.09,;5.73,-3.12,;7.2,-2.64,;7.52,-1.14,;8.98,-.66,;6.37,-.11,;4.91,-.58,)|

BDBM528398

COc1cccc(OC)c1-n1c(CN2CCCC2=O)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:28.31,26.29,(-7.1,1.81,;-5.76,1.04,;-4.43,1.81,;-4.43,3.35,;-3.1,4.12,;-1.76,3.35,;-1.76,1.81,;-.43,1.04,;.91,1.81,;-3.1,1.04,;-3.1,-.5,;-4.34,-1.41,;-5.81,-.93,;-6.95,-1.96,;-6.79,-3.49,;-8.2,-4.12,;-9.23,-2.97,;-8.46,-1.64,;-9.08,-.23,;-3.87,-2.87,;-2.33,-2.87,;-1.85,-1.41,;-.39,-.93,;.76,-1.96,;-.01,-3.29,;1.53,-3.29,;2.22,-1.49,;2.54,.02,;3.37,-2.52,;3.05,-4.02,;4.83,-2.04,;5.98,-3.07,;7.44,-2.59,;7.76,-1.09,;9.23,-.61,;6.62,-.06,;5.15,-.53,)|

BDBM528399

COc1cccc(OC)c1-n1c(Cn2ccccc2=O)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:29.32,27.30,(-6.93,2,;-5.6,1.23,;-4.26,2,;-4.26,3.54,;-2.93,4.31,;-1.6,3.54,;-1.6,2,;-.26,1.23,;1.07,2,;-2.93,1.23,;-2.93,-.31,;-4.18,-1.22,;-5.64,-.74,;-6.78,-1.77,;-6.46,-3.28,;-7.61,-4.31,;-9.07,-3.83,;-9.39,-2.33,;-8.25,-1.3,;-8.57,.21,;-3.7,-2.68,;-2.16,-2.68,;-1.68,-1.22,;-.22,-.74,;.93,-1.77,;.16,-3.11,;1.7,-3.11,;2.39,-1.3,;2.71,.21,;3.53,-2.33,;3.21,-3.83,;5,-1.85,;6.14,-2.88,;7.61,-2.4,;7.93,-.9,;9.39,-.42,;6.78,.13,;5.32,-.34,)|

BDBM528400

COc1cccc(OC)c1-n1c(Cc2cccs2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:27.30,25.28,(-7.1,1.81,;-5.76,1.04,;-4.43,1.81,;-4.43,3.35,;-3.1,4.12,;-1.76,3.35,;-1.76,1.81,;-.43,1.04,;.91,1.81,;-3.1,1.04,;-3.1,-.5,;-4.34,-1.41,;-5.81,-.93,;-6.95,-1.96,;-8.46,-1.64,;-9.23,-2.97,;-8.2,-4.12,;-6.79,-3.49,;-3.87,-2.87,;-2.33,-2.87,;-1.85,-1.41,;-.39,-.93,;.76,-1.96,;-.01,-3.29,;1.53,-3.29,;2.22,-1.49,;2.54,.02,;3.37,-2.52,;3.05,-4.02,;4.83,-2.04,;5.98,-3.07,;7.44,-2.59,;7.76,-1.09,;9.23,-.61,;6.62,-.06,;5.15,-.53,)|

BDBM528401

COc1cccc(OC)c1-n1c(Cc2nc(C)cs2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:28.31,26.29,(-6.33,1.81,;-5,1.04,;-3.66,1.81,;-3.66,3.35,;-2.33,4.12,;-1,3.35,;-1,1.81,;.34,1.04,;1.67,1.81,;-2.33,1.04,;-2.33,-.5,;-3.58,-1.41,;-5.04,-.93,;-6.18,-1.96,;-7.69,-1.64,;-8.46,-2.97,;-9.99,-3.14,;-7.43,-4.12,;-6.02,-3.49,;-3.1,-2.87,;-1.56,-2.87,;-1.08,-1.41,;.38,-.93,;1.53,-1.96,;.76,-3.29,;2.3,-3.29,;2.99,-1.49,;3.31,.02,;4.13,-2.52,;3.81,-4.02,;5.6,-2.04,;6.74,-3.07,;8.21,-2.59,;8.53,-1.09,;9.99,-.61,;7.38,-.06,;5.92,-.53,)|

BDBM528402

COc1cccc(OC)c1-n1c(Cc2ccncc2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:28.31,26.29,(-6.93,2,;-5.6,1.23,;-4.26,2,;-4.26,3.54,;-2.93,4.31,;-1.6,3.54,;-1.6,2,;-.26,1.23,;1.07,2,;-2.93,1.23,;-2.93,-.31,;-4.18,-1.22,;-5.64,-.74,;-6.78,-1.77,;-8.25,-1.3,;-9.39,-2.33,;-9.07,-3.83,;-7.61,-4.31,;-6.46,-3.28,;-3.7,-2.68,;-2.16,-2.68,;-1.68,-1.22,;-.22,-.74,;.93,-1.77,;.16,-3.11,;1.7,-3.11,;2.39,-1.3,;2.71,.21,;3.53,-2.33,;3.21,-3.83,;5,-1.85,;6.14,-2.88,;7.61,-2.4,;7.93,-.9,;9.39,-.42,;6.78,.13,;5.32,-.34,)|

BDBM528403

COc1cccc(OC)c1-n1c(C[C@@H]2CCCO2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:13.13,27.30,25.28,(-7.1,1.81,;-5.76,1.04,;-4.43,1.81,;-4.43,3.35,;-3.1,4.12,;-1.76,3.35,;-1.76,1.81,;-.43,1.04,;.91,1.81,;-3.1,1.04,;-3.1,-.5,;-4.34,-1.41,;-5.81,-.93,;-6.95,-1.96,;-8.46,-1.64,;-9.23,-2.97,;-8.2,-4.12,;-6.79,-3.49,;-3.87,-2.87,;-2.33,-2.87,;-1.85,-1.41,;-.39,-.93,;.76,-1.96,;-.01,-3.29,;1.53,-3.29,;2.22,-1.49,;2.54,.02,;3.37,-2.52,;3.05,-4.02,;4.83,-2.04,;5.98,-3.07,;7.44,-2.59,;7.76,-1.09,;9.23,-.61,;6.62,-.06,;5.15,-.53,)|

BDBM528404

COc1cccc(OC)c1-n1c(C[C@@H]2CCS(=O)(=O)C2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:13.13,29.32,27.30,(-7.07,2.55,;-5.73,1.78,;-4.4,2.55,;-4.4,4.09,;-3.07,4.86,;-1.73,4.09,;-1.73,2.55,;-.4,1.78,;.93,2.55,;-3.07,1.78,;-3.07,.24,;-4.31,-.66,;-5.78,-.19,;-6.92,-1.22,;-8.43,-.9,;-9.2,-2.23,;-8.17,-3.38,;-7.77,-4.86,;-9.26,-4.46,;-6.76,-2.75,;-3.84,-2.13,;-2.3,-2.13,;-1.82,-.66,;-.36,-.19,;.79,-1.22,;.02,-2.55,;1.56,-2.55,;2.25,-.74,;2.57,.77,;3.4,-1.77,;3.08,-3.28,;4.86,-1.3,;6.01,-2.33,;7.47,-1.85,;7.79,-.34,;9.26,.13,;6.65,.69,;5.18,.21,)|

BDBM528406

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(Cc2ccc(OC)cc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.6,-2.5,;4.27,-1.73,;4.27,-.19,;2.93,.58,;2.93,2.12,;1.6,-.19,;.27,-.96,;2.93,-.96,;.27,.58,;-1.07,-.19,;-1.54,-1.65,;-3.08,-1.65,;-3.56,-.19,;-5.02,.29,;-6.17,-.74,;-7.63,-.27,;-8.78,-1.3,;-8.46,-2.8,;-9.6,-3.83,;-9.28,-5.34,;-6.99,-3.28,;-5.85,-2.25,;-2.31,.72,;-2.31,2.26,;-3.65,3.03,;-4.98,2.26,;-6.31,3.03,;-3.65,4.57,;-2.31,5.34,;-.98,4.57,;-.98,3.03,;.35,2.26,;1.69,3.03,;5.6,.58,;6.93,-.19,;8.27,.58,;8.27,2.12,;9.6,2.89,;6.93,2.89,;5.6,2.12,)|

BDBM528407

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(Cc2ccc(F)cc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.6,-3.25,;4.27,-2.48,;4.27,-.94,;2.93,-.17,;2.93,1.37,;1.6,-.94,;.27,-1.71,;2.93,-1.71,;.27,-.17,;-1.07,-.94,;-1.54,-2.4,;-3.08,-2.4,;-3.56,-.94,;-5.02,-.46,;-6.17,-1.49,;-7.63,-1.02,;-8.78,-2.05,;-8.46,-3.56,;-9.6,-4.59,;-6.99,-4.03,;-5.85,-3,;-2.31,-.03,;-2.31,1.51,;-3.65,2.28,;-4.98,1.51,;-6.31,2.28,;-3.65,3.82,;-2.31,4.59,;-.98,3.82,;-.98,2.28,;.35,1.51,;1.69,2.28,;5.6,-.17,;6.93,-.94,;8.27,-.17,;8.27,1.37,;9.6,2.14,;6.93,2.14,;5.6,1.37,)|

BDBM528408

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CCN(C)C)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.19,-3.92,;3.86,-3.15,;3.86,-1.61,;2.52,-.84,;2.52,.7,;1.19,-1.61,;-.15,-2.38,;2.52,-2.38,;-.15,-.84,;-1.48,-1.61,;-1.96,-3.07,;-3.5,-3.07,;-3.97,-1.61,;-5.44,-1.13,;-6.58,-2.16,;-8.05,-1.69,;-9.19,-2.72,;-8.37,-.18,;-2.73,-.7,;-2.73,.84,;-4.06,1.61,;-5.39,.84,;-6.73,1.61,;-4.06,3.15,;-2.73,3.92,;-1.39,3.15,;-1.39,1.61,;-.06,.84,;1.28,1.61,;5.19,-.84,;6.52,-1.61,;7.86,-.84,;7.86,.7,;9.19,1.47,;6.52,1.47,;5.19,.7,)|

BDBM528409

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CN2CCCCCC2=O)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.35,-3.33,;4.02,-2.56,;4.02,-1.02,;2.68,-.25,;2.68,1.29,;1.35,-1.02,;.01,-1.79,;2.68,-1.79,;.01,-.25,;-1.32,-1.02,;-1.8,-2.48,;-3.34,-2.48,;-3.81,-1.02,;-5.28,-.54,;-6.42,-1.57,;-5.91,-3.03,;-6.73,-4.33,;-8.26,-4.5,;-9.35,-3.42,;-9.18,-1.89,;-7.87,-1.07,;-8.05,.46,;-2.57,-.12,;-2.57,1.42,;-3.9,2.19,;-5.23,1.42,;-6.57,2.19,;-3.9,3.73,;-2.57,4.5,;-1.23,3.73,;-1.23,2.19,;.1,1.42,;1.44,2.19,;5.35,-.25,;6.68,-1.02,;8.02,-.25,;8.02,1.29,;9.35,2.06,;6.68,2.06,;5.35,1.29,)|

BDBM528410

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CCN2CCN(C)CC2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(6.81,-3.92,;5.48,-3.15,;5.48,-1.61,;4.15,-.84,;4.15,.7,;2.81,-1.61,;1.48,-2.38,;4.15,-2.38,;1.48,-.84,;.15,-1.61,;-.33,-3.07,;-1.87,-3.07,;-2.35,-1.61,;-3.81,-1.13,;-4.96,-2.16,;-6.42,-1.69,;-6.74,-.18,;-8.21,.3,;-9.35,-.73,;-10.81,-.26,;-9.03,-2.24,;-7.57,-2.72,;-1.1,-.7,;-1.1,.84,;-2.43,1.61,;-3.77,.84,;-5.1,1.61,;-2.43,3.15,;-1.1,3.92,;.23,3.15,;.23,1.61,;1.57,.84,;2.9,1.61,;6.81,-.84,;8.15,-1.61,;9.48,-.84,;9.48,.7,;10.81,1.47,;8.15,1.47,;6.81,.7,)|

BDBM528411

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(Cc2ccccc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.19,-3.53,;3.86,-2.76,;3.86,-1.22,;2.52,-.45,;2.52,1.09,;1.19,-1.22,;-.15,-1.99,;2.52,-1.99,;-.15,-.45,;-1.48,-1.22,;-1.96,-2.68,;-3.5,-2.68,;-3.97,-1.22,;-5.44,-.74,;-6.58,-1.77,;-8.05,-1.3,;-9.19,-2.33,;-8.87,-3.83,;-7.4,-4.31,;-6.26,-3.28,;-2.73,-.31,;-2.73,1.23,;-4.06,2,;-5.39,1.23,;-6.73,2,;-4.06,3.54,;-2.73,4.31,;-1.39,3.54,;-1.39,2,;-.06,1.23,;1.28,2,;5.19,-.45,;6.52,-1.22,;7.86,-.45,;7.86,1.09,;9.19,1.86,;6.52,1.86,;5.19,1.09,)|

BDBM528412

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C)n1C1(C)CC1)c1ncc(Cl)cn1

BDBM528413

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C[C@H]2CCCO2)n1C1(C)CC1)c1ncc(Cl)cn1

BDBM528415

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)ncnc1OC |wD:11.11,13.13,(.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,-2.31,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,)|

BDBM528416

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1C1(C)CC1

BDBM528417

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |wD:13.13,11.11,(-.18,-7.26,;1.28,-7.73,;2.42,-6.7,;3.89,-7.18,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;13.38,-6.31,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,)|

BDBM528418

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |wD:11.11,13.13,(-.18,-7.26,;1.28,-7.73,;2.42,-6.7,;3.89,-7.18,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,)|

BDBM528419

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |wU:13.13,11.11,(13.12,-2.64,;11.66,-3.11,;10.51,-2.08,;9.05,-2.56,;8.57,-4.02,;7.03,-4.02,;6.56,-2.56,;5.09,-2.08,;3.95,-3.11,;2.92,-1.97,;4.98,-4.26,;2.8,-4.15,;3.12,-5.65,;1.34,-3.67,;.19,-4.7,;.51,-6.21,;1.98,-6.68,;-.63,-7.24,;1.02,-2.16,;-.45,-1.69,;-.77,-.18,;.38,.85,;.06,2.36,;1.84,.37,;2.16,-1.13,;7.8,-1.65,;7.8,-.11,;9.14,.66,;10.47,-.11,;11.8,.66,;9.14,2.2,;7.8,2.97,;6.47,2.2,;6.47,.66,;5.14,-.11,;3.8,.66,)|

BDBM528420

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1C1CCOCC1

BDBM528421

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CO)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528422

CC(C)(C)OC(=O)NNC(=O)COC(F)F

BDBM528423

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COC(F)F)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.05,-6.25,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528424

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC(F)(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.98,-6.71,;3.79,-7.96,;1.76,-8.74,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528425

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |wD:11.11,13.13,(-.18,-7.26,;1.28,-7.73,;2.42,-6.7,;3.89,-7.18,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,)|

BDBM528426

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COC(C)C)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.05,-6.25,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528427

CCOCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |wD:12.12,14.14,(-.05,-6.25,;.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,-2.31,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,)|

BDBM528475

CCOCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |wU:14.14,wD:12.12,(-.05,-6.25,;.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,-2.31,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,)|

BDBM528428

CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COC)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |wD:3.2,4.4,(11.1,-4.25,;10.78,-5.75,;11.92,-6.78,;11.6,-8.29,;10.13,-8.77,;9.81,-10.27,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;7.85,-6.7,;6.38,-7.18,;5.91,-8.64,;4.37,-8.64,;3.89,-7.18,;2.42,-6.7,;1.28,-7.73,;-.18,-7.26,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,;12.74,-9.32,;14.21,-8.84,;15.35,-9.87,;15.03,-11.38,;16.18,-12.41,;13.57,-11.86,;12.42,-10.83,)|

BDBM528429

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2cnc(OC)cn2)n1-c1c(OC)cccc1OC |wD:11.11,13.13,(-.18,-7.26,;1.28,-7.73,;2.42,-6.7,;3.89,-7.18,;4.37,-8.64,;5.91,-8.64,;6.38,-7.18,;7.85,-6.7,;8.99,-7.73,;7.96,-8.88,;10.02,-6.59,;10.13,-8.77,;9.81,-10.27,;11.6,-8.29,;11.92,-6.78,;12.74,-9.32,;12.42,-10.83,;13.57,-11.86,;15.03,-11.38,;16.18,-12.41,;15.86,-13.92,;15.35,-9.87,;14.21,-8.84,;5.14,-6.27,;5.14,-4.73,;6.47,-3.96,;7.8,-4.73,;9.14,-3.96,;6.47,-2.42,;5.14,-1.65,;3.8,-2.42,;3.8,-3.96,;2.47,-4.73,;1.13,-3.96,)|

BDBM528430

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ccc(Cl)cn2)n1-c1c(OC)cccc1OC |wD:11.11,13.13,(.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,)|

BDBM528431

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ccc(Cl)cn2)n1-c1c(OC)cccc1OC |wD:11.11,13.13,(.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,-2.31,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,)|

BDBM528432

COCc1nnc(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |wD:11.10,(-7.99,-8.68,;-6.52,-9.16,;-5.38,-8.13,;-3.91,-8.61,;-3.44,-10.07,;-1.9,-10.07,;-1.42,-8.61,;.04,-8.13,;1.19,-9.16,;.16,-10.3,;2.22,-8.02,;2.33,-10.19,;2.01,-11.7,;3.16,-12.73,;4.62,-12.25,;4.94,-10.74,;3.8,-9.71,;6.41,-10.27,;6.73,-8.76,;8.19,-8.29,;9.34,-9.32,;10.8,-8.84,;9.01,-10.82,;7.55,-11.3,;-2.67,-7.7,;-2.67,-6.16,;-1.33,-5.39,;,-6.16,;1.33,-5.39,;-1.33,-3.85,;-2.67,-3.08,;-4,-3.85,;-4,-5.39,;-5.33,-6.16,;-6.67,-5.39,)|

BDBM528434

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COC(C)C)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.05,-6.25,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528435

COc1ncnc(OC)c1-n1c(COC(C)C)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |wD:24.26,26.28,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.05,-6.25,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528436

COCC(COC)n1c(COC)nnc1NS(=O)(=O)[C@@H](C)[C@H](OC)c1ncc(Cl)cn1

BDBM528437

COc1ncnc(OC)c1-n1c(COC(F)F)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |wD:24.26,26.28,(6.01,-6.31,;4.87,-5.28,;5.19,-3.77,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;4.04,-2.74,;2.58,-3.22,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.05,-6.25,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528438

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COC(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.05,-6.25,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528440

COCc1nnc(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(OC)cn2)n1-c1c(OC)cccc1OC |wU:11.11,13.13,(.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,,;-2.67,-1.54,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-9.34,2.31,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,)|

BDBM528441

COCc1nnc(NS(=O)(=O)[C@H](OC)[C@@H](C)c2ncc(Cl)cn2)n1-c1c(F)cccc1F |wU:14.14,11.11,(.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,3.08,;-2.67,,;-2.67,-1.54,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,)|

BDBM528442

COCc1nnc(NS(=O)(=O)[C@H](OC)[C@@H](C)c2ncc(Cl)cn2)n1-c1ccccc1OC |wU:14.14,11.11,(.85,-7.49,;2.38,-7.33,;3.01,-5.93,;2.1,-4.68,;.56,-4.68,;.09,-3.22,;1.33,-2.31,;1.33,-.77,;;-.77,-1.33,;.77,1.33,;-1.33,.77,;-1.33,2.31,;-2.67,3.08,;-2.67,,;-2.67,-1.54,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,;2.58,-3.22,;4.04,-2.74,;4.36,-1.23,;5.83,-.76,;6.97,-1.79,;6.65,-3.29,;5.19,-3.77,;4.87,-5.28,;5.49,-6.68,)|

BDBM528443

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C(C)C)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(3.96,-3.92,;2.62,-3.15,;2.62,-1.61,;1.29,-.84,;1.29,.7,;-.04,-1.61,;-1.38,-2.38,;1.29,-2.38,;-1.38,-.84,;-2.71,-1.61,;-3.19,-3.07,;-4.73,-3.07,;-5.2,-1.61,;-6.74,-1.61,;-7.51,-2.94,;-7.51,-.27,;-3.96,-.7,;-3.96,.84,;-5.29,1.61,;-6.62,.84,;-7.96,1.61,;-5.29,3.15,;-3.96,3.92,;-2.62,3.15,;-2.62,1.61,;-1.29,.84,;.04,1.61,;3.96,-.84,;5.29,-1.61,;6.62,-.84,;6.62,.7,;7.96,1.47,;5.29,1.47,;3.96,.7,)|

BDBM528444

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC(C)C)c2ncc(Cl)cn2)nnc1C(C)C |r,wU:18.19,16.17,(-7.96,1.61,;-6.62,.84,;-5.29,1.61,;-5.29,3.15,;-3.96,3.92,;-2.62,3.15,;-2.62,1.61,;-1.29,.84,;.04,1.61,;-3.96,.84,;-3.96,-.7,;-2.71,-1.61,;-1.38,-.84,;-.04,-1.61,;-1.38,-2.38,;1.29,-2.38,;1.29,-.84,;1.29,.7,;2.62,-1.61,;2.62,-3.15,;3.96,-3.92,;3.96,-5.46,;5.29,-3.15,;3.96,-.84,;5.29,-1.61,;6.62,-.84,;6.62,.7,;7.96,1.47,;5.29,1.47,;3.96,.7,;-3.19,-3.07,;-4.73,-3.07,;-5.2,-1.61,;-6.74,-1.61,;-7.51,-2.94,;-7.51,-.27,)|

BDBM528445

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COCC(F)(F)F)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |wD:3.3,2.1,(-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-1.33,2.31,;;-.77,-1.33,;.77,1.33,;1.33,-.77,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;3.01,-5.93,;2.38,-7.33,;.85,-7.49,;.22,-8.9,;-.4,-10.31,;-1.18,-8.27,;1.63,-9.53,;2.58,-3.22,;4.04,-2.74,;5.19,-3.77,;4.87,-5.28,;6.01,-6.31,;6.65,-3.29,;6.97,-1.79,;5.83,-.76,;4.36,-1.23,;3.22,-.2,;3.54,1.3,;-4,.77,;-4,2.31,;-5.33,3.08,;-6.67,2.31,;-8,3.08,;-6.67,.77,;-5.33,,)|

BDBM528446

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(n1-c1c(OC)ncnc1OC)C(F)(F)c1ccccn1)c1ncc(Cl)cn1 |wD:3.3,2.1,(-3.1,-1.74,;-2.07,-.6,;-2.55,.87,;-1.52,2.01,;-1.99,3.48,;-.01,1.69,;-.33,.19,;.31,3.2,;1.5,1.37,;1.97,-.09,;1.07,-1.34,;1.97,-2.58,;3.44,-2.11,;3.44,-.57,;4.68,.34,;6.09,-.29,;6.25,-1.82,;7.66,-2.45,;7.34,.62,;7.18,2.15,;5.77,2.77,;4.52,1.87,;3.12,2.5,;2.95,4.03,;4.68,-3.01,;6.22,-3.01,;5.16,-1.55,;4.52,-4.54,;3.12,-5.17,;2.95,-6.7,;4.2,-7.61,;5.61,-6.98,;5.77,-5.45,;-4.05,1.19,;-4.53,2.65,;-6.03,2.97,;-7.07,1.83,;-8.57,2.15,;-6.59,.36,;-5.08,.04,)|

BDBM528447

COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1C(F)(F)c1ccccn1 |wD:16.17,18.19,(7.66,-2.45,;6.25,-1.82,;6.09,-.29,;7.34,.62,;7.18,2.15,;5.77,2.77,;4.52,1.87,;3.12,2.5,;2.95,4.03,;4.68,.34,;3.44,-.57,;1.97,-.09,;1.5,1.37,;-.01,1.69,;-.33,.19,;.31,3.2,;-1.52,2.01,;-1.99,3.48,;-2.55,.87,;-2.07,-.6,;-4.05,1.19,;-4.53,2.65,;-6.03,2.97,;-7.07,1.83,;-8.57,2.15,;-6.59,.36,;-5.08,.04,;1.07,-1.34,;1.97,-2.58,;3.44,-2.11,;4.68,-3.01,;6.22,-3.01,;5.16,-1.55,;4.52,-4.54,;3.12,-5.17,;2.95,-6.7,;4.2,-7.61,;5.61,-6.98,;5.77,-5.45,)|

BDBM528448

COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(C)cn2)nnc1C(C)(C)c1ccccc1 |wD:16.17,18.19,(7.66,-2.45,;6.25,-1.82,;6.09,-.29,;7.34,.62,;7.18,2.15,;5.77,2.77,;4.52,1.87,;3.12,2.5,;2.95,4.03,;4.68,.34,;3.44,-.57,;1.97,-.09,;1.5,1.37,;-.01,1.69,;-.33,.19,;.31,3.2,;-1.52,2.01,;-1.99,3.48,;-2.55,.87,;-2.07,-.6,;-4.05,1.19,;-4.53,2.65,;-6.03,2.97,;-7.07,1.83,;-8.57,2.15,;-6.59,.36,;-5.08,.04,;1.07,-1.34,;1.97,-2.58,;3.44,-2.11,;4.68,-3.01,;6.22,-3.01,;5.16,-1.55,;4.52,-4.54,;3.12,-5.17,;2.95,-6.7,;4.2,-7.61,;5.61,-6.98,;5.77,-5.45,)|

BDBM528449

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(CC(F)(F)F)n1C1CCOCC1)c1ncccn1

BDBM528450

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(OC)n1C1(CC1)c1cccnc1)c1ncc(Cl)cn1

BDBM528451

COc1cccc(OC)c1-n1c(Cc2ccncc2)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:26.29,28.31,(1.21,2,;-.12,1.23,;-1.46,2,;-1.46,3.54,;-2.79,4.31,;-4.12,3.54,;-4.12,2,;-5.46,1.23,;-6.79,2,;-2.79,1.23,;-2.79,-.31,;-4.04,-1.22,;-5.5,-.74,;-6.65,-1.77,;-8.11,-1.3,;-9.26,-2.33,;-8.93,-3.83,;-7.47,-4.31,;-6.33,-3.28,;-3.56,-2.68,;-2.02,-2.68,;-1.55,-1.22,;-.08,-.74,;1.25,-1.51,;-.08,-2.28,;2.59,-2.28,;2.59,-.74,;2.59,.8,;3.92,-1.51,;3.92,-3.05,;5.25,-.74,;6.59,-1.51,;7.92,-.74,;7.92,.8,;9.26,1.57,;6.59,1.57,;5.25,.8,)|

BDBM528452

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1C(C)C |r|

BDBM528453

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1C1(COC)CC1 |r|

BDBM528454

COCCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1C(COC)COC |r|

BDBM528455

CCC(CC)n1c(COC)nnc1NS(=O)(=O)[C@@H](C)[C@H](OC)c1ncc(Cl)cn1 |r|

BDBM528456

COCCOCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:14.14,16.16,(-10.71,-3.74,;-9.62,-2.66,;-8.13,-3.05,;-7.04,-1.97,;-5.55,-2.36,;-4.47,-1.28,;-2.98,-1.67,;-2.5,-3.14,;-.96,-3.14,;-.49,-1.67,;.85,-.9,;2.18,-1.67,;.85,-2.44,;3.27,-2.76,;3.67,-1.28,;4.07,.21,;4.76,-2.36,;4.36,-3.85,;6.24,-1.97,;7.33,-3.05,;8.82,-2.66,;9.22,-1.17,;10.71,-.77,;8.13,-.08,;6.64,-.48,;-1.73,-.77,;-1.73,.77,;-3.07,1.54,;-4.4,.77,;-5.73,1.54,;-3.07,3.08,;-1.73,3.85,;-.4,3.08,;-.4,1.54,;.94,.77,;2.27,1.54,)|

BDBM528457

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,wD:13.13,(-7.91,-.07,;-6.58,-.84,;-5.25,-.07,;-3.91,-.84,;-3.44,-2.3,;-1.9,-2.3,;-1.42,-.84,;-.09,-.07,;1.25,-.84,;-.09,-1.61,;2.58,-1.61,;2.58,-.07,;2.58,1.47,;3.91,-.84,;3.91,-2.38,;5.25,-3.15,;5.25,-4.69,;6.58,-2.38,;5.25,-.07,;6.58,-.84,;7.91,-.07,;7.91,1.47,;9.25,2.24,;6.58,2.24,;5.25,1.47,;-2.67,.07,;-2.67,1.61,;-4,2.38,;-5.33,1.61,;-6.67,2.38,;-4,3.92,;-2.67,4.69,;-1.33,3.92,;-1.33,2.38,;,1.61,;1.33,2.38,)|

BDBM528458

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,wD:13.13,(-7.91,-.07,;-6.58,-.84,;-5.25,-.07,;-3.91,-.84,;-3.44,-2.3,;-1.9,-2.3,;-1.42,-.84,;-.09,-.07,;1.25,-.84,;-.09,-1.61,;2.58,-1.61,;2.58,-.07,;2.58,1.47,;3.91,-.84,;3.91,-2.38,;5.25,-3.15,;5.25,-4.69,;6.58,-2.38,;5.25,-.07,;6.58,-.84,;7.91,-.07,;7.91,1.47,;9.25,2.24,;6.58,2.24,;5.25,1.47,;-2.67,.07,;-2.67,1.61,;-4,2.38,;-5.33,1.61,;-6.67,2.38,;-4,3.92,;-2.67,4.69,;-1.33,3.92,;-1.33,2.38,;,1.61,;1.33,2.38,)|

BDBM528459

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,wD:13.13,(-8.58,-.07,;-7.25,-.84,;-5.91,-.07,;-4.58,-.84,;-4.1,-2.3,;-2.56,-2.3,;-2.09,-.84,;-.75,-.07,;.58,-.84,;-.75,-1.61,;1.91,-1.61,;1.91,-.07,;1.91,1.47,;3.25,-.84,;3.25,-2.38,;4.58,-3.15,;4.58,-4.69,;5.91,-2.38,;4.58,-.07,;5.91,-.84,;7.25,-.07,;7.25,1.47,;8.58,2.24,;5.91,2.24,;4.58,1.47,;-3.33,.07,;-3.33,1.61,;-4.67,2.38,;-6,1.61,;-7.34,2.38,;-4.67,3.92,;-3.33,4.69,;-2,3.92,;-2,2.38,;-.67,1.61,;.67,2.38,)|

BDBM528460

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ccc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:11.11,wD:13.13,(-8.58,-.07,;-7.25,-.84,;-5.91,-.07,;-4.58,-.84,;-4.1,-2.3,;-2.56,-2.3,;-2.09,-.84,;-.75,-.07,;.58,-.84,;-.75,-1.61,;1.91,-1.61,;1.91,-.07,;1.91,1.47,;3.25,-.84,;3.25,-2.38,;4.58,-3.15,;4.58,-4.69,;5.91,-2.38,;4.58,-.07,;4.58,1.47,;5.91,2.24,;7.25,1.47,;8.58,2.24,;7.25,-.07,;5.91,-.84,;-3.33,.07,;-3.33,1.61,;-4.67,2.38,;-6,1.61,;-7.34,2.38,;-4.67,3.92,;-3.33,4.69,;-2,3.92,;-2,2.38,;-.67,1.61,;.67,2.38,)|

BDBM528461

COCCn1c(COC)nnc1NS(=O)(=O)[C@@H](C)[C@H](OC)c1ncc(Cl)cn1 |r|

BDBM528462

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(Cl)cccc1Cl |r,wU:11.11,13.13,(-8.58,-.84,;-7.25,-1.61,;-5.91,-.84,;-4.58,-1.61,;-4.1,-3.07,;-2.56,-3.07,;-2.09,-1.61,;-.75,-.84,;.58,-1.61,;-.75,-2.38,;1.91,-2.38,;1.91,-.84,;1.91,.7,;3.25,-1.61,;3.25,-3.15,;4.58,-3.92,;4.58,-.84,;5.91,-1.61,;7.25,-.84,;7.25,.7,;8.58,1.47,;5.91,1.47,;4.58,.7,;-3.33,-.7,;-3.33,.84,;-4.67,1.61,;-6,.84,;-4.67,3.15,;-3.33,3.92,;-2,3.15,;-2,1.61,;-.67,.84,)|

BDBM528463

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1cc(OC)ccc1Cl |r,wU:11.11,13.13,(-8.58,-.84,;-7.25,-1.61,;-5.91,-.84,;-4.58,-1.61,;-4.1,-3.07,;-2.56,-3.07,;-2.09,-1.61,;-.75,-.84,;.58,-1.61,;-.75,-2.38,;1.91,-2.38,;1.91,-.84,;1.91,.7,;3.25,-1.61,;3.25,-3.15,;4.58,-3.92,;4.58,-.84,;5.91,-1.61,;7.25,-.84,;7.25,.7,;8.58,1.47,;5.91,1.47,;4.58,.7,;-3.33,-.7,;-3.33,.84,;-4.67,1.61,;-4.67,3.15,;-6,3.92,;-7.34,3.15,;-3.33,3.92,;-2,3.15,;-2,1.61,;-.67,.84,)|

BDBM528464

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1cc(OC)ccc1Cl |r,wU:11.11,13.13,(-7.91,-.84,;-6.58,-1.61,;-5.25,-.84,;-3.91,-1.61,;-3.44,-3.07,;-1.9,-3.07,;-1.42,-1.61,;-.09,-.84,;1.25,-1.61,;-.09,-2.38,;2.58,-2.38,;2.58,-.84,;2.58,.7,;3.91,-1.61,;3.91,-3.15,;5.25,-3.92,;5.25,-.84,;6.58,-1.61,;7.91,-.84,;7.91,.7,;9.25,1.47,;6.58,1.47,;5.25,.7,;-2.67,-.7,;-2.67,.84,;-4,1.61,;-4,3.15,;-5.33,3.92,;-6.67,3.15,;-2.67,3.92,;-1.33,3.15,;-1.33,1.61,;,.84,)|

BDBM528465

CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(COC(F)F)n1-c1cc(OC)ccc1Cl)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.25,-3.92,;3.91,-3.15,;3.91,-1.61,;2.58,-.84,;2.58,.7,;1.25,-1.61,;-.09,-2.38,;2.58,-2.38,;-.09,-.84,;-1.42,-1.61,;-1.9,-3.07,;-3.44,-3.07,;-3.91,-1.61,;-5.25,-.84,;-6.58,-1.61,;-7.91,-.84,;-9.25,-1.61,;-7.91,.7,;-2.67,-.7,;-2.67,.84,;-4,1.61,;-4,3.15,;-5.33,3.92,;-6.67,3.15,;-2.67,3.92,;-1.33,3.15,;-1.33,1.61,;,.84,;5.25,-.84,;6.58,-1.61,;7.91,-.84,;7.91,.7,;9.25,1.47,;6.58,1.47,;5.25,.7,)|

BDBM528466

COc1cccc(OC)c1-n1c(COC(C)C)nnc1NS(=O)(=O)[C@@H](C)[C@H](C)c1ncc(Cl)cn1 |r,wU:24.26,26.28,(1.33,1.22,;,.45,;-1.33,1.22,;-1.33,2.76,;-2.67,3.53,;-4,2.76,;-4,1.22,;-5.33,.45,;-6.67,1.22,;-2.67,.45,;-2.67,-1.09,;-3.91,-1.99,;-5.25,-1.22,;-6.58,-1.99,;-7.91,-1.22,;-9.25,-1.99,;-7.91,.32,;-3.44,-3.46,;-1.9,-3.46,;-1.42,-1.99,;-.09,-1.22,;1.25,-1.99,;-.09,-2.76,;2.58,-2.76,;2.58,-1.22,;2.58,.32,;3.91,-1.99,;3.91,-3.53,;5.25,-1.22,;6.58,-1.99,;7.91,-1.22,;7.91,.32,;9.25,1.09,;6.58,1.09,;5.25,.32,)|

BDBM528467

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1cc(OC)ccc1Cl |r,wU:11.11,13.13,(-8.58,-1.22,;-7.25,-1.99,;-5.91,-1.22,;-4.58,-1.99,;-4.1,-3.46,;-2.56,-3.46,;-2.09,-1.99,;-.75,-1.22,;.58,-1.99,;-.75,-2.76,;1.91,-2.76,;1.91,-1.22,;1.91,.32,;3.25,-1.99,;3.25,-3.53,;4.58,-1.22,;5.91,-1.99,;7.25,-1.22,;7.25,.32,;8.58,1.09,;5.91,1.09,;4.58,.32,;-3.33,-1.09,;-3.33,.45,;-4.67,1.22,;-4.67,2.76,;-6,3.53,;-7.34,2.76,;-3.33,3.53,;-2,2.76,;-2,1.22,;-.67,.45,)|

BDBM528468

COCc1nnc(NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c2ncc(C)cn2)n1-c1cc(OC)ccc1Cl |r,wU:11.11,wD:13.13,(-8.58,-.07,;-7.25,-.84,;-5.91,-.07,;-4.58,-.84,;-4.1,-2.3,;-2.56,-2.3,;-2.09,-.84,;-.75,-.07,;.58,-.84,;-.75,-1.61,;1.91,-1.61,;1.91,-.07,;1.91,1.47,;3.25,-.84,;3.25,-2.38,;4.58,-3.15,;4.58,-4.69,;5.91,-2.38,;4.58,-.07,;5.91,-.84,;7.25,-.07,;7.25,1.47,;8.58,2.24,;5.91,2.24,;4.58,1.47,;-3.33,.07,;-3.33,1.61,;-4.67,2.38,;-4.67,3.92,;-6,4.69,;-7.34,3.92,;-3.33,4.69,;-2,3.92,;-2,2.38,;-.67,1.61,)|

BDBM528469

CCCCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:12.12,14.14,(-9.25,-1.99,;-7.91,-1.22,;-6.58,-1.99,;-5.25,-1.22,;-3.91,-1.99,;-3.44,-3.46,;-1.9,-3.46,;-1.42,-1.99,;-.09,-1.22,;1.25,-1.99,;-.09,-2.76,;2.58,-2.76,;2.58,-1.22,;2.58,.32,;3.91,-1.99,;3.91,-3.53,;5.25,-1.22,;6.58,-1.99,;7.91,-1.22,;7.91,.32,;9.25,1.09,;6.58,1.09,;5.25,.32,;-2.67,-1.09,;-2.67,.45,;-4,1.22,;-5.33,.45,;-6.67,1.22,;-4,2.76,;-2.67,3.53,;-1.33,2.76,;-1.33,1.22,;,.45,;1.33,1.22,)|

BDBM528470

CO[C@@H]([C@H](C)S(=O)(=O)N\C(NN)=N/c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r|

BDBM528471

COc1cccc(Br)c1-n1c(CCC=C)nnc1NS(=O)(=O)[C@@H](C)[C@@H](OC(C)C)c1ncc(C)cn1 |r,wU:22.24,wD:24.26,(-6.14,-2.4,;-4.96,-3.39,;-3.63,-2.62,;-3.63,-1.08,;-2.29,-.31,;-.96,-1.08,;-.96,-2.62,;.37,-3.39,;-2.29,-3.39,;-2.29,-4.93,;-3.54,-5.84,;-4.87,-5.07,;-6.21,-5.84,;-7.54,-5.07,;-8.87,-5.84,;-3.06,-7.3,;-1.52,-7.3,;-1.05,-5.84,;.29,-5.07,;1.62,-5.84,;.29,-6.61,;2.95,-6.61,;2.95,-5.07,;2.95,-3.53,;4.29,-5.84,;4.29,-7.38,;5.62,-8.15,;5.62,-9.69,;6.95,-7.38,;5.62,-5.07,;6.95,-5.84,;8.29,-5.07,;8.29,-3.53,;9.62,-2.76,;6.95,-2.76,;5.62,-3.53,)|

BDBM528472

CCCCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)n1-c1c(OC)cccc1OC |r,wU:12.12,14.14,(-9.25,-1.61,;-7.91,-.84,;-6.58,-1.61,;-5.25,-.84,;-3.91,-1.61,;-3.44,-3.07,;-1.9,-3.07,;-1.42,-1.61,;-.09,-.84,;1.25,-1.61,;-.09,-2.38,;2.58,-2.38,;2.58,-.84,;2.58,.7,;3.91,-1.61,;3.91,-3.15,;5.25,-3.92,;5.25,-.84,;6.58,-1.61,;7.91,-.84,;7.91,.7,;9.25,1.47,;6.58,1.47,;5.25,.7,;-2.67,-.7,;-2.67,.84,;-4,1.61,;-5.33,.84,;-6.67,1.61,;-4,3.15,;-2.67,3.92,;-1.33,3.15,;-1.33,1.61,;,.84,;1.33,1.61,)|

BDBM528473

CCCCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:12.12,14.14,(-9.25,-1.61,;-7.91,-.84,;-6.58,-1.61,;-5.25,-.84,;-3.91,-1.61,;-3.44,-3.07,;-1.9,-3.07,;-1.42,-1.61,;-.09,-.84,;1.25,-1.61,;-.09,-2.38,;2.58,-2.38,;2.58,-.84,;2.58,.7,;3.91,-1.61,;3.91,-3.15,;5.25,-3.92,;5.25,-.84,;6.58,-1.61,;7.91,-.84,;7.91,.7,;9.25,1.47,;6.58,1.47,;5.25,.7,;-2.67,-.7,;-2.67,.84,;-4,1.61,;-5.33,.84,;-6.67,1.61,;-4,3.15,;-2.67,3.92,;-1.33,3.15,;-1.33,1.61,;,.84,;1.33,1.61,)|

BDBM528474

CCCCc1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:12.12,14.14,(-9.25,-1.99,;-7.91,-1.22,;-6.58,-1.99,;-5.25,-1.22,;-3.91,-1.99,;-3.44,-3.46,;-1.9,-3.46,;-1.42,-1.99,;-.09,-1.22,;1.25,-1.99,;-.09,-2.76,;2.58,-2.76,;2.58,-1.22,;2.58,.32,;3.91,-1.99,;3.91,-3.53,;5.25,-1.22,;6.58,-1.99,;7.91,-1.22,;7.91,.32,;9.25,1.09,;6.58,1.09,;5.25,.32,;-2.67,-1.09,;-2.67,.45,;-4,1.22,;-5.33,.45,;-6.67,1.22,;-4,2.76,;-2.67,3.53,;-1.33,2.76,;-1.33,1.22,;,.45,;1.33,1.22,)|

BDBM633562

CCCCC(=N)Nc1c(OC)cccc1OC

BDBM633563

CCCCc1nc(O)c(NS(=O)(=O)C(C)C)c(=O)n1-c1c(OC)cccc1OC |(-6.67,-.77,;-5.33,,;-4,-.77,;-2.67,,;-1.33,-.77,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;2.91,-1.22,;5.09,-1.22,;5.33,-3.08,;6.67,-2.31,;5.33,-4.62,;1.33,-.77,;2.67,,;;,1.54,;1.33,2.31,;2.67,1.54,;4,2.31,;1.33,3.85,;,4.62,;-1.33,3.85,;-1.33,2.31,;-2.67,1.54,;-4,2.31,)|

BDBM633564

CCCCc1nc(O)c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)c(=O)n1-c1c(OC)cccc1OC |r,wD:13.13,15.15,(-9.34,-.38,;-8,.38,;-6.67,-.38,;-5.33,.38,;-4,-.38,;-4,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;.24,-.84,;2.42,-.84,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;4,-.38,;5.33,-2.69,;5.33,-4.23,;6.67,-5,;8,-4.23,;9.34,-5,;8,-2.69,;6.67,-1.93,;-1.33,-.38,;,.38,;-2.67,.38,;-2.67,1.93,;-1.33,2.69,;,1.93,;1.33,2.69,;-1.33,4.23,;-2.67,5,;-4,4.23,;-4,2.69,;-5.33,1.93,;-6.67,2.69,)|

BDBM633565

CCCCc1nc(O)c(NS(=O)(=O)Cc2ccccc2)c(=O)n1-c1c(OC)cccc1OC |(-8,-.77,;-6.67,,;-5.33,-.77,;-4,,;-2.67,-.77,;-2.67,-2.31,;-1.33,-3.08,;-1.33,-4.62,;,-2.31,;1.33,-3.08,;2.67,-2.31,;1.58,-1.22,;3.76,-1.22,;4,-3.08,;5.33,-2.31,;6.67,-3.08,;8,-2.31,;8,-.77,;6.67,,;5.33,-.77,;,-.77,;1.33,,;-1.33,,;-1.33,1.54,;,2.31,;1.33,1.54,;2.67,2.31,;,3.85,;-1.33,4.62,;-2.67,3.85,;-2.67,2.31,;-4,1.54,;-5.33,2.31,)|

BDBM633566

CCCCc1nc(O)c(NS(=O)(=O)c2ccccc2)c(=O)n1-c1c(OC)cccc1OC |(-7.34,-.38,;-6,.38,;-4.67,-.38,;-3.33,.38,;-2,-.38,;-2,-1.93,;-.67,-2.69,;-.67,-4.23,;.67,-1.93,;2,-2.69,;3.33,-1.93,;2.25,-.84,;4.42,-.84,;4.67,-2.69,;6,-1.93,;7.34,-2.69,;7.34,-4.23,;6,-5,;4.67,-4.23,;.67,-.38,;2,.38,;-.67,.38,;-.67,1.93,;.67,2.69,;2,1.93,;3.33,2.69,;.67,4.23,;-.67,5,;-2,4.23,;-2,2.69,;-3.33,1.93,;-4.67,2.69,)|

BDBM633567

CCCCc1nc(O)c(NS(=O)(=O)CCc2ccccc2)c(=O)n1-c1c(OC)cccc1OC |(-8.67,-.38,;-7.34,.38,;-6,-.38,;-4.67,.38,;-3.33,-.38,;-3.33,-1.93,;-2,-2.69,;-2,-4.23,;-.67,-1.93,;.67,-2.69,;2,-1.93,;.91,-.84,;3.09,-.84,;3.33,-2.69,;4.67,-1.93,;6,-2.69,;6,-4.23,;7.34,-5,;8.67,-4.23,;8.67,-2.69,;7.34,-1.93,;-.67,-.38,;.67,.38,;-2,.38,;-2,1.93,;-.67,2.69,;.67,1.93,;2,2.69,;-.67,4.23,;-2,5,;-3.33,4.23,;-3.33,2.69,;-4.67,1.93,;-6,2.69,)|

BDBM633568

CCCCc1nc(O)c(NS(=O)(=O)C[C@H](C)c2ncc(F)cn2)c(=O)n1-c1c(OC)cccc1OC |r,wD:14.14,(-9.34,-.38,;-8,.38,;-6.67,-.38,;-5.33,.38,;-4,-.38,;-4,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;.24,-.84,;2.42,-.84,;2.67,-2.69,;4,-1.93,;4,-.38,;5.33,-2.69,;5.33,-4.23,;6.67,-5,;8,-4.23,;9.34,-5,;8,-2.69,;6.67,-1.93,;-1.33,-.38,;,.38,;-2.67,.38,;-2.67,1.93,;-1.33,2.69,;,1.93,;1.33,2.69,;-1.33,4.23,;-2.67,5,;-4,4.23,;-4,2.69,;-5.33,1.93,;-6.67,2.69,)|

BDBM633569

CCCCc1nc(O)c(NS(=O)(=O)C[C@@H](C)c2ncc(F)cn2)c(=O)n1-c1c(OC)cccc1OC |r,wU:14.14,(-9.34,-.38,;-8,.38,;-6.67,-.38,;-5.33,.38,;-4,-.38,;-4,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;.24,-.84,;2.42,-.84,;2.67,-2.69,;4,-1.93,;4,-.38,;5.33,-2.69,;5.33,-4.23,;6.67,-5,;8,-4.23,;9.34,-5,;8,-2.69,;6.67,-1.93,;-1.33,-.38,;,.38,;-2.67,.38,;-2.67,1.93,;-1.33,2.69,;,1.93,;1.33,2.69,;-1.33,4.23,;-2.67,5,;-4,4.23,;-4,2.69,;-5.33,1.93,;-6.67,2.69,)|

BDBM633570

CCCCc1nc(O)c(NS(=O)(=O)[C@H]2CCCN(C2)c2ncc(F)cn2)c(=O)n1-c1c(OC)cccc1OC |r,wU:13.12,(-7.34,2.74,;-6.01,3.51,;-4.68,2.74,;-3.34,3.51,;-2.01,2.74,;-2.01,1.2,;-.68,.43,;-.68,-1.11,;.66,1.2,;1.99,.43,;3.33,1.2,;2.24,2.29,;4.41,2.29,;4.66,.43,;5.99,1.2,;7.33,.43,;7.33,-1.11,;5.99,-1.88,;4.66,-1.11,;5.99,-3.44,;4.64,-4.22,;4.64,-5.78,;5.99,-6.57,;5.99,-8.13,;7.34,-5.78,;7.34,-4.22,;.66,2.74,;1.99,3.51,;-.68,3.51,;-.68,5.05,;.66,5.82,;1.99,5.05,;3.33,5.82,;.66,7.36,;-.68,8.13,;-2.01,7.36,;-2.01,5.82,;-3.34,5.05,;-4.68,5.82,)|

BDBM633571

CCCCc1nc(O)c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(C)cn2)c(=O)n1-c1c(OC)cccc1OC |r,wD:15.15,13.13,(-9.34,-.38,;-8,.38,;-6.67,-.38,;-5.33,.38,;-4,-.38,;-4,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;.24,-.84,;2.42,-.84,;2.67,-2.69,;2.67,-4.23,;4,-1.93,;4,-.38,;5.33,.38,;5.33,-2.69,;5.33,-4.23,;6.67,-5,;8,-4.23,;9.34,-5,;8,-2.69,;6.67,-1.93,;-1.33,-.38,;,.38,;-2.67,.38,;-2.67,1.93,;-1.33,2.69,;,1.93,;1.33,2.69,;-1.33,4.23,;-2.67,5,;-4,4.23,;-4,2.69,;-5.33,1.93,;-6.67,2.69,)|

BDBM633572

CCCCc1nc(O)c(NS(=O)(=O)C2CCCCC2)c(=O)n1-c1c(OC)cccc1OC |(-7.34,-.38,;-6,.38,;-4.67,-.38,;-3.33,.38,;-2,-.38,;-2,-1.93,;-.67,-2.69,;-.67,-4.23,;.67,-1.93,;2,-2.69,;3.33,-1.93,;2.25,-.84,;4.42,-.84,;4.67,-2.69,;6,-1.93,;7.34,-2.69,;7.34,-4.23,;6,-5,;4.67,-4.23,;.67,-.38,;2,.38,;-.67,.38,;-.67,1.93,;.67,2.69,;2,1.93,;3.33,2.69,;.67,4.23,;-.67,5,;-2,4.23,;-2,2.69,;-3.33,1.93,;-4.67,2.69,)|

BDBM633573

COc1cccc(OC)c1-n1c(nc(O)c(NS(=O)(=O)CCc2ncc(F)cn2)c1=O)C1CCCC1 |(.65,2.69,;-.68,1.93,;-2.01,2.69,;-2.01,4.23,;-3.35,5,;-4.68,4.23,;-4.68,2.69,;-6.01,1.93,;-7.35,2.69,;-3.35,1.93,;-3.35,.38,;-4.68,-.38,;-4.68,-1.93,;-3.35,-2.69,;-3.35,-4.23,;-2.01,-1.93,;-.68,-2.69,;.65,-1.93,;-.43,-.84,;1.74,-.84,;1.99,-2.69,;3.32,-1.93,;4.66,-2.69,;4.66,-4.23,;5.99,-5,;7.32,-4.23,;8.66,-5,;7.32,-2.69,;5.99,-1.93,;-2.01,-.38,;-.68,.38,;-6.17,.01,;-6.72,1.45,;-8.26,1.37,;-8.66,-.12,;-7.36,-.96,)|

BDBM633574

COc1cccc(OC)c1-n1c(nc(O)c(NS(=O)(=O)CCc2ncc(F)cn2)c1=O)-c1ccccc1 |(.95,2.69,;-.38,1.93,;-1.72,2.69,;-1.72,4.23,;-3.05,5,;-4.38,4.23,;-4.38,2.69,;-5.72,1.93,;-7.05,2.69,;-3.05,1.93,;-3.05,.38,;-4.38,-.38,;-4.38,-1.93,;-3.05,-2.69,;-3.05,-4.23,;-1.72,-1.93,;-.38,-2.69,;.95,-1.93,;-.14,-.84,;2.04,-.84,;2.28,-2.69,;3.62,-1.93,;4.95,-2.69,;4.95,-4.23,;6.28,-5,;7.62,-4.23,;8.95,-5,;7.62,-2.69,;6.28,-1.93,;-1.72,-.38,;-.38,.38,;-5.87,.01,;-6.64,1.35,;-8.18,1.35,;-8.95,.01,;-8.18,-1.32,;-6.64,-1.32,)|

BDBM50077999

BDBM50244511

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC=C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244512

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC=C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC=C)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244513

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC=C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC=C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244514

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)N(CC=C)C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244515

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC=C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC=C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244516

CCCC[C@H](NC(=O)[C@H](CC=C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)N(CC=C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(C)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244517

CCCC[C@H](NC(=O)[C@H](CC=C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC=C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244518

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244519

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC=C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC=C)C(O)=O |r|

BDBM50244520

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@@H]1C\C=C/C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:48|

BDBM50244523

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1C\C=C/CN([C@@H](CCCNC(N)=N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:42|

BDBM50244533

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1C\C=C/C[C@H](NC(=O)[C@@H]2CCC(=O)N2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:42|

BDBM50244534

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:31|

BDBM50244535

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1C\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:22|

BDBM50244563

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C\C=C/C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:18|

BDBM50244575

CCCC[C@H](NC(=O)[C@@H]1C\C=C/CN([C@@H](CO)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:10|

BDBM50244576

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@H]1C\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCCCN)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:56|

BDBM50244577

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](C\C=C/C[C@H](NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:22|

BDBM50244578

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](C\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:18|

BDBM50244579

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCN(C\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)S(=O)(=O)c1ccccc1[N+]([O-])=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:21|

BDBM50244580

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCNC\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:21|

BDBM50244583

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCNC\C=C/C[C@@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:21|

BDBM50244584

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CCN(C\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)S(=O)(=O)c1ccccc1[N+]([O-])=O |r,c:22|

BDBM50244585

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](N)CCNC\C=C/C[C@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O |r,c:22|

BDBM50244586

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC=C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)N(CC=C)C(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244587

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC=C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244625

CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCN(C\C=C/C[C@@H](NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)S(=O)(=O)c1ccccc1[N+]([O-])=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:21|

BDBM50014619

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O

BDBM50244626

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1C\C=C/CN([C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:22|

BDBM50244627

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC=C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC=C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50244628

CCCC[C@H](NC(=O)[C@H](CC=C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC=C)C(O)=O |r|

BDBM50244633

CCCC[C@H](NC(=O)[C@@H]1C\C=C/C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:10|

BDBM50244634

CCCC[C@@H]1NC(=O)[C@H](C\C=C/C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C1=O)C(O)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)N1CCC[C@H]1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1 |r,c:10|

BDBM50257219

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)N(CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257220

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257221

BDBM50257222

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257227

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)N(CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257228

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)N(CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257229

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257230

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257231

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257232

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257233

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257234

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@](C)(CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50009575

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50257251

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@](C)(CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50257252

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)N(CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50506016

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1ncc([nH]1)-c1ccccc1)c1ccccc1 |r|

BDBM50506017

COc1ccc(NC(=O)c2ccc(Cl)cc2-c2ccc(cc2C(O)=O)C(=O)N[C@H](CO)c2ccccc2)cc1F |r|

BDBM50506018

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1c(Cl)cccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r,wD:3.35,(4.31,-6.81,;5.64,-6.04,;6.98,-6.81,;8.31,-6.04,;9.65,-6.8,;10.98,-6.03,;10.98,-4.49,;12.32,-6.8,;12.33,-8.35,;13.66,-9.12,;14.99,-8.34,;14.99,-6.8,;13.66,-6.03,;16.32,-6.03,;16.32,-4.49,;17.66,-6.8,;16.31,-9.12,;17.65,-8.34,;18.41,-6.99,;18.98,-9.11,;18.99,-10.66,;17.65,-11.43,;16.31,-10.66,;14.98,-11.43,;13.58,-10.81,;12.55,-11.95,;11.01,-11.95,;10.24,-13.27,;11.01,-14.61,;12.55,-14.61,;13.31,-13.28,;14.82,-12.96,;8.31,-4.5,;9.64,-3.73,;9.64,-2.19,;8.3,-1.42,;6.97,-2.2,;6.97,-3.74,)|

BDBM50506019

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1c(Cl)cccc1-c1nc2cc(OC)ccc2[nH]1)c1ccccc1 |r,wD:3.37,(50.15,-45.98,;51.48,-45.21,;52.81,-45.98,;54.15,-45.21,;55.49,-45.97,;56.82,-45.2,;56.82,-43.66,;58.16,-45.97,;58.16,-47.52,;59.5,-48.28,;60.83,-47.51,;60.83,-45.97,;59.49,-45.2,;62.16,-45.2,;62.16,-43.66,;63.49,-45.97,;62.15,-48.28,;63.48,-47.51,;64.24,-46.17,;64.82,-48.28,;64.82,-49.83,;63.48,-50.6,;62.15,-49.83,;60.82,-50.6,;60.66,-52.13,;59.15,-52.45,;58.38,-53.78,;56.85,-53.78,;56.09,-55.11,;54.55,-55.11,;56.07,-52.44,;56.85,-51.12,;58.39,-51.12,;59.42,-49.98,;54.15,-43.67,;55.48,-42.9,;55.48,-41.36,;54.14,-40.59,;52.8,-41.37,;52.81,-42.9,)|

BDBM50506020

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1c(C)cccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r,wD:3.35,(52.74,-6.81,;54.08,-6.04,;55.41,-6.81,;56.75,-6.04,;58.09,-6.8,;59.42,-6.03,;59.42,-4.49,;60.76,-6.8,;60.76,-8.35,;62.09,-9.11,;63.42,-8.34,;63.42,-6.8,;62.09,-6.03,;64.76,-6.03,;64.76,-4.49,;66.09,-6.8,;64.75,-9.11,;66.08,-8.34,;66.84,-6.99,;67.42,-9.11,;67.42,-10.66,;66.08,-11.43,;64.75,-10.66,;63.41,-11.43,;62.01,-10.81,;60.99,-11.95,;59.45,-11.95,;58.67,-13.27,;59.45,-14.61,;60.98,-14.61,;61.75,-13.28,;63.26,-12.96,;56.75,-4.5,;58.08,-3.73,;58.08,-2.19,;56.74,-1.42,;55.4,-2.2,;55.41,-3.74,)|

BDBM50506021

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1ccc(Cl)cc1-c1nc2ccccc2[nH]1)c1ccccc1 |r|

BDBM50506022

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cccc(Cl)c1-c1nc2ccccc2[nH]1)c1ccccc1 |r|

BDBM50506023

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2ccccc2o1)c1ccccc1 |r|

BDBM50506024

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2ccncc2[nH]1)c1ccccc1 |r|

BDBM50506025

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2cc(C)ccc2[nH]1)c1ccccc1 |r|

BDBM50506026

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r|

BDBM50506027

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1C(=O)Nc1ccc(OC)c(F)c1)c1ccccc1 |r|

BDBM50506028

COC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1C(=O)Nc1ccc(OC)c(F)c1)c1ccccc1 |r|

BDBM50506029

COc1ccc(NC(=O)c2ccc(Cl)cc2-c2ccc(cc2C(O)=O)C(=O)Nc2ccc3CCCc3c2)cc1F

BDBM50506030

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1ccccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r|

BDBM50506031

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2cc(Cl)ccc2[nH]1)c1ccccc1 |r|

BDBM50506032

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(OC)ccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r|

BDBM50506033

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1c(F)cccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r,wD:3.35,(27.17,-6.87,;28.49,-6.1,;29.83,-6.87,;31.16,-6.1,;32.5,-6.86,;33.84,-6.1,;33.83,-4.55,;35.17,-6.86,;35.18,-8.41,;36.51,-9.18,;37.84,-8.4,;37.84,-6.86,;36.51,-6.09,;39.17,-6.09,;39.17,-4.55,;40.51,-6.86,;39.17,-9.18,;40.5,-8.4,;41.25,-7.06,;41.83,-9.17,;41.84,-10.72,;40.5,-11.49,;39.16,-10.72,;37.84,-11.49,;36.43,-10.87,;35.4,-12.01,;33.87,-12.01,;33.09,-13.33,;33.86,-14.67,;35.4,-14.67,;36.16,-13.34,;37.67,-13.03,;31.16,-4.56,;32.5,-3.79,;32.49,-2.25,;31.16,-1.48,;29.82,-2.26,;29.83,-3.8,)|

BDBM50506034

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(C)ccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r|

BDBM50506035

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2cccc(C)c2[nH]1)c1ccccc1 |r|

BDBM50506036

COC[C@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1C(=O)Nc1ccc(OC)c(F)c1)c1ccccc1 |r|

BDBM50506037

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1-c1nc2cc(OC)ccc2[nH]1)c1ccccc1 |r|

BDBM50518024

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H]1CC=CCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCCCN)NC1=O)C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r|

BDBM50172371

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50518047

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CSSC[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50518048

CCC(CC)n1c(Cc2cccs2)nc2cc(ccc12)C(=O)N[C@@H](CC(C)C)CC([O-])=O |r|

BDBM50525999

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50526000

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCC)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50526001

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCC)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50526002

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50526003

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50526004

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50541295

CCCSc1nc(=O)cc(O)n1-c1ccccc1

BDBM50541296

CCCSc1nc(=O)cc(O)n1-c1ccccc1OC |(38.91,-20.71,;40.24,-21.48,;41.58,-20.71,;42.91,-21.47,;44.24,-20.7,;44.25,-19.16,;45.58,-18.39,;45.58,-16.85,;46.91,-19.16,;46.91,-20.69,;48.25,-21.46,;45.58,-21.46,;45.58,-23,;44.25,-23.77,;44.25,-25.31,;45.58,-26.08,;46.92,-25.31,;46.91,-23.76,;48.24,-22.99,;49.58,-23.75,)|

BDBM50541297

CCCSc1nc(=O)cc(O)n1-c1cccc(OC)c1

BDBM50541298

CCCSc1nc(=O)cc(O)n1-c1ccc(OC)cc1

BDBM50541299

CCCSc1nc(=O)cc(O)n1-c1ccccc1C |(75.63,-6.41,;76.97,-7.18,;78.3,-6.4,;79.64,-7.17,;80.97,-6.4,;80.97,-4.85,;82.3,-4.08,;82.31,-2.54,;83.64,-4.86,;83.64,-6.39,;84.97,-7.16,;82.3,-7.16,;82.3,-8.69,;80.97,-9.46,;80.97,-11.01,;82.31,-11.78,;83.64,-11.01,;83.64,-9.46,;84.97,-8.68,)|

BDBM50541300

CCCSc1nc(=O)cc(O)n1-c1cccc(C)c1

BDBM50541301

CCCSc1nc(=O)cc(O)n1-c1ccc(C)cc1

BDBM50541302

CCCSc1nc(=O)cc(O)n1-c1ccccc1Cl |(40.28,-25.39,;41.62,-26.16,;42.95,-25.39,;44.29,-26.16,;45.62,-25.38,;45.62,-23.84,;46.96,-23.07,;46.96,-21.53,;48.29,-23.84,;48.29,-25.37,;49.62,-26.14,;46.95,-26.14,;46.95,-27.68,;45.63,-28.45,;45.62,-29.99,;46.96,-30.76,;48.29,-29.99,;48.29,-28.44,;49.62,-27.67,)|

BDBM50541303

CCCSc1nc(=O)cc(O)n1-c1ccccc1F |(56.55,-24.81,;57.89,-25.58,;59.22,-24.81,;60.55,-25.57,;61.89,-24.8,;61.89,-23.26,;63.22,-22.49,;63.22,-20.95,;64.56,-23.26,;64.56,-24.79,;65.89,-25.56,;63.22,-25.56,;63.22,-27.1,;61.89,-27.87,;61.89,-29.41,;63.22,-30.18,;64.56,-29.41,;64.56,-27.86,;65.89,-27.09,)|

BDBM50541304

CCCSc1nc(=O)cc(O)n1-c1ccccc1Br |(75.66,-25.69,;77,-26.46,;78.33,-25.69,;79.66,-26.45,;81,-25.68,;81,-24.14,;82.33,-23.36,;82.33,-21.82,;83.66,-24.14,;83.67,-25.67,;85,-26.44,;82.33,-26.44,;82.33,-27.98,;81,-28.75,;81,-30.29,;82.33,-31.06,;83.67,-30.29,;83.67,-28.74,;85,-27.96,)|

BDBM50541305

CCCSc1nc(=O)cc(O)n1-c1ccccc1C(F)(F)F |(2.99,-44.3,;4.32,-45.06,;5.65,-44.29,;6.99,-45.06,;8.31,-44.28,;8.32,-42.74,;9.65,-41.97,;9.66,-40.43,;10.98,-42.74,;10.98,-44.27,;12.31,-45.04,;9.65,-45.05,;9.65,-47.02,;8.32,-47.79,;8.32,-49.33,;9.66,-50.1,;10.99,-49.33,;10.98,-47.78,;12.31,-46.95,;11.53,-45.61,;13.08,-45.61,;13.67,-47.67,)|

BDBM50541306

CCCSc1nc(=O)cc(O)n1-c1ccccc1CC |(20.85,-43.96,;22.19,-44.73,;23.52,-43.96,;24.85,-44.72,;26.19,-43.95,;26.19,-42.41,;27.52,-41.63,;27.52,-40.09,;28.86,-42.41,;28.86,-43.94,;30.19,-44.71,;27.52,-44.71,;27.52,-46.25,;26.19,-47.02,;26.19,-48.56,;27.52,-49.33,;28.86,-48.56,;28.86,-47.01,;30.19,-46.23,;31.52,-47,)|

BDBM50541307

CCCSc1nc(=O)cc(O)n1-c1ccccc1OCC |(39.43,-44.01,;40.77,-44.78,;42.1,-44,;43.43,-44.77,;44.77,-44,;44.77,-42.45,;46.1,-41.68,;46.1,-40.14,;47.44,-42.45,;47.44,-43.99,;48.77,-44.76,;46.1,-44.76,;46.1,-46.29,;44.77,-47.06,;44.77,-48.61,;46.11,-49.38,;47.44,-48.61,;47.44,-47.06,;48.77,-46.28,;50.11,-47.05,;51.44,-46.27,)|

BDBM50541308

COc1ccccc1-n1c(O)cc(=O)nc1SC(C)C |(67.57,-48.25,;66.23,-47.49,;64.9,-48.26,;64.9,-49.81,;63.57,-50.58,;62.23,-49.81,;62.23,-48.27,;63.56,-47.5,;63.56,-45.96,;64.9,-45.19,;66.23,-45.96,;64.9,-43.66,;63.56,-42.89,;63.57,-41.35,;62.23,-43.66,;62.23,-45.2,;60.9,-45.98,;59.56,-45.21,;58.23,-45.98,;59.56,-43.67,)|

BDBM50541309

COc1ccccc1-n1c(O)cc(=O)nc1SCC(C)C |(85.4,-47.57,;84.06,-46.8,;82.73,-47.58,;82.74,-49.13,;81.4,-49.9,;80.07,-49.13,;80.07,-47.58,;81.4,-46.81,;81.4,-45.28,;82.73,-44.51,;84.07,-45.28,;82.73,-42.97,;81.4,-42.2,;81.4,-40.66,;80.06,-42.97,;80.06,-44.52,;78.73,-45.29,;77.39,-44.52,;76.06,-45.3,;74.73,-44.53,;76.06,-46.84,)|

BDBM50541310

CCCCSc1nc(=O)cc(O)n1-c1ccccc1OC |(3,-5.53,;4.33,-4.75,;5.67,-5.52,;7,-4.75,;8.33,-5.52,;9.67,-4.74,;9.67,-3.2,;11,-2.43,;11,-.89,;12.34,-3.2,;12.34,-4.73,;13.67,-5.5,;11,-5.5,;11,-7.04,;9.67,-7.81,;9.67,-9.35,;11.01,-10.12,;12.34,-9.35,;12.34,-7.8,;13.67,-7.03,;15,-7.79,)|

BDBM50541311

CCCSc1nc(=O)c(C)c(O)n1-c1ccccc1OC |(22.4,-5.23,;23.73,-6,;25.06,-5.22,;26.4,-5.99,;27.73,-5.22,;27.73,-3.67,;29.07,-2.9,;29.07,-1.36,;30.4,-3.67,;31.74,-2.91,;30.4,-5.21,;31.74,-5.98,;29.07,-5.98,;29.07,-7.51,;27.74,-8.28,;27.74,-9.83,;29.07,-10.6,;30.41,-9.83,;30.4,-8.28,;31.73,-7.5,;33.07,-8.27,)|

BDBM50541312

CCCSc1nc(=O)c(CC)c(O)n1-c1ccccc1OC |(39.11,-5.05,;40.45,-5.82,;41.78,-5.04,;43.11,-5.81,;44.45,-5.04,;44.45,-3.49,;45.78,-2.72,;45.78,-1.18,;47.12,-3.5,;48.45,-2.73,;49.78,-3.5,;47.12,-5.03,;48.45,-5.8,;45.78,-5.8,;45.78,-7.33,;44.45,-8.1,;44.45,-9.65,;45.79,-10.42,;47.12,-9.65,;47.12,-8.1,;48.45,-7.32,;49.78,-8.09,)|

BDBM50541313

CCCCc1c(O)n(c(SCCC)nc1=O)-c1ccccc1OC |(68.54,-3.86,;67.2,-3.09,;65.87,-3.86,;64.54,-3.08,;63.2,-3.85,;63.2,-5.39,;64.54,-6.16,;61.87,-6.16,;60.53,-5.4,;59.2,-6.17,;57.86,-5.4,;56.53,-6.17,;55.2,-5.41,;60.53,-3.85,;61.87,-3.08,;61.87,-1.54,;61.87,-7.69,;60.54,-8.46,;60.54,-10.01,;61.87,-10.78,;63.21,-10.01,;63.2,-8.46,;64.53,-7.68,;65.87,-8.45,)|

BDBM50541314

CCCSc1nc(=O)c(Cc2ccccc2)c(O)n1-c1ccccc1OC |(74.39,-5.52,;75.72,-6.29,;77.05,-5.52,;78.39,-6.29,;79.72,-5.51,;79.72,-3.97,;81.06,-3.2,;81.06,-1.66,;82.39,-3.97,;83.72,-3.2,;85.06,-3.97,;85.05,-5.51,;86.38,-6.28,;87.72,-5.51,;87.71,-3.96,;86.38,-3.2,;82.39,-5.5,;83.72,-6.27,;81.06,-6.27,;81.06,-7.81,;79.73,-8.58,;79.72,-10.12,;81.06,-10.89,;82.4,-10.12,;82.39,-8.57,;83.72,-7.8,;85.06,-8.56,)|

BDBM50541315

CCCSc1nc(=O)c(CC=C)c(O)n1-c1ccccc1OC |(3.13,-20.21,;4.46,-20.97,;5.79,-20.2,;7.13,-20.97,;8.46,-20.2,;8.46,-18.65,;9.8,-17.88,;9.8,-16.34,;11.13,-18.65,;12.46,-17.88,;13.8,-18.66,;15.13,-17.89,;11.13,-20.19,;12.46,-20.96,;9.8,-20.96,;9.8,-22.49,;8.47,-23.26,;8.46,-24.81,;9.8,-25.58,;11.14,-24.81,;11.13,-23.26,;12.46,-22.48,;13.8,-23.25,)|

BDBM50541316

CCCSc1nc(=O)c(C(C)C)c(O)n1-c1ccccc1OC |(22.01,-20.43,;23.35,-21.19,;24.68,-20.42,;26.01,-21.19,;27.34,-20.42,;27.35,-18.87,;28.68,-18.1,;28.68,-16.56,;30.01,-18.87,;31.35,-18.1,;32.68,-18.87,;31.35,-16.56,;30.02,-20.41,;31.35,-21.17,;28.68,-21.18,;28.68,-22.71,;27.35,-23.48,;27.35,-25.03,;28.68,-25.8,;30.02,-25.02,;30.02,-23.47,;31.35,-22.7,;32.68,-23.46,)|

BDBM50541317

CCCCc1nc(=O)cc(O)n1-c1ccccc1OC |(21.92,-35.82,;23.25,-36.58,;24.58,-35.81,;25.92,-36.58,;27.25,-35.81,;27.25,-34.26,;28.59,-33.49,;28.59,-31.95,;29.92,-34.26,;29.92,-35.8,;31.25,-36.57,;28.59,-36.57,;28.59,-38.1,;29.92,-38.87,;29.93,-40.42,;28.59,-41.19,;27.26,-40.42,;27.26,-38.87,;25.92,-38.1,;24.59,-38.87,)|

BDBM50541318

CCCCc1nc(=O)cc(O)n1-c1c(C)cccc1OC |(56.29,-35.76,;57.62,-36.53,;58.95,-35.76,;60.29,-36.53,;61.62,-35.75,;61.62,-34.21,;62.96,-33.44,;62.96,-31.9,;64.29,-34.21,;64.29,-35.74,;65.63,-36.51,;62.96,-36.51,;62.96,-38.05,;64.29,-38.81,;65.62,-38.04,;64.3,-40.36,;62.96,-41.13,;61.63,-40.36,;61.63,-38.82,;60.29,-38.05,;58.96,-38.82,)|

BDBM50541319

CCCCc1nc(=O)cc(O)n1-c1c(OC)cccc1OC |(4.98,-51.3,;6.32,-52.06,;7.65,-51.29,;8.99,-52.06,;10.32,-51.29,;10.32,-49.74,;11.66,-48.97,;11.66,-47.43,;12.99,-49.74,;12.99,-51.28,;14.32,-52.04,;11.65,-52.05,;11.66,-53.58,;10.33,-54.35,;8.99,-53.58,;7.66,-54.35,;10.32,-55.9,;11.66,-56.67,;13,-55.89,;12.99,-54.34,;14.32,-53.57,;15.66,-54.33,)|

BDBM50541320

CCCCc1nc(=O)c(Cc2ccc(OC)cc2)c(O)n1-c1c(OC)cccc1OC |(23.06,-50.84,;24.39,-51.6,;25.73,-50.83,;27.06,-51.6,;28.39,-50.83,;28.4,-49.28,;29.73,-48.51,;29.73,-46.97,;31.06,-49.28,;32.4,-48.51,;33.73,-49.28,;33.73,-50.82,;35.06,-51.59,;36.39,-50.82,;37.73,-51.59,;39.06,-50.82,;36.39,-49.28,;35.06,-48.51,;31.06,-50.82,;32.4,-51.59,;29.73,-51.59,;29.73,-53.12,;28.4,-53.89,;27.07,-53.12,;25.73,-53.89,;28.4,-55.44,;29.73,-56.21,;31.07,-55.44,;31.07,-53.88,;32.4,-53.11,;33.73,-53.87,)|

BDBM50541321

CCC(C)Sc1nc(=O)cc(O)n1CC=C

BDBM50541322

BDBM50544719

CC1=CC(=O)C(=C\C1=N/OS(=O)(=O)c1ccccc1)C1CCCCC1 |c:5,t:1|

BDBM50544721

CCCn1nc(cc1-c1c(OC)cccc1OC)C(=O)N[C@@H](CCC1CCCCC1)CC(=O)NC1CCC1 |r,wU:21.23,(9.06,-56.14,;9.67,-54.73,;8.76,-53.49,;9.38,-52.08,;10.89,-51.76,;11.04,-50.23,;9.64,-49.6,;8.61,-50.75,;7.07,-50.59,;6.45,-49.19,;7.35,-47.94,;6.72,-46.54,;4.92,-49.03,;4.01,-50.27,;4.63,-51.68,;6.16,-51.85,;6.79,-53.26,;5.88,-54.5,;12.38,-49.45,;12.37,-47.91,;13.71,-50.22,;15.04,-49.45,;15.04,-47.91,;16.37,-47.14,;16.37,-45.6,;17.7,-44.83,;17.71,-43.3,;16.37,-42.52,;15.04,-43.29,;15.03,-44.84,;16.38,-50.22,;17.71,-49.44,;17.71,-47.9,;19.05,-50.21,;20.38,-49.44,;21.87,-49.84,;22.27,-48.35,;20.78,-47.95,)|

BDBM50544722

COC(=O)CNC(=O)[C@H](CCc1ccccc1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:8.8,(23.73,-48.34,;22.4,-49.11,;21.06,-48.34,;21.06,-46.8,;19.73,-49.12,;18.4,-48.35,;17.06,-49.12,;17.07,-50.66,;15.73,-48.35,;15.73,-46.81,;17.06,-46.04,;17.06,-44.5,;18.39,-43.73,;18.39,-42.2,;17.06,-41.42,;15.72,-42.19,;15.72,-43.74,;14.4,-49.12,;13.06,-48.36,;13.06,-46.82,;11.73,-49.13,;10.32,-48.5,;9.29,-49.65,;7.76,-49.5,;7.13,-48.09,;8.03,-46.85,;7.41,-45.44,;5.6,-47.93,;4.69,-49.18,;5.31,-50.59,;6.85,-50.75,;7.47,-52.16,;6.57,-53.4,;10.06,-50.98,;9.45,-52.39,;10.36,-53.63,;9.74,-55.04,;11.89,-53.46,;11.57,-50.66,)|

BDBM50544723

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCC1CCCCC1)CC(=O)NCC(O)=O |r,wU:22.24,(63.7,-46.9,;64.33,-48.31,;63.43,-49.55,;61.9,-49.39,;60.99,-50.64,;61.61,-52.05,;63.14,-52.21,;63.77,-53.62,;62.86,-54.87,;64.05,-50.96,;65.59,-51.11,;66.62,-49.97,;68.02,-50.59,;67.87,-52.12,;66.36,-52.45,;65.74,-53.85,;66.65,-55.09,;66.04,-56.5,;68.19,-54.92,;69.36,-49.82,;69.35,-48.28,;70.69,-50.59,;72.02,-49.81,;72.02,-48.27,;73.35,-47.5,;73.35,-45.96,;74.68,-45.19,;74.69,-43.66,;73.35,-42.89,;72.02,-43.66,;72.01,-45.2,;73.36,-50.58,;74.69,-49.81,;74.69,-48.27,;76.03,-50.58,;77.36,-49.81,;78.69,-50.57,;80.03,-49.8,;78.7,-52.11,)|

BDBM50544724

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:23.26,(40.31,-5.59,;40.93,-6.99,;40.03,-8.24,;38.5,-8.08,;37.59,-9.32,;38.21,-10.73,;39.75,-10.9,;40.37,-12.31,;39.47,-13.55,;40.66,-9.64,;42.19,-9.8,;43.22,-8.65,;44.63,-9.28,;44.47,-10.81,;42.96,-11.13,;42.35,-12.54,;40.85,-12.87,;40.69,-14.4,;42.1,-15.01,;43.12,-13.87,;45.96,-8.5,;45.96,-6.96,;47.3,-9.27,;48.63,-8.5,;48.63,-6.96,;49.96,-6.19,;49.96,-4.65,;51.29,-3.88,;51.29,-2.35,;49.96,-1.57,;48.62,-2.34,;48.62,-3.89,;49.96,-9.27,;51.3,-8.49,;52.63,-9.26,;51.29,-6.95,)|

BDBM50544725

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CCC1CCCCC1)CC(=O)NC1CCC1 |r,wU:25.28,(65.64,-25.66,;66.26,-27.06,;65.36,-28.3,;63.83,-28.14,;62.92,-29.39,;63.54,-30.8,;65.07,-30.97,;65.7,-32.37,;64.79,-33.62,;65.99,-29.71,;67.52,-29.86,;68.55,-28.72,;69.96,-29.34,;69.8,-30.87,;68.3,-31.2,;67.67,-32.6,;66.15,-32.77,;65.54,-34.17,;66.44,-35.41,;65.83,-36.82,;67.97,-35.24,;68.59,-33.83,;71.29,-28.57,;71.28,-27.03,;72.62,-29.34,;73.95,-28.56,;73.95,-27.02,;75.29,-26.25,;75.28,-24.71,;76.62,-23.94,;76.62,-22.41,;75.29,-21.64,;73.95,-22.4,;73.94,-23.95,;75.29,-29.33,;76.62,-28.56,;76.62,-27.02,;77.96,-29.33,;79.29,-28.55,;80.78,-28.96,;81.18,-27.47,;79.69,-27.07,)|

BDBM50544726

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCc1ccccc1)C(=O)NC1CCC1 |r,wU:22.24,(65.73,-5.38,;66.36,-6.78,;65.46,-8.03,;63.93,-7.87,;63.02,-9.11,;63.64,-10.52,;65.17,-10.69,;65.8,-12.1,;64.89,-13.34,;66.08,-9.43,;67.62,-9.59,;68.65,-8.44,;70.05,-9.07,;69.9,-10.6,;68.39,-10.92,;67.77,-12.33,;68.68,-13.57,;68.07,-14.98,;70.22,-13.4,;71.39,-8.29,;71.38,-6.75,;72.72,-9.06,;74.05,-8.29,;74.05,-6.75,;75.38,-5.98,;75.38,-4.44,;76.71,-3.67,;76.72,-2.14,;75.38,-1.36,;74.05,-2.13,;74.04,-3.68,;75.39,-9.06,;75.39,-10.6,;76.72,-8.28,;78.06,-9.05,;78.45,-10.53,;79.94,-10.13,;79.53,-8.65,)|

BDBM50544720

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCC1CCCCC1)CC(=O)NC1CCC1 |r,wU:22.24,(36.18,-25.4,;36.81,-26.8,;35.91,-28.05,;34.38,-27.89,;33.47,-29.13,;34.09,-30.54,;35.63,-30.71,;36.25,-32.12,;35.35,-33.36,;36.54,-29.45,;38.07,-29.61,;39.1,-28.46,;40.51,-29.09,;40.35,-30.62,;38.84,-30.94,;38.22,-32.35,;39.14,-33.59,;38.52,-35,;40.67,-33.42,;41.84,-28.31,;41.84,-26.77,;43.17,-29.08,;44.51,-28.31,;44.5,-26.77,;45.84,-26,;45.83,-24.46,;47.17,-23.69,;47.17,-22.16,;45.84,-21.38,;44.5,-22.15,;44.5,-23.7,;45.84,-29.08,;47.17,-28.3,;47.17,-26.76,;48.51,-29.07,;49.84,-28.3,;51.33,-28.7,;51.73,-27.21,;50.24,-26.81,)|

BDBM50544727

CCC(CC)n1c2ccc(cc2nc1Cc3cccs3)C(=O)N[C@@H](CC(C)C)CC(=O)O

BDBM50544729

COc1cccc(OC)c1-c1cc(nn1C1CCCCC1)C(=O)N[C@@H](CCC1CCCCC1)CC(=O)NC1CCC1 |r,wU:24.27,(64.94,-45.08,;65.56,-46.49,;64.66,-47.74,;63.14,-47.58,;62.22,-48.82,;62.84,-50.23,;64.38,-50.4,;65.01,-51.81,;64.1,-53.05,;65.29,-49.14,;66.82,-49.3,;67.85,-48.15,;69.26,-48.78,;69.1,-50.31,;67.6,-50.63,;66.98,-52.04,;65.46,-52.2,;64.84,-53.6,;65.74,-54.84,;67.27,-54.67,;67.9,-53.26,;70.6,-48,;70.59,-46.46,;71.92,-48.77,;73.26,-48,;73.25,-46.46,;74.59,-45.69,;74.59,-44.15,;75.92,-43.38,;75.92,-41.84,;74.59,-41.07,;73.25,-41.84,;73.25,-43.38,;74.59,-48.77,;75.93,-47.99,;75.92,-46.45,;77.26,-48.76,;78.6,-47.99,;80.09,-48.38,;80.48,-46.9,;78.99,-46.5,)|

BDBM50544728

CCC(=O)CNC(=O)[C@H](CCc1ccccc1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:8.8,(51.91,-8.05,;50.58,-8.82,;49.24,-8.05,;49.24,-6.51,;47.91,-8.83,;46.57,-8.06,;45.24,-8.83,;45.24,-10.37,;43.91,-8.06,;43.9,-6.52,;45.24,-5.75,;45.23,-4.21,;46.57,-3.44,;46.57,-1.91,;45.24,-1.14,;43.9,-1.91,;43.9,-3.45,;42.57,-8.84,;41.24,-8.07,;41.24,-6.53,;39.91,-8.84,;38.5,-8.22,;37.47,-9.36,;35.94,-9.21,;35.31,-7.8,;36.21,-6.56,;35.59,-5.15,;33.78,-7.64,;32.87,-8.89,;33.49,-10.3,;35.03,-10.46,;35.65,-11.87,;34.75,-13.12,;38.24,-10.69,;37.63,-12.1,;38.54,-13.34,;37.92,-14.75,;40.07,-13.17,;39.75,-10.37,)|

BDBM50544730

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCc1ccccc1)C(O)=O |r,wU:22.24,(67.18,-24.44,;67.81,-25.85,;66.9,-27.09,;65.37,-26.93,;64.46,-28.18,;65.08,-29.59,;66.62,-29.75,;67.25,-31.16,;66.34,-32.4,;67.53,-28.5,;69.06,-28.65,;70.09,-27.5,;71.5,-28.13,;71.34,-29.66,;69.84,-29.98,;69.22,-31.39,;70.13,-32.63,;69.51,-34.04,;71.66,-32.46,;72.83,-27.36,;72.83,-25.82,;74.17,-28.12,;75.5,-27.35,;75.5,-25.81,;76.83,-25.04,;76.83,-23.5,;78.16,-22.73,;78.16,-21.2,;76.83,-20.42,;75.49,-21.19,;75.49,-22.74,;76.84,-28.12,;78.17,-27.35,;76.84,-29.66,)|

BDBM50544731

COC(=O)CN(C)C(=O)C[C@H](CCC1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:10.10,(51.18,-49.76,;49.84,-48.99,;48.51,-49.76,;48.51,-51.3,;47.17,-49,;45.84,-49.77,;45.84,-51.31,;44.51,-49,;44.5,-47.46,;43.17,-49.77,;41.84,-49.01,;41.84,-47.47,;43.17,-46.69,;43.17,-45.15,;44.5,-44.39,;44.5,-42.85,;43.17,-42.08,;41.83,-42.85,;41.83,-44.39,;40.51,-49.78,;39.17,-49.01,;39.17,-47.47,;37.84,-49.78,;36.43,-49.16,;35.4,-50.3,;33.87,-50.15,;33.24,-48.75,;34.14,-47.5,;33.52,-46.09,;31.71,-48.58,;30.8,-49.83,;31.42,-51.24,;32.96,-51.4,;33.58,-52.81,;32.68,-54.06,;36.17,-51.64,;35.56,-53.04,;36.47,-54.28,;35.85,-55.69,;38,-54.11,;37.68,-51.31,)|

BDBM50544732

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:22.24,(10.23,-5.68,;10.86,-7.09,;9.95,-8.33,;8.43,-8.17,;7.51,-9.42,;8.14,-10.83,;9.67,-10.99,;10.3,-12.4,;9.39,-13.64,;10.58,-9.74,;12.12,-9.89,;13.14,-8.75,;14.55,-9.37,;14.39,-10.9,;12.89,-11.22,;12.27,-12.63,;13.18,-13.87,;12.56,-15.28,;14.71,-13.7,;15.88,-8.6,;15.88,-7.06,;17.22,-9.36,;18.55,-8.59,;18.55,-7.05,;19.88,-6.28,;19.88,-4.74,;21.21,-3.97,;21.21,-2.44,;19.88,-1.66,;18.55,-2.43,;18.54,-3.98,;19.89,-9.36,;21.22,-8.59,;22.55,-9.36,;21.22,-7.05,)|

BDBM50544733

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCc1ccccc1)CC(=O)NC1CCC1 |r,wU:22.24,(36.61,-26.26,;37.24,-27.67,;36.34,-28.91,;34.81,-28.75,;33.9,-30,;34.52,-31.41,;36.05,-31.57,;36.68,-32.98,;35.77,-34.22,;36.96,-30.32,;38.5,-30.47,;39.53,-29.32,;40.93,-29.95,;40.78,-31.48,;39.27,-31.8,;38.65,-33.21,;39.56,-34.45,;38.95,-35.86,;41.09,-34.28,;42.27,-29.18,;42.26,-27.64,;43.6,-29.94,;44.93,-29.17,;44.93,-27.63,;46.26,-26.86,;46.26,-25.32,;47.59,-24.55,;47.59,-23.02,;46.26,-22.24,;44.93,-23.01,;44.92,-24.56,;46.27,-29.94,;47.6,-29.17,;47.6,-27.63,;48.94,-29.94,;50.27,-29.16,;51.76,-29.56,;52.16,-28.07,;50.67,-27.68,)|

BDBM50544734

CCC(O)CNC(=O)[C@H](CCc1ccccc1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:8.8,(22.71,-9.64,;21.38,-10.41,;20.04,-9.64,;20.04,-8.1,;18.71,-10.41,;17.38,-9.65,;16.04,-10.42,;16.05,-11.96,;14.71,-9.65,;14.71,-8.11,;16.04,-7.34,;16.04,-5.8,;17.37,-5.03,;17.37,-3.5,;16.04,-2.72,;14.7,-3.49,;14.7,-5.04,;13.38,-10.42,;12.04,-9.65,;12.04,-8.11,;10.71,-10.43,;9.3,-9.8,;8.27,-10.95,;6.74,-10.79,;6.11,-9.39,;7.02,-8.14,;6.39,-6.74,;4.58,-9.23,;3.67,-10.48,;4.29,-11.88,;5.83,-12.05,;6.46,-13.46,;5.55,-14.7,;9.05,-12.28,;8.43,-13.69,;9.34,-14.93,;8.72,-16.34,;10.87,-14.76,;10.55,-11.96,)|

BDBM50544735

CC[C@@H](O)CNC(=O)C[C@H](CCC1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:9.9,2.2,(52.82,-9.06,;51.48,-8.29,;50.15,-9.06,;50.15,-10.6,;48.81,-8.3,;47.48,-9.07,;46.15,-8.3,;46.14,-6.76,;44.81,-9.07,;43.48,-8.3,;43.48,-6.76,;44.81,-5.99,;44.81,-4.45,;46.14,-3.68,;46.14,-2.15,;44.81,-1.38,;43.47,-2.15,;43.47,-3.69,;42.15,-9.08,;40.81,-8.31,;40.81,-6.77,;39.48,-9.08,;38.07,-8.46,;37.04,-9.6,;35.51,-9.45,;34.88,-8.04,;35.78,-6.8,;35.16,-5.39,;33.35,-7.88,;32.44,-9.13,;33.06,-10.54,;34.6,-10.7,;35.22,-12.11,;34.32,-13.36,;37.82,-10.94,;37.2,-12.34,;38.11,-13.58,;37.49,-14.99,;39.64,-13.41,;39.32,-10.61,)|

BDBM50544736

CCC(=O)CNC(=O)C[C@H](CCC1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:9.9,(82.42,-8.46,;81.08,-7.69,;79.75,-8.46,;79.75,-10,;78.42,-7.7,;77.08,-8.47,;75.75,-7.7,;75.75,-6.16,;74.42,-8.47,;73.08,-7.71,;73.08,-6.17,;74.41,-5.39,;74.41,-3.85,;75.74,-3.09,;75.74,-1.55,;74.41,-.78,;73.08,-1.55,;73.07,-3.09,;71.75,-8.48,;70.41,-7.71,;70.41,-6.17,;69.08,-8.48,;67.67,-7.86,;66.65,-9,;65.11,-8.85,;64.48,-7.45,;65.39,-6.2,;64.76,-4.79,;62.96,-7.28,;62.04,-8.53,;62.67,-9.94,;64.2,-10.11,;64.83,-11.51,;63.92,-12.76,;67.42,-10.34,;66.8,-11.74,;67.71,-12.98,;67.09,-14.39,;69.24,-12.81,;68.92,-10.01,)|

BDBM50544737

COCCNC(=O)C[C@H](CCC1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:8.8,(23.56,-29.8,;22.22,-29.03,;20.89,-29.81,;19.55,-29.04,;18.22,-29.81,;16.89,-29.04,;16.88,-27.5,;15.55,-29.82,;14.22,-29.05,;14.22,-27.51,;15.55,-26.74,;15.55,-25.2,;16.88,-24.43,;16.88,-22.89,;15.55,-22.12,;14.21,-22.89,;14.21,-24.43,;12.89,-29.82,;11.55,-29.05,;11.55,-27.51,;10.22,-29.82,;8.81,-29.2,;7.78,-30.35,;6.25,-30.19,;5.62,-28.79,;6.53,-27.54,;5.9,-26.13,;4.09,-28.63,;3.18,-29.87,;3.8,-31.28,;5.34,-31.45,;5.97,-32.85,;5.06,-34.1,;8.56,-31.68,;7.94,-33.08,;8.85,-34.33,;8.23,-35.74,;10.38,-34.16,;10.06,-31.36,)|

BDBM50544738

COC(=O)CNC(=O)C[C@H](CCC1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:9.9,(23.73,-49.7,;22.39,-48.93,;21.06,-49.7,;21.06,-51.24,;19.73,-48.93,;18.39,-49.71,;17.06,-48.94,;17.06,-47.4,;15.73,-49.71,;14.39,-48.94,;14.39,-47.4,;15.72,-46.63,;15.72,-45.09,;17.05,-44.32,;17.05,-42.79,;15.72,-42.01,;14.38,-42.78,;14.38,-44.33,;13.06,-49.72,;11.72,-48.95,;11.72,-47.41,;10.39,-49.72,;8.98,-49.1,;7.95,-50.24,;6.42,-50.09,;5.79,-48.68,;6.7,-47.44,;6.07,-46.03,;4.26,-48.52,;3.35,-49.77,;3.98,-51.18,;5.51,-51.34,;6.14,-52.75,;5.23,-53.99,;8.73,-51.57,;8.11,-52.98,;9.02,-54.22,;8.4,-55.63,;10.55,-54.05,;10.23,-51.25,)|

BDBM50544739

CCCn1nc(cc1-c1c(OC)cccc1OC)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:21.23,(69.22,-45.03,;69.83,-43.62,;68.92,-42.38,;69.54,-40.97,;71.05,-40.65,;71.2,-39.12,;69.8,-38.49,;68.77,-39.64,;67.23,-39.49,;66.61,-38.08,;67.51,-36.84,;66.88,-35.43,;65.08,-37.92,;64.17,-39.17,;64.79,-40.58,;66.32,-40.74,;66.95,-42.15,;66.04,-43.39,;72.54,-38.35,;72.53,-36.81,;73.87,-39.11,;75.2,-38.34,;75.2,-36.8,;76.53,-36.03,;76.53,-34.49,;77.86,-33.72,;77.87,-32.19,;76.53,-31.41,;75.2,-32.18,;75.19,-33.73,;76.54,-39.11,;77.87,-38.34,;79.21,-39.11,;77.87,-36.8,)|

BDBM50544740

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCc1ccccc1)CC(O)=O |r,wU:22.24,(6.83,-26.11,;7.46,-27.52,;6.55,-28.76,;5.03,-28.6,;4.11,-29.85,;4.74,-31.26,;6.27,-31.42,;6.9,-32.83,;5.99,-34.08,;7.18,-30.17,;8.72,-30.32,;9.75,-29.18,;11.15,-29.8,;10.99,-31.33,;9.49,-31.66,;8.87,-33.06,;9.78,-34.3,;9.16,-35.71,;11.31,-34.13,;12.49,-29.03,;12.48,-27.49,;13.82,-29.8,;15.15,-29.02,;15.15,-27.48,;16.48,-26.71,;16.48,-25.17,;17.81,-24.4,;17.81,-22.87,;16.48,-22.1,;15.15,-22.87,;15.14,-24.41,;16.49,-29.79,;17.82,-29.02,;19.16,-29.79,;17.82,-27.48,)|

BDBM50544741

COCCNC(=O)[C@H](CCc1ccccc1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:7.7,(81.02,-47.56,;79.69,-48.33,;78.35,-47.57,;77.02,-48.34,;75.69,-47.57,;74.35,-48.34,;74.36,-49.88,;73.02,-47.57,;73.02,-46.03,;74.35,-45.26,;74.35,-43.72,;75.68,-42.95,;75.68,-41.42,;74.35,-40.65,;73.01,-41.42,;73.01,-42.96,;71.69,-48.35,;70.35,-47.58,;70.35,-46.04,;69.02,-48.35,;67.61,-47.73,;66.58,-48.87,;65.05,-48.72,;64.42,-47.31,;65.32,-46.07,;64.7,-44.66,;62.89,-47.15,;61.98,-48.4,;62.6,-49.81,;64.14,-49.97,;64.76,-51.38,;63.86,-52.63,;67.35,-50.21,;66.74,-51.61,;67.65,-52.85,;67.03,-54.26,;69.18,-52.68,;68.86,-49.88,)|

BDBM50544742

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCC1CCCCC1)CC(=O)NC1CCC1 |r,wU:23.26,(36.48,-46.53,;37.11,-47.94,;36.21,-49.19,;34.68,-49.03,;33.77,-50.28,;34.39,-51.69,;35.92,-51.85,;36.55,-53.26,;35.64,-54.5,;36.83,-50.59,;38.37,-50.75,;39.4,-49.6,;40.81,-50.23,;40.65,-51.76,;39.14,-52.08,;38.52,-53.49,;37.03,-53.82,;36.88,-55.34,;38.28,-55.96,;39.31,-54.82,;42.14,-49.45,;42.13,-47.91,;43.47,-50.22,;44.8,-49.45,;44.8,-47.91,;46.13,-47.14,;46.13,-45.6,;47.46,-44.83,;47.46,-43.3,;46.13,-42.52,;44.8,-43.29,;44.79,-44.84,;46.14,-50.22,;47.47,-49.44,;47.47,-47.9,;48.81,-50.22,;50.14,-49.44,;51.63,-49.84,;52.02,-48.35,;50.54,-47.95,)|

BDBM50544743

COc1cccc(OC)c1-c1cc(nn1C)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:19.21,(40.39,-35.41,;41.02,-36.82,;40.12,-38.07,;38.59,-37.91,;37.68,-39.15,;38.3,-40.56,;39.83,-40.73,;40.46,-42.13,;39.55,-43.38,;40.74,-39.47,;42.28,-39.62,;43.31,-38.48,;44.71,-39.1,;44.56,-40.63,;43.05,-40.96,;42.43,-42.36,;46.05,-38.33,;46.04,-36.79,;47.38,-39.1,;48.71,-38.33,;48.71,-36.79,;50.04,-36.01,;50.04,-34.47,;51.37,-33.71,;51.37,-32.17,;50.04,-31.4,;48.71,-32.17,;48.7,-33.71,;50.05,-39.09,;51.38,-38.32,;52.72,-39.09,;51.38,-36.78,)|

BDBM50544744

CCC(O)CNC(=O)C[C@H](CCC1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:9.9,(23.75,-9.44,;22.42,-8.67,;21.08,-9.44,;21.09,-10.98,;19.75,-8.68,;18.42,-9.45,;17.08,-8.68,;17.08,-7.14,;15.75,-9.45,;14.41,-8.69,;14.41,-7.15,;15.74,-6.37,;15.74,-4.83,;17.07,-4.07,;17.08,-2.53,;15.74,-1.76,;14.41,-2.53,;14.4,-4.07,;13.08,-9.46,;11.75,-8.69,;11.74,-7.15,;10.41,-9.46,;9.01,-8.84,;7.98,-9.98,;6.44,-9.83,;5.82,-8.43,;6.72,-7.18,;6.09,-5.77,;4.29,-8.26,;3.38,-9.51,;4,-10.92,;5.53,-11.09,;6.16,-12.49,;5.25,-13.74,;8.75,-11.32,;8.13,-12.72,;9.04,-13.96,;8.43,-15.37,;10.58,-13.79,;10.26,-10.99,)|

BDBM50544745

CCN(CC)c1ccc2c(-c3ccc(cc3S([O-])(=O)=O)S(=O)(=O)CCCCCCCCCCCCNC(=O)NCCCC[C@H](NC(=O)Cc3csc(=N)n3C)C(=O)N[C@@H](Cc3cn(Cc4ccccc4)c[n+]3C)C(=O)NC3CCN(C)CC3)c3ccc(cc3oc2c1)=[N+](CC)CC |r,wU:58.60,wD:43.43,(12.2,-.37,;13.55,-1.1,;13.6,-2.64,;12.29,-3.45,;10.93,-2.72,;14.95,-3.37,;14.99,-4.92,;16.35,-5.65,;17.66,-4.84,;19.01,-5.57,;19.05,-7.11,;17.74,-7.91,;17.78,-9.45,;19.13,-10.18,;20.45,-9.37,;20.4,-7.83,;21.7,-7.02,;23.07,-7.75,;20.89,-5.71,;22.44,-5.66,;19.18,-11.72,;20.5,-10.94,;20.28,-12.8,;17.87,-12.5,;17.9,-14.04,;16.58,-14.83,;16.6,-16.37,;15.28,-17.17,;15.31,-18.71,;13.99,-19.5,;14.01,-21.04,;12.69,-21.83,;12.72,-23.37,;11.4,-24.16,;11.43,-25.7,;10.11,-26.5,;10.13,-28.04,;11.48,-28.78,;8.81,-28.83,;8.84,-30.37,;10.18,-31.11,;10.21,-32.65,;11.56,-33.4,;11.58,-34.94,;12.93,-35.69,;14.25,-34.9,;14.22,-33.36,;15.6,-35.64,;16.92,-34.85,;17.05,-33.31,;18.55,-32.97,;19.35,-34.29,;20.88,-34.42,;18.34,-35.45,;18.68,-36.95,;10.26,-35.73,;10.29,-37.27,;8.92,-34.99,;7.6,-35.78,;7.62,-37.32,;6.3,-38.11,;4.88,-37.51,;3.87,-38.67,;2.33,-38.54,;1.45,-39.8,;2.1,-41.18,;1.22,-42.44,;-.33,-42.31,;-.97,-40.92,;-.08,-39.66,;4.66,-39.99,;6.16,-39.65,;7.32,-40.66,;6.25,-35.03,;6.22,-33.49,;4.93,-35.82,;3.58,-35.08,;2.26,-35.88,;.92,-35.12,;.89,-33.58,;-.46,-32.83,;2.22,-32.79,;3.56,-33.54,;20.32,-4.76,;21.67,-5.49,;22.99,-4.69,;22.95,-3.15,;21.6,-2.41,;20.29,-3.22,;18.93,-2.48,;17.61,-3.29,;16.26,-2.56,;24.27,-2.35,;25.62,-3.09,;26.93,-2.29,;24.23,-.81,;25.55,-.01,)|

BDBM50544746

CCN(CC)c1ccc2c(-c3ccc(cc3S([O-])(=O)=O)S(=O)(=O)NC(=O)NCCCC[C@H](NC(=O)Cc3csc(=N)n3C)C(=O)N[C@@H](Cc3cn(Cc4ccccc4)c[n+]3C)C(=O)NC3CCN(C)CC3)c3ccc(cc3oc2c1)=[N+](CC)CC |r,wU:46.48,wD:31.31,(7.89,-20.87,;9.26,-21.59,;9.32,-23.13,;8.02,-23.95,;6.65,-23.24,;10.68,-23.84,;10.74,-25.39,;12.11,-26.1,;13.4,-25.27,;14.77,-25.99,;14.83,-27.53,;13.52,-28.35,;13.58,-29.89,;14.94,-30.6,;16.25,-29.77,;16.18,-28.24,;17.48,-27.41,;18.85,-28.13,;16.65,-26.11,;18.19,-26.04,;14.96,-32.14,;16.5,-32.14,;15.73,-33.47,;13.65,-32.94,;13.67,-34.48,;15.02,-35.22,;12.35,-35.27,;12.38,-36.81,;13.72,-37.56,;13.75,-39.1,;15.1,-39.84,;15.12,-41.38,;16.47,-42.13,;17.79,-41.34,;17.76,-39.8,;19.14,-42.09,;20.46,-41.29,;20.59,-39.76,;22.09,-39.41,;22.89,-40.73,;24.42,-40.86,;21.88,-41.89,;22.22,-43.39,;13.8,-42.18,;13.83,-43.72,;12.46,-41.43,;11.13,-42.22,;11.16,-43.76,;9.84,-44.55,;8.42,-43.95,;7.41,-45.11,;5.87,-44.98,;4.99,-46.24,;3.45,-46.1,;2.57,-47.36,;3.22,-48.76,;4.76,-48.89,;5.64,-47.63,;8.2,-46.44,;9.7,-46.09,;10.86,-47.1,;9.79,-41.47,;9.76,-39.93,;8.47,-42.27,;7.12,-41.52,;7.1,-39.98,;5.76,-39.23,;4.43,-40.02,;3.09,-39.27,;4.45,-41.56,;5.8,-42.32,;16.07,-25.17,;17.43,-25.89,;18.73,-25.07,;18.68,-23.53,;17.31,-22.8,;16.01,-23.62,;14.64,-22.9,;13.34,-23.73,;11.98,-23.02,;19.98,-22.71,;19.93,-21.17,;21.24,-20.36,;21.34,-23.43,;22.63,-22.63,)|

BDBM50544747

CCN(CC)C1C=CC2=C(c3ccc(cc3OC2=C1)N(CC)CC)c1ccc(cc1S([O-])(=O)=O)S(=O)(=O)NC(=O)NCCCC[C@H](NC(=O)Cc1csc(=N)n1C)C(=O)N[C@@H](Cc1cn(Cc2ccccc2)c[n+]1C)C(=O)NCC1CCN(C)CC1 |r,c:6,19,t:8|

BDBM50544748

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCC1CCCCC1)CC(N)=O |r,wU:22.24,(66.47,-26.21,;67.1,-27.62,;66.19,-28.87,;64.67,-28.7,;63.75,-29.95,;64.38,-31.36,;65.91,-31.52,;66.54,-32.93,;65.63,-34.18,;66.82,-30.27,;68.36,-30.42,;69.38,-29.28,;70.79,-29.9,;70.63,-31.43,;69.13,-31.76,;68.51,-33.16,;69.42,-34.4,;68.8,-35.81,;70.95,-34.23,;72.12,-29.13,;72.12,-27.59,;73.46,-29.9,;74.79,-29.13,;74.79,-27.59,;76.12,-26.81,;76.12,-25.27,;77.45,-24.51,;77.45,-22.97,;76.12,-22.2,;74.79,-22.97,;74.78,-24.51,;76.13,-29.89,;77.46,-29.12,;78.79,-29.89,;77.46,-27.58,)|

BDBM50183341

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wD:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;3.45,-11.34,;4.07,-12.75,;3.16,-13.99,;1.63,-13.82,;1.01,-12.41,;1.92,-11.17,;6.18,-7.61,;6.8,-9.02,;6.07,-10.02,;8.02,-9.16,)|

BDBM50544749

COC(=O)CN(C)C(=O)[C@H](CCc1ccccc1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(CC(C)C)n1 |r,wU:9.9,(52.52,-48.16,;51.18,-48.93,;49.85,-48.16,;49.85,-46.62,;48.52,-48.94,;47.18,-48.17,;47.18,-46.63,;45.85,-48.94,;45.85,-50.48,;44.51,-48.17,;44.51,-46.63,;45.84,-45.86,;45.84,-44.32,;47.17,-43.55,;47.17,-42.02,;45.84,-41.24,;44.51,-42.01,;44.5,-43.56,;43.18,-48.95,;41.85,-48.18,;41.84,-46.64,;40.51,-48.95,;39.11,-48.33,;38.08,-49.47,;36.54,-49.32,;35.92,-47.91,;36.82,-46.67,;36.19,-45.26,;34.39,-47.75,;33.48,-49,;34.1,-50.41,;35.63,-50.57,;36.26,-51.98,;35.35,-53.22,;38.85,-50.8,;38.23,-52.21,;39.14,-53.45,;38.53,-54.86,;40.67,-53.28,;40.36,-50.48,)|

BDBM50544750

COc1cccc(OC)c1-c1cc(nn1C1CCCCCC1)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:25.28,(36.85,-26.08,;37.47,-27.49,;36.57,-28.74,;35.04,-28.58,;34.13,-29.82,;34.75,-31.23,;36.28,-31.39,;36.86,-32.8,;36,-34.05,;37.2,-30.14,;38.73,-30.3,;39.76,-29.15,;41.17,-29.77,;41.01,-31.3,;39.51,-31.63,;38.88,-33.03,;39.88,-34.19,;39.6,-35.71,;38.24,-36.43,;36.84,-35.81,;36.44,-34.33,;37.35,-33.09,;42.51,-29,;42.5,-27.46,;43.84,-29.77,;45.17,-29,;45.17,-27.46,;46.5,-26.68,;46.5,-25.14,;47.83,-24.37,;47.83,-22.84,;46.5,-22.06,;45.16,-22.83,;45.16,-24.38,;46.51,-29.76,;47.84,-28.99,;49.18,-29.76,;47.84,-27.45,)|

BDBM50544751

COc1cccc(OC)c1-c1cc(nn1CC1CCCCC1)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:25.28,(8.69,-25.46,;9.32,-26.86,;8.41,-28.11,;6.89,-27.95,;5.97,-29.2,;6.6,-30.61,;8.13,-30.77,;8.76,-32.18,;7.85,-33.42,;9.04,-29.52,;10.58,-29.67,;11.6,-28.52,;13.01,-29.15,;12.85,-30.68,;11.35,-31,;10.73,-32.41,;11.64,-33.65,;11.01,-35.05,;11.92,-36.29,;13.45,-36.13,;14.07,-34.72,;13.16,-33.47,;14.34,-28.38,;14.34,-26.84,;15.68,-29.14,;17.01,-28.37,;17.01,-26.83,;18.34,-26.06,;18.34,-24.52,;19.67,-23.75,;19.67,-22.22,;18.34,-21.44,;17.01,-22.21,;17,-23.76,;18.35,-29.14,;19.68,-28.37,;21.01,-29.13,;19.68,-26.83,)|

BDBM50544752

COc1cccc(OC)c1-c1cc(nn1C1CCCCC1)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:24.27,(64.81,-5.23,;65.44,-6.63,;64.54,-7.88,;63.01,-7.72,;62.09,-8.97,;62.71,-10.37,;64.25,-10.54,;64.88,-11.95,;63.97,-13.19,;65.16,-9.29,;66.7,-9.44,;67.73,-8.29,;69.14,-8.92,;68.98,-10.45,;67.47,-10.77,;66.85,-12.18,;65.33,-12.34,;64.71,-13.74,;65.61,-14.97,;67.14,-14.81,;67.77,-13.4,;70.47,-8.14,;70.47,-6.6,;71.8,-8.92,;73.13,-8.14,;73.13,-6.6,;74.46,-5.83,;74.46,-4.29,;75.79,-3.52,;75.79,-1.99,;74.46,-1.21,;73.13,-1.98,;73.12,-3.53,;74.47,-8.91,;75.8,-8.13,;77.14,-8.91,;75.8,-6.59,)|

BDBM50544753

[#6]-[#6]-[#7](-[#6]-[#6])-c1ccc2-[#6](=[#6]-3-[#6]=[#6]\[#6](-[#6]=[#6]-3-c2c1)=[#7+](\[#6]-[#6])-[#6]-[#6])-c1ccc(cc1S([#8-])(=O)=O)S(=O)(=O)[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6]-c1csc(=[#7])n1-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1cn(-[#6]-c2ccccc2)c[n+]1-[#6])-[#6](=O)-[#7]-[#6]-1-[#6]-[#6]-[#7](-[#6])-[#6]-[#6]-1 |r,c:11,14,t:9|

BDBM50546706

CCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O)C(O)=O |r|

BDBM50546707

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(C)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546708

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(C)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546709

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546710

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546711

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546712

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546713

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546714

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546715

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546716

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546717

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546718

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546719

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546720

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546721

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546722

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546723

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546724

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546725

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546726

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50546727

[H][C@]12C[C@H](N(C(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(O)=O)C(O)=O)[C@@]1([H])CCCC2)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(cc1)-c1ccccc1)C(O)=O |r|

BDBM50553991

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50553992

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50553993

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50553994

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50553995

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50553996

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)CCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50553997

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50553998

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50553999

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCNC(=O)[C@@H](N)Cc1ccc(cc1)C(=O)c1ccccc1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554000

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCc1ccccc1)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554001

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554002

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554003

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOC)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554004

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554005

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCOC)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554006

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554007

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@](C)(CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554008

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554009

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCCC1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50554010

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50554011

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554012

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554013

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50554014

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(O)=O |r|

BDBM50556824

CSCC[C@H](NC(=O)[C@@H](N)CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50556825

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O)C(O)=O |r|

BDBM50556826

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O)C(O)=O |r|

BDBM50556827

CSCC[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)CCOCCOCCOCCOCCOCCOCCN)C(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50556828

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](NC(=O)CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O)C(O)=O |r|

BDBM50556829

CSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50565846

CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565847

CSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565848

CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565849

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565850

CC(C)C[C@H](N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565851

CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565852

CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565853

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565854

CCCCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565855

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50565856

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r|

BDBM50565857

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(cc1)C(=O)c1ccccc1)C(O)=O |r|

BDBM50565858

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cccc2ccccc12)C(O)=O |r|

BDBM50565859

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(O)=O)c1ccccc1 |r|

BDBM50565860

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(O)=O)Cc1ccccc1 |r|

BDBM50565861

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](CCC(O)=O)Cc1ccccc1 |r|

BDBM50565862

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)CCC(O)=O |r|

BDBM50565863

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50565864

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50565865

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)NC1(CC1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50565866

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50565867

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(O)=O |r|

BDBM50565868

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1C(O)=O |r|

BDBM50565869

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H](O)C[C@H]1C(O)=O |r|

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565880

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1CCCCC1)C(=O)N1CCC[C@H]1C(O)=O |r|

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565885

BDBM50565886

BDBM50565887

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565888

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565889

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565890

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565891

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O)C(C)(C)C |r|

BDBM50565892

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CC1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565893

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC1(CCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565894

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565895

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565896

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565897

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565898

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565899

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cncs1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565900

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cccs1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565901

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565902

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565903

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565904

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565905

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565906

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565907

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@](C)(CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565908

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565909

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O)C(C)(C)C |r|

BDBM50565910

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565911

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565912

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565913

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@](C)(Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565914

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)NC1(CCCC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50565915

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)NC1(CC1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50014620

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1cc(C2CCCC2)c(OCc2ccccc2)c(c1)C1CCCC1)C(O)=O |r|

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@H](Cc1cccc2ccccc12)C(=O)N[C@H](Cc1cc(C2CCCC2)c(O)c(c1)C1CCCC1)C(O)=O |r|

BDBM50567159

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1 |(29.35,-6.37,;30.68,-7.14,;32.02,-6.37,;33.35,-7.14,;34.69,-6.37,;34.69,-4.83,;36.02,-4.06,;36.01,-2.52,;37.35,-4.82,;37.36,-6.37,;38.69,-7.14,;36.02,-7.15,;36.02,-8.68,;37.35,-9.45,;38.68,-8.67,;40.02,-9.44,;37.36,-10.98,;36.02,-11.76,;34.68,-10.99,;34.69,-9.45,;33.35,-8.68,;32.02,-9.45,;38.68,-4.04,;37.9,-2.71,;39.45,-2.7,;40.02,-4.81,;40.02,-6.35,;41.35,-7.11,;42.69,-6.34,;42.68,-4.79,;41.34,-4.03,;44.02,-7.1,;44.03,-8.64,;45.36,-9.41,;46.69,-8.63,;48.03,-9.39,;46.68,-7.08,;45.34,-6.33,)|

BDBM50567160

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccnc1 |(55.23,-6.18,;56.56,-6.95,;57.89,-6.19,;59.23,-6.95,;60.56,-6.19,;60.56,-4.64,;61.89,-3.87,;61.89,-2.33,;63.23,-4.64,;63.23,-6.19,;64.57,-6.95,;61.89,-6.96,;61.9,-8.49,;63.23,-9.26,;64.56,-8.49,;65.89,-9.25,;63.23,-10.8,;61.89,-11.57,;60.56,-10.8,;60.56,-9.26,;59.23,-8.49,;57.89,-9.26,;64.55,-3.86,;63.78,-2.52,;65.32,-2.52,;65.89,-4.63,;65.89,-6.16,;67.23,-6.93,;68.56,-6.15,;68.55,-4.6,;67.21,-3.85,;69.9,-6.91,;71.22,-6.14,;72.56,-6.89,;72.57,-8.44,;71.24,-9.22,;69.9,-8.46,)|

BDBM50567161

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1cc(Cl)ccc1=O |(2.86,-35.48,;4.19,-36.25,;5.53,-35.48,;6.86,-36.24,;8.19,-35.48,;8.2,-33.94,;9.52,-33.16,;9.52,-31.62,;10.86,-33.93,;10.86,-35.48,;12.2,-36.25,;9.53,-36.25,;9.53,-37.79,;10.86,-38.55,;12.19,-37.78,;13.53,-38.54,;10.87,-40.09,;9.53,-40.87,;8.19,-40.09,;8.19,-38.55,;6.86,-37.78,;5.53,-38.55,;12.19,-33.15,;11.41,-31.81,;12.96,-31.81,;13.53,-33.92,;13.53,-35.45,;14.86,-36.22,;16.19,-35.44,;16.18,-33.9,;14.85,-33.14,;17.53,-36.21,;17.53,-37.75,;18.87,-38.51,;18.88,-40.05,;20.2,-37.73,;20.19,-36.19,;18.85,-35.43,;18.84,-33.89,)|

BDBM50567162

CCCCc1[nH]c(=O)c(c(O)c1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)cc1 |(27.58,-36.46,;28.91,-37.23,;30.24,-36.46,;31.58,-37.23,;32.91,-36.47,;32.91,-34.92,;34.24,-34.15,;34.24,-32.61,;35.58,-34.91,;35.58,-36.46,;36.92,-37.23,;34.24,-37.24,;34.25,-38.77,;35.58,-39.54,;36.91,-38.76,;38.24,-39.53,;35.58,-41.07,;34.24,-41.85,;32.91,-41.08,;32.91,-39.54,;31.58,-38.77,;30.24,-39.54,;36.9,-34.14,;36.13,-32.8,;37.67,-32.79,;38.24,-34.9,;38.24,-36.44,;39.58,-37.2,;40.91,-36.43,;40.9,-34.88,;39.56,-34.12,;42.25,-37.19,;42.25,-38.73,;43.59,-39.5,;44.92,-38.72,;46.26,-39.48,;44.9,-37.17,;43.57,-36.42,)|

BDBM50567163

CCCCc1[nH]c(=O)c(c(O)c1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccncc1C |(53.9,-35.82,;55.23,-36.59,;56.57,-35.82,;57.9,-36.59,;59.23,-35.82,;59.24,-34.28,;60.57,-33.51,;60.56,-31.97,;61.9,-34.27,;61.91,-35.82,;63.24,-36.59,;60.57,-36.59,;60.57,-38.13,;61.9,-38.89,;63.23,-38.12,;64.57,-38.89,;61.91,-40.43,;60.57,-41.21,;59.23,-40.44,;59.23,-38.9,;57.9,-38.13,;56.57,-38.89,;63.23,-33.49,;62.45,-32.16,;64,-32.15,;64.57,-34.26,;64.57,-35.8,;65.9,-36.56,;67.24,-35.79,;67.22,-34.24,;65.89,-33.48,;68.57,-36.55,;69.89,-35.77,;71.23,-36.53,;71.24,-38.08,;69.91,-38.86,;68.58,-38.09,;67.24,-38.87,)|

BDBM50567164

CCCCc1[nH]c(=O)c(c(O)c1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccnc1OC |(1.28,-54.76,;2.61,-55.53,;3.95,-54.76,;5.28,-55.53,;6.61,-54.76,;6.62,-53.22,;7.95,-52.45,;7.94,-50.91,;9.28,-53.21,;9.29,-54.76,;10.62,-55.53,;7.95,-55.53,;7.95,-57.07,;9.28,-57.83,;10.61,-57.06,;11.95,-57.83,;9.29,-59.37,;7.95,-60.15,;6.61,-59.38,;6.61,-57.84,;5.28,-57.07,;3.95,-57.83,;10.61,-52.43,;9.83,-51.09,;11.38,-51.09,;11.95,-53.2,;11.95,-54.74,;13.28,-55.5,;14.62,-54.73,;14.6,-53.18,;13.27,-52.42,;15.95,-55.49,;17.27,-54.71,;18.61,-55.47,;18.62,-57.02,;17.29,-57.79,;15.96,-57.03,;14.62,-57.81,;14.63,-59.35,)|

BDBM50567165

CCCCc1[nH]c(=O)c(c(O)c1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1ccc(F)nc1 |(27.06,-54.59,;28.39,-55.36,;29.72,-54.59,;31.06,-55.35,;32.39,-54.59,;32.39,-53.05,;33.72,-52.28,;33.72,-50.74,;35.06,-53.04,;35.06,-54.59,;36.4,-55.36,;33.72,-55.36,;33.73,-56.9,;35.06,-57.66,;36.39,-56.89,;37.72,-57.66,;35.06,-59.2,;33.72,-59.98,;32.39,-59.2,;32.39,-57.67,;31.06,-56.89,;29.72,-57.66,;36.39,-52.26,;35.61,-50.92,;37.16,-50.92,;37.72,-53.03,;37.72,-54.56,;39.06,-55.33,;40.39,-54.55,;40.38,-53.01,;39.04,-52.25,;41.73,-55.32,;43.05,-54.54,;44.39,-55.3,;44.4,-56.85,;45.74,-57.61,;43.07,-57.62,;41.73,-56.86,)|

BDBM50567166

CCCCc1[nH]c(=O)c(c(O)c1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1ccccc1=O |(54.82,-54.94,;56.15,-55.71,;57.48,-54.94,;58.82,-55.7,;60.15,-54.94,;60.15,-53.4,;61.48,-52.63,;61.48,-51.09,;62.82,-53.39,;62.82,-54.94,;64.16,-55.71,;61.48,-55.71,;61.49,-57.25,;62.82,-58.01,;64.15,-57.24,;65.48,-58.01,;62.82,-59.55,;61.48,-60.33,;60.15,-59.55,;60.15,-58.02,;58.82,-57.24,;57.48,-58.01,;64.15,-52.61,;63.37,-51.27,;64.91,-51.27,;65.48,-53.38,;65.48,-54.91,;66.82,-55.68,;68.15,-54.9,;68.14,-53.36,;66.8,-52.6,;69.49,-55.67,;69.49,-57.21,;70.83,-57.97,;72.16,-57.2,;72.15,-55.65,;70.81,-54.89,;70.8,-53.35,)|

BDBM50567167

CCCCc1[nH]c(=O)c(c(O)c1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-n1cc(Cl)ccc1=O |(2.32,-5.85,;3.65,-6.62,;4.99,-5.85,;6.33,-6.62,;7.66,-5.85,;7.66,-4.31,;8.99,-3.54,;8.98,-2,;10.32,-4.3,;10.33,-5.85,;11.66,-6.62,;8.99,-6.62,;8.99,-8.16,;10.32,-8.93,;11.66,-8.15,;12.99,-8.92,;10.33,-10.46,;8.99,-11.24,;7.66,-10.47,;7.66,-8.93,;6.32,-8.16,;4.99,-8.93,;11.65,-3.52,;10.87,-2.19,;12.42,-2.18,;12.99,-4.29,;12.99,-5.83,;14.33,-6.59,;15.66,-5.82,;15.65,-4.27,;14.31,-3.51,;16.99,-6.58,;17,-8.12,;18.33,-8.89,;18.34,-10.43,;19.67,-8.11,;19.65,-6.56,;18.32,-5.8,;18.3,-4.26,)|

BDBM50567168

CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)C1CC1 |(40.9,-21.23,;42.23,-22,;43.57,-21.24,;44.9,-22,;46.23,-21.24,;46.24,-19.69,;47.56,-18.92,;47.56,-17.38,;48.9,-19.69,;48.91,-21.24,;50.24,-22,;47.57,-22.01,;47.57,-23.54,;48.9,-24.31,;50.23,-23.54,;51.57,-24.3,;48.91,-25.85,;47.57,-26.62,;46.23,-25.85,;46.23,-24.31,;44.9,-23.54,;43.57,-24.31,;50.23,-18.91,;49.45,-17.57,;51,-17.57,;51.57,-19.68,;51.57,-21.21,;52.9,-21.98,;54.23,-21.2,;54.22,-19.65,;52.89,-18.9,;55.57,-21.96,;56.35,-23.29,;57.11,-21.96,)|

BDBM50567169

CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(19.32,-34.97,;20.66,-35.74,;21.99,-34.96,;23.33,-35.72,;24.66,-34.94,;24.64,-33.41,;25.98,-32.63,;25.97,-31.09,;27.32,-33.39,;28.65,-32.62,;28.8,-31.09,;30.31,-30.76,;31.08,-32.09,;32.61,-32.25,;33.24,-33.66,;34.77,-33.81,;35.4,-35.21,;34.5,-36.46,;35.12,-37.87,;32.96,-36.3,;32.34,-34.9,;30.05,-33.24,;27.32,-34.93,;28.65,-35.71,;25.99,-35.7,;26,-37.24,;24.67,-38.01,;23.34,-37.25,;22.01,-38.02,;24.67,-39.55,;26,-40.32,;27.34,-39.55,;27.33,-38,;28.67,-37.23,;30,-38,)|

BDBM50570414

CCCCc1[nH]c(=O)c(C(=O)OCC)c(O)c1-c1c(OC)cccc1OC |(.82,-4.56,;2.16,-5.33,;3.49,-4.55,;4.82,-5.31,;6.15,-4.53,;6.14,-3,;7.48,-2.21,;7.47,-.67,;8.81,-2.98,;10.15,-2.21,;10.14,-.67,;11.48,-2.98,;12.81,-2.2,;14.15,-2.97,;8.82,-4.52,;10.15,-5.29,;7.48,-5.29,;7.49,-6.83,;6.17,-7.6,;4.83,-6.83,;3.5,-7.61,;6.16,-9.14,;7.5,-9.91,;8.83,-9.14,;8.83,-7.59,;10.16,-6.82,;11.5,-7.59,)|

BDBM50570415

CCCCc1[nH]c(=O)c(-c2n[nH]c(Cc3ccccc3)n2)c(O)c1-c1c(OC)cccc1OC |(13.71,-4.63,;15.04,-5.39,;16.37,-4.61,;17.71,-5.37,;19.04,-4.6,;19.03,-3.06,;20.37,-2.28,;20.36,-.74,;21.7,-3.04,;23.03,-2.27,;23.19,-.74,;24.69,-.41,;25.47,-1.75,;27,-1.9,;27.63,-3.31,;26.72,-4.55,;27.35,-5.96,;28.88,-6.11,;29.79,-4.86,;29.15,-3.46,;24.44,-2.89,;21.71,-4.58,;23.04,-5.36,;20.37,-5.36,;20.38,-6.89,;19.05,-7.66,;17.72,-6.9,;16.39,-7.67,;19.05,-9.21,;20.39,-9.98,;21.72,-9.2,;21.72,-7.65,;23.05,-6.88,;24.38,-7.65,)|

BDBM50570416

CCCCc1[nH]c(=O)c(-c2nc(Cc3ccccc3)no2)c(O)c1-c1c(OC)cccc1OC |(30.75,-4.85,;32.08,-5.61,;33.41,-4.84,;34.75,-5.6,;36.08,-4.82,;36.07,-3.28,;37.41,-2.5,;37.4,-.96,;38.74,-3.27,;40.07,-2.5,;41.48,-3.12,;42.51,-1.97,;44.04,-2.13,;44.67,-3.53,;43.76,-4.78,;44.39,-6.18,;45.92,-6.34,;46.83,-5.08,;46.19,-3.68,;41.73,-.64,;40.23,-.96,;38.75,-4.81,;40.08,-5.58,;37.41,-5.58,;37.42,-7.12,;36.09,-7.89,;34.76,-7.12,;33.43,-7.9,;36.09,-9.43,;37.43,-10.2,;38.76,-9.43,;38.76,-7.88,;40.09,-7.11,;41.43,-7.88,)|

BDBM50570417

CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(48.64,-5.04,;49.98,-5.8,;51.31,-5.02,;52.65,-5.79,;53.98,-5.01,;53.97,-3.47,;55.3,-2.69,;55.3,-1.15,;56.64,-3.46,;57.97,-2.68,;58.13,-1.15,;59.63,-.83,;60.41,-2.16,;61.94,-2.31,;62.57,-3.72,;61.66,-4.96,;62.29,-6.37,;63.82,-6.53,;64.73,-5.27,;64.09,-3.87,;59.38,-3.3,;56.65,-5,;57.98,-5.77,;55.31,-5.77,;55.32,-7.3,;53.99,-8.07,;52.66,-7.31,;51.33,-8.08,;53.99,-9.62,;55.32,-10.39,;56.66,-9.62,;56.66,-8.07,;57.99,-7.3,;59.32,-8.06,)|

BDBM50570418

CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(.71,-14.58,;2.05,-15.34,;3.38,-14.57,;4.71,-15.33,;6.04,-14.55,;6.03,-13.01,;7.37,-12.23,;7.36,-10.69,;8.71,-13,;10.04,-12.23,;10.19,-10.69,;11.7,-10.37,;12.47,-11.7,;14,-11.86,;14.63,-13.26,;13.72,-14.51,;14.35,-15.91,;15.89,-16.07,;16.79,-14.81,;16.16,-13.41,;17.06,-12.16,;11.44,-12.85,;8.71,-14.54,;10.04,-15.31,;7.38,-15.31,;7.38,-16.85,;6.06,-17.62,;4.73,-16.85,;3.39,-17.63,;6.05,-19.16,;7.39,-19.93,;8.73,-19.16,;8.72,-17.61,;10.05,-16.84,;11.39,-17.61,)|

BDBM50570419

CCCCc1[nH]c(=O)c(-c2nnc(Cc3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(17.91,-14.72,;19.24,-15.48,;20.57,-14.71,;21.91,-15.47,;23.24,-14.69,;23.23,-13.15,;24.57,-12.37,;24.56,-10.83,;25.9,-13.14,;27.23,-12.37,;27.39,-10.83,;28.89,-10.51,;29.67,-11.84,;31.2,-12,;31.83,-13.4,;30.92,-14.65,;31.55,-16.05,;33.08,-16.21,;33.99,-14.95,;35.52,-15.11,;33.35,-13.55,;28.64,-12.99,;25.91,-14.68,;27.24,-15.45,;24.57,-15.45,;24.58,-16.99,;23.25,-17.76,;21.92,-16.99,;20.59,-17.77,;23.25,-19.3,;24.58,-20.07,;25.92,-19.3,;25.92,-17.75,;27.25,-16.98,;28.58,-17.75,)|

BDBM50570420

CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(36.73,-14.63,;38.06,-15.39,;39.39,-14.61,;40.73,-15.37,;42.06,-14.6,;42.05,-13.06,;43.39,-12.28,;43.38,-10.74,;44.72,-13.05,;46.05,-12.27,;46.21,-10.74,;47.71,-10.42,;48.49,-11.75,;50.02,-11.9,;50.65,-13.31,;49.74,-14.55,;50.37,-15.96,;51.9,-16.12,;52.53,-17.53,;52.81,-14.86,;52.17,-13.46,;47.46,-12.89,;44.73,-14.58,;46.06,-15.36,;43.39,-15.36,;43.4,-16.89,;42.07,-17.66,;40.74,-16.9,;39.41,-17.67,;42.07,-19.21,;43.41,-19.98,;44.74,-19.21,;44.74,-17.66,;46.07,-16.88,;47.4,-17.65,)|

BDBM50570421

CCCCc1[nH]c(=O)c(-c2nnc(o2)-c2ccc(Cl)cc2)c(O)c1-c1c(OC)cccc1OC |(53.34,-14.22,;54.68,-14.98,;56.01,-14.2,;57.35,-14.96,;58.68,-14.19,;58.67,-12.65,;60,-11.87,;60,-10.33,;61.34,-12.63,;62.67,-11.86,;62.82,-10.33,;64.33,-10,;65.1,-11.34,;64.08,-12.48,;66.64,-11.49,;67.26,-12.9,;68.79,-13.06,;69.69,-11.81,;71.22,-11.97,;69.05,-10.4,;67.53,-10.25,;61.34,-14.17,;62.67,-14.95,;60.01,-14.95,;60.02,-16.48,;58.69,-17.25,;57.36,-16.49,;56.03,-17.26,;58.69,-18.8,;60.02,-19.57,;61.36,-18.8,;61.35,-17.24,;62.69,-16.47,;64.02,-17.24,)|

BDBM50570422

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(=O)[nH]c1C1CC1 |(.41,-28.21,;1.74,-27.44,;3.07,-28.2,;3.07,-29.75,;4.4,-30.52,;5.74,-29.75,;5.73,-28.19,;7.07,-27.42,;8.4,-28.19,;4.4,-27.43,;4.39,-25.9,;5.72,-25.12,;7.05,-25.9,;5.72,-23.59,;7.05,-22.81,;7.2,-21.28,;8.71,-20.95,;9.48,-22.29,;11.01,-22.44,;11.64,-23.85,;10.74,-25.09,;11.37,-26.5,;12.9,-26.65,;13.52,-28.06,;13.8,-25.4,;13.17,-24,;8.45,-23.43,;4.38,-22.82,;4.38,-21.28,;3.05,-23.6,;3.06,-25.14,;1.73,-25.91,;.18,-25.93,;.96,-27.26,)|

BDBM50570423

COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(=O)[nH]c1C1CCCC1 |(16.9,-27.97,;18.24,-27.2,;19.57,-27.96,;19.56,-29.5,;20.9,-30.28,;22.24,-29.5,;22.23,-27.95,;23.56,-27.18,;24.9,-27.95,;20.89,-27.19,;20.88,-25.66,;22.22,-24.88,;23.55,-25.66,;22.22,-23.34,;23.55,-22.57,;23.7,-21.04,;25.21,-20.71,;25.98,-22.04,;27.51,-22.2,;28.14,-23.61,;27.23,-24.85,;27.86,-26.26,;29.4,-26.41,;30.02,-27.82,;30.3,-25.16,;29.66,-23.76,;24.95,-23.19,;20.88,-22.58,;20.87,-21.04,;19.54,-23.36,;19.55,-24.89,;18.12,-25.44,;16.82,-24.61,;15.62,-25.57,;16.17,-27.01,;17.71,-26.94,)|

BDBM50570424

COCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(32.64,-24.82,;33.98,-25.59,;35.31,-24.81,;36.65,-25.57,;37.98,-24.79,;37.97,-23.26,;39.3,-22.48,;39.3,-20.94,;40.64,-23.24,;41.97,-22.47,;42.12,-20.94,;43.63,-20.61,;44.4,-21.94,;45.94,-22.1,;46.56,-23.51,;45.66,-24.75,;46.29,-26.15,;47.82,-26.31,;48.45,-27.72,;48.72,-25.05,;48.09,-23.66,;43.38,-23.09,;40.64,-24.78,;41.97,-25.55,;39.31,-25.55,;39.32,-27.09,;37.99,-27.86,;36.66,-27.09,;35.33,-27.87,;37.99,-29.4,;39.32,-30.17,;40.66,-29.4,;40.65,-27.85,;41.99,-27.08,;43.32,-27.85,)|

BDBM50570425

CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(51.08,-24.65,;52.42,-25.41,;53.75,-24.63,;55.09,-25.39,;56.42,-24.61,;56.41,-23.08,;57.74,-22.3,;57.74,-20.76,;59.08,-23.06,;60.41,-22.29,;60.57,-20.76,;62.07,-20.43,;62.84,-21.76,;64.38,-21.92,;65.01,-23.33,;64.1,-24.57,;64.73,-25.98,;66.26,-26.13,;66.89,-27.54,;67.16,-24.88,;66.53,-23.48,;61.82,-22.91,;59.09,-24.6,;60.42,-25.38,;57.75,-25.38,;57.76,-26.91,;56.43,-27.68,;55.1,-26.92,;53.77,-27.69,;56.43,-29.22,;57.76,-30,;59.1,-29.22,;59.1,-27.67,;60.43,-26.9,;61.76,-27.67,)|

BDBM50570426

CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)nc3)o2)c(O)c1-c1c(OC)cccc1OC |(.83,-34.32,;2.17,-35.08,;3.5,-34.31,;4.84,-35.07,;6.17,-34.29,;6.16,-32.75,;7.49,-31.97,;7.49,-30.43,;8.83,-32.74,;10.16,-31.97,;10.31,-30.43,;11.82,-30.11,;12.59,-31.44,;14.13,-31.6,;14.76,-33,;16.28,-33.15,;16.91,-34.55,;16.01,-35.81,;16.64,-37.22,;14.48,-35.65,;13.85,-34.25,;11.57,-32.59,;8.83,-34.28,;10.16,-35.05,;7.5,-35.05,;7.51,-36.59,;6.18,-37.36,;4.85,-36.59,;3.52,-37.36,;6.18,-38.9,;7.51,-39.67,;8.85,-38.9,;8.84,-37.35,;10.18,-36.58,;11.51,-37.35,)|

BDBM50571376

CCN(CC)CC[C@@H](CC(O)=O)NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)C1CCCC1

BDBM50571377

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCC1)CC(O)=O

BDBM50571378

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(O)=O

BDBM50571379

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCOCC1)CC(O)=O

BDBM50571380

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCNCC1)CC(O)=O

BDBM50571381

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1C(C)CCCC1C)CC(O)=O

BDBM50571382

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1C2CCC1CC2)CC(O)=O

BDBM50571383

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCCC1)CC(O)=O

BDBM50571384

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCC1)CC(=O)NC1CCC1

BDBM50571385

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1

BDBM50571386

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCOCC1)CC(=O)NC1CCC1

BDBM50571387

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCN(C)CC1)CC(=O)NC1CCC1

BDBM50571388

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1C(C)CCCC1C)CC(=O)NC1CCC1

BDBM50571389

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1C2CCC1CC2)CC(=O)NC1CCC1

BDBM50571390

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCCC1)CC(=O)NC1CCC1

BDBM50571391

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)OC1CCC1 |r,wU:23.26,(62.36,-50.2,;63.51,-51.23,;63.19,-52.74,;61.73,-53.22,;61.41,-54.73,;62.56,-55.76,;64.02,-55.27,;65.17,-56.3,;64.86,-57.81,;64.34,-53.77,;65.79,-53.3,;66.26,-51.83,;67.8,-51.83,;68.28,-53.29,;67.04,-54.2,;67.04,-55.74,;65.8,-56.64,;66.27,-58.11,;67.81,-58.11,;68.29,-56.64,;68.71,-50.58,;68.08,-49.17,;70.24,-50.74,;71.14,-49.49,;70.51,-48.09,;71.42,-46.84,;70.79,-45.43,;71.7,-44.18,;71.08,-42.78,;69.55,-42.62,;68.64,-43.86,;69.26,-45.28,;72.67,-49.65,;73.58,-48.4,;72.95,-47,;75.11,-48.56,;76.01,-47.31,;77.53,-47.07,;77.29,-45.55,;75.77,-45.79,)|

BDBM50571392

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CC(F)(F)C1 |r,wU:23.26,(15.01,-9.2,;16.16,-10.23,;15.84,-11.74,;14.38,-12.21,;14.06,-13.72,;15.21,-14.75,;16.67,-14.27,;17.82,-15.3,;17.51,-16.8,;16.98,-12.77,;18.44,-12.29,;18.91,-10.83,;20.45,-10.82,;20.93,-12.29,;19.69,-13.19,;19.69,-14.73,;18.45,-15.64,;18.92,-17.1,;20.46,-17.1,;20.94,-15.64,;21.36,-9.58,;20.73,-8.17,;22.89,-9.73,;23.79,-8.49,;23.16,-7.08,;24.07,-5.83,;23.44,-4.43,;24.35,-3.18,;23.73,-1.78,;22.2,-1.61,;21.29,-2.86,;21.91,-4.27,;25.32,-8.65,;26.23,-7.4,;25.6,-5.99,;27.76,-7.56,;28.66,-6.31,;30.18,-6.07,;29.93,-4.54,;30.33,-3.05,;31.42,-4.14,;28.41,-4.79,)|

BDBM50571393

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)N(C)C1CCC1 |r,wU:23.26,(28.59,-8.86,;29.74,-9.89,;29.42,-11.4,;27.96,-11.87,;27.64,-13.38,;28.79,-14.41,;30.25,-13.93,;31.4,-14.95,;31.09,-16.46,;30.57,-12.43,;32.02,-11.95,;32.49,-10.48,;34.03,-10.48,;34.51,-11.95,;33.27,-12.85,;33.28,-14.39,;32.03,-15.3,;32.5,-16.76,;34.04,-16.76,;34.52,-15.3,;34.94,-9.23,;34.31,-7.83,;36.47,-9.39,;37.37,-8.15,;36.74,-6.74,;37.65,-5.49,;37.02,-4.09,;37.93,-2.84,;37.31,-1.44,;35.78,-1.27,;34.87,-2.52,;35.49,-3.93,;38.9,-8.3,;39.81,-7.06,;39.18,-5.65,;41.34,-7.22,;41.73,-8.7,;42.24,-5.97,;43.76,-5.73,;43.51,-4.2,;42,-4.45,)|

BDBM50571394

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1(C)CCC1 |r,wU:23.26,(41.41,-9.55,;42.55,-10.58,;42.24,-12.09,;40.77,-12.56,;40.45,-14.07,;41.61,-15.1,;43.07,-14.62,;44.22,-15.65,;43.9,-17.15,;43.38,-13.12,;44.84,-12.64,;45.31,-11.18,;46.85,-11.17,;47.33,-12.64,;46.08,-13.54,;46.09,-15.08,;44.85,-15.99,;45.32,-17.45,;46.86,-17.45,;47.34,-15.99,;47.75,-9.93,;47.12,-8.52,;49.28,-10.09,;50.19,-8.84,;49.56,-7.43,;50.46,-6.18,;49.83,-4.78,;50.75,-3.53,;50.12,-2.13,;48.59,-1.96,;47.69,-3.21,;48.31,-4.62,;51.72,-9,;52.62,-7.75,;51.99,-6.34,;54.15,-7.91,;55.06,-6.66,;56.14,-7.75,;56.58,-6.42,;56.33,-4.89,;54.81,-5.14,)|

BDBM50571395

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1(C)COC1 |r,wU:23.26,(55.82,-9.68,;56.96,-10.71,;56.64,-12.21,;55.18,-12.69,;54.86,-14.2,;56.02,-15.23,;57.47,-14.74,;58.62,-15.77,;58.31,-17.28,;57.79,-13.24,;59.24,-12.77,;59.72,-11.3,;61.26,-11.3,;61.73,-12.76,;60.49,-13.67,;60.5,-15.21,;59.26,-16.11,;59.73,-17.58,;61.27,-17.58,;61.75,-16.11,;62.16,-10.05,;61.53,-8.65,;63.69,-10.21,;64.59,-8.96,;63.97,-7.56,;64.87,-6.31,;64.24,-4.9,;65.15,-3.65,;64.53,-2.25,;63,-2.09,;62.09,-3.33,;62.72,-4.75,;66.13,-9.12,;67.03,-7.87,;66.4,-6.47,;68.56,-8.03,;69.46,-6.79,;70.55,-7.87,;70.98,-6.54,;70.73,-5.02,;69.22,-5.26,)|

BDBM50571396

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1(C)CC1 |r,wU:23.26,(70.8,-9.5,;71.95,-10.53,;71.63,-12.03,;70.17,-12.51,;69.85,-14.02,;71,-15.05,;72.46,-14.57,;73.61,-15.59,;73.3,-17.1,;72.77,-13.06,;74.23,-12.59,;74.7,-11.12,;76.24,-11.12,;76.72,-12.58,;75.48,-13.49,;75.48,-15.03,;74.24,-15.94,;74.71,-17.4,;76.25,-17.4,;76.73,-15.94,;77.15,-9.87,;76.52,-8.47,;78.68,-10.03,;79.58,-8.78,;78.95,-7.38,;79.86,-6.13,;79.23,-4.72,;80.14,-3.48,;79.52,-2.07,;77.99,-1.91,;77.08,-3.15,;77.7,-4.57,;81.11,-8.94,;82.02,-7.69,;81.39,-6.29,;83.55,-7.85,;84.44,-6.6,;84.21,-5.09,;85.98,-6.6,;85.21,-7.94,)|

BDBM50571397

COCCN(C)C(=O)C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)C1CCCC1 |r,wU:9.9,(18.17,-23.03,;16.64,-22.88,;15.74,-24.13,;14.21,-23.98,;13.31,-25.23,;13.95,-26.63,;11.78,-25.07,;11.15,-23.66,;10.88,-26.32,;9.35,-26.16,;8.72,-24.75,;9.62,-23.51,;8.99,-22.1,;9.91,-20.85,;9.28,-19.45,;7.75,-19.28,;6.85,-20.53,;7.47,-21.94,;8.44,-27.41,;6.91,-27.25,;6.28,-25.84,;6.01,-28.49,;4.47,-28.5,;4,-29.96,;2.54,-30.44,;1.39,-29.41,;1.71,-27.9,;.57,-26.87,;-.07,-29.88,;-.39,-31.39,;.77,-32.42,;2.23,-31.94,;3.38,-32.97,;3.06,-34.47,;5.24,-30.87,;6.49,-29.96,;5.25,-32.4,;4.01,-33.31,;4.48,-34.77,;6.02,-34.77,;6.5,-33.31,)|

BDBM50571398

COCCNC(=O)C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)C1CCCC1 |r,wU:8.8,(32.52,-23.55,;30.99,-23.4,;30.09,-24.65,;28.56,-24.5,;27.66,-25.75,;26.13,-25.59,;25.5,-24.19,;25.23,-26.84,;23.7,-26.68,;23.07,-25.27,;23.97,-24.03,;23.34,-22.62,;24.26,-21.37,;23.63,-19.97,;22.1,-19.8,;21.19,-21.05,;21.82,-22.46,;22.79,-27.93,;21.26,-27.77,;20.63,-26.36,;20.36,-29.02,;18.82,-29.02,;18.35,-30.48,;16.89,-30.96,;15.74,-29.93,;16.06,-28.42,;14.92,-27.39,;14.28,-30.41,;13.96,-31.91,;15.12,-32.94,;16.58,-32.46,;17.73,-33.49,;17.41,-34.99,;19.59,-31.39,;20.84,-30.48,;19.6,-32.92,;18.36,-33.83,;18.83,-35.3,;20.37,-35.3,;20.85,-33.83,)|

BDBM50571399

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)N1CC2(COC2)C1 |r,wU:23.26,(28.71,-27.51,;29.85,-28.54,;29.54,-30.05,;28.07,-30.52,;27.75,-32.03,;28.91,-33.06,;30.37,-32.58,;31.52,-33.6,;31.2,-35.11,;30.68,-31.08,;32.14,-30.6,;32.61,-29.13,;34.15,-29.13,;34.63,-30.6,;33.38,-31.5,;33.39,-33.04,;32.15,-33.95,;32.62,-35.41,;34.16,-35.41,;34.64,-33.95,;35.05,-27.89,;34.42,-26.48,;36.58,-28.04,;37.49,-26.8,;36.86,-25.39,;37.76,-24.14,;37.13,-22.74,;38.05,-21.49,;37.42,-20.09,;35.89,-19.92,;34.99,-21.17,;35.61,-22.58,;39.02,-26.96,;39.92,-25.71,;39.29,-24.3,;41.45,-25.87,;42.42,-27.06,;43.61,-26.09,;44.7,-27.18,;45.79,-26.09,;44.7,-25,;42.64,-24.9,)|

BDBM50571400

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NCc1ncco1 |r,wU:23.26,(43.18,-29.73,;44.33,-30.76,;44.01,-32.26,;42.55,-32.74,;42.23,-34.25,;43.38,-35.28,;44.84,-34.8,;45.99,-35.82,;45.68,-37.33,;45.15,-33.29,;46.61,-32.82,;47.08,-31.35,;48.62,-31.35,;49.1,-32.81,;47.86,-33.72,;47.86,-35.26,;46.62,-36.16,;47.09,-37.63,;48.63,-37.63,;49.11,-36.16,;49.53,-30.1,;48.9,-28.7,;51.06,-30.26,;51.96,-29.01,;51.33,-27.61,;52.24,-26.36,;51.61,-24.95,;52.52,-23.71,;51.9,-22.3,;50.37,-22.14,;49.46,-23.38,;50.08,-24.8,;53.49,-29.17,;54.4,-27.92,;53.77,-26.52,;55.93,-28.08,;56.83,-26.84,;58.36,-26.99,;59.14,-28.32,;60.64,-27.99,;60.8,-26.46,;59.39,-25.84,)|

BDBM50571401

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)Nc1nccs1 |r,wU:23.26,(62.77,-29.2,;63.91,-30.23,;63.59,-31.73,;62.13,-32.21,;61.81,-33.72,;62.97,-34.75,;64.43,-34.27,;65.57,-35.29,;65.26,-36.8,;64.74,-32.77,;66.19,-32.29,;66.67,-30.82,;68.21,-30.82,;68.69,-32.28,;67.44,-33.19,;67.45,-34.73,;66.21,-35.64,;66.68,-37.1,;68.22,-37.1,;68.7,-35.64,;69.11,-29.57,;68.48,-28.17,;70.64,-29.73,;71.55,-28.48,;70.92,-27.08,;71.82,-25.83,;71.19,-24.43,;72.1,-23.18,;71.48,-21.77,;69.95,-21.61,;69.04,-22.85,;69.67,-24.27,;73.08,-28.64,;73.98,-27.4,;73.35,-25.99,;75.51,-27.55,;76.42,-26.31,;77.95,-26.3,;78.42,-24.84,;77.17,-23.93,;75.93,-24.84,)|

BDBM50571402

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)N(C)c1nccs1 |r,wU:23.26,(5.01,-45.46,;6.16,-46.49,;5.84,-48,;4.37,-48.47,;4.05,-49.98,;5.21,-51.01,;6.67,-50.53,;7.82,-51.55,;7.5,-53.06,;6.98,-49.03,;8.44,-48.55,;8.91,-47.09,;10.45,-47.08,;10.93,-48.55,;9.68,-49.45,;9.69,-50.99,;8.45,-51.9,;8.92,-53.36,;10.46,-53.36,;10.94,-51.9,;11.35,-45.84,;10.72,-44.43,;12.89,-45.99,;13.79,-44.75,;13.16,-43.34,;14.06,-42.09,;13.43,-40.69,;14.35,-39.44,;13.73,-38.04,;12.19,-37.87,;11.29,-39.12,;11.91,-40.53,;15.32,-44.91,;16.22,-43.66,;15.6,-42.25,;17.76,-43.82,;18.38,-45.22,;18.66,-42.57,;20.19,-42.56,;20.66,-41.1,;19.42,-40.2,;18.17,-41.1,)|

BDBM50571403

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)Nc1nnn[nH]1 |r,wU:23.26,(17.37,-47.15,;18.51,-48.18,;18.19,-49.68,;16.73,-50.16,;16.41,-51.67,;17.57,-52.7,;19.03,-52.22,;20.18,-53.24,;19.86,-54.75,;19.34,-50.72,;20.8,-50.24,;21.27,-48.77,;22.81,-48.77,;23.29,-50.23,;22.04,-51.14,;22.05,-52.68,;20.81,-53.59,;21.28,-55.05,;22.82,-55.05,;23.3,-53.59,;23.71,-47.52,;23.08,-46.12,;25.24,-47.68,;26.15,-46.44,;25.52,-45.03,;26.42,-43.78,;25.79,-42.38,;26.71,-41.13,;26.08,-39.73,;24.55,-39.56,;23.64,-40.81,;24.27,-42.22,;27.68,-46.59,;28.58,-45.35,;27.95,-43.94,;30.11,-45.51,;31.02,-44.26,;30.53,-42.79,;31.77,-41.88,;33.29,-42.74,;32.55,-44.25,)|

BDBM50571404

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NCc1nnn[nH]1 |r,wU:23.26,(31.82,-48.78,;32.97,-49.81,;32.65,-51.32,;31.18,-51.8,;30.86,-53.3,;32.02,-54.33,;33.48,-53.85,;34.63,-54.88,;34.31,-56.38,;33.79,-52.35,;35.25,-51.87,;35.72,-50.41,;37.26,-50.4,;37.74,-51.87,;36.49,-52.78,;36.5,-54.31,;35.26,-55.22,;35.73,-56.68,;37.27,-56.68,;37.75,-55.22,;38.16,-49.16,;37.53,-47.75,;39.7,-49.32,;40.6,-48.07,;39.97,-46.66,;40.87,-45.42,;40.24,-44.01,;41.16,-42.76,;40.54,-41.36,;39,-41.19,;38.1,-42.44,;38.72,-43.85,;42.13,-48.23,;43.03,-46.98,;42.41,-45.57,;44.57,-47.14,;45.47,-45.89,;47,-46.05,;48.03,-44.89,;49.44,-45.52,;49.28,-47.05,;47.77,-47.37,)|

BDBM50571405

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NCCc1nnn[nH]1 |r,wU:23.26,(47.27,-49.83,;48.41,-50.86,;48.09,-52.37,;46.63,-52.84,;46.31,-54.35,;47.47,-55.38,;48.92,-54.9,;50.07,-55.93,;49.76,-57.43,;49.24,-53.4,;50.69,-52.92,;51.17,-51.46,;52.71,-51.45,;53.18,-52.92,;51.94,-53.83,;51.95,-55.36,;50.71,-56.27,;51.18,-57.73,;52.72,-57.73,;53.2,-56.27,;53.61,-50.21,;52.98,-48.8,;55.14,-50.37,;56.04,-49.12,;55.42,-47.71,;56.32,-46.47,;55.69,-45.06,;56.6,-43.81,;55.98,-42.41,;54.45,-42.24,;53.54,-43.49,;54.17,-44.9,;57.58,-49.28,;58.48,-48.03,;57.85,-46.62,;60.01,-48.19,;60.91,-46.94,;62.45,-47.1,;63.35,-45.85,;62.87,-44.39,;64.12,-43.48,;65.36,-44.38,;64.89,-45.85,)|

BDBM50571406

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)Cc1nnc[nH]1 |r,wU:23.26,(2.18,-9.73,;3.32,-10.76,;3,-12.27,;1.54,-12.74,;1.22,-14.25,;2.38,-15.28,;3.84,-14.8,;4.99,-15.82,;4.67,-17.33,;4.15,-13.3,;5.61,-12.82,;6.08,-11.35,;7.62,-11.35,;8.1,-12.82,;6.85,-13.72,;6.86,-15.26,;5.62,-16.17,;6.09,-17.63,;7.63,-17.63,;8.11,-16.17,;8.52,-10.11,;7.89,-8.7,;10.05,-10.26,;10.96,-9.02,;10.33,-7.61,;11.23,-6.36,;10.6,-4.96,;11.52,-3.71,;10.89,-2.31,;9.36,-2.14,;8.45,-3.39,;9.08,-4.8,;12.49,-9.18,;13.39,-7.93,;12.89,-6.48,;14.13,-5.57,;15.38,-6.46,;14.91,-7.93,)|

BDBM50571407

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)Cc1nnco1 |r,wU:23.26,(14.59,-11.09,;15.74,-12.12,;15.42,-13.63,;13.96,-14.1,;13.64,-15.61,;14.79,-16.64,;16.25,-16.16,;17.4,-17.19,;17.09,-18.69,;16.56,-14.66,;18.02,-14.18,;18.49,-12.72,;20.03,-12.71,;20.51,-14.18,;19.27,-15.08,;19.27,-16.62,;18.03,-17.53,;18.5,-18.99,;20.04,-18.99,;20.52,-17.53,;20.94,-11.47,;20.31,-10.06,;22.47,-11.63,;23.37,-10.38,;22.74,-8.97,;23.65,-7.72,;23.02,-6.32,;23.93,-5.07,;23.31,-3.67,;21.78,-3.5,;20.87,-4.75,;21.49,-6.16,;24.9,-10.54,;25.8,-9.29,;25.31,-7.84,;26.55,-6.93,;27.79,-7.82,;27.33,-9.29,)|

BDBM50577739

CCCCc1[nH]c(=O)c(C(=O)NCC)c(O)c1-c1c(OC)cccc1OC |(32.08,-11.24,;33.41,-12,;34.74,-11.23,;36.08,-12,;37.41,-11.23,;37.41,-9.68,;38.75,-8.91,;38.75,-7.37,;40.08,-9.68,;41.41,-8.91,;41.42,-7.37,;42.75,-9.69,;44.08,-8.92,;45.41,-9.69,;40.08,-11.22,;41.41,-11.99,;38.75,-11.99,;38.75,-13.52,;40.09,-14.28,;41.42,-13.51,;42.76,-14.27,;40.09,-15.83,;38.76,-16.6,;37.42,-15.83,;37.42,-14.29,;36.09,-13.52,;34.76,-14.29,)|

BDBM50577740

CCCCc1[nH]c(=O)c(C(=O)N(C)C)c(O)c1-c1c(OC)cccc1OC |(50.69,-11.72,;52.02,-12.49,;53.35,-11.71,;54.69,-12.48,;56.02,-11.71,;56.02,-10.16,;57.36,-9.39,;57.36,-7.85,;58.69,-10.17,;60.03,-9.4,;60.03,-7.86,;61.36,-10.17,;62.69,-9.4,;61.36,-11.71,;58.69,-11.7,;60.03,-12.47,;57.36,-12.47,;57.36,-14,;58.7,-14.76,;60.03,-13.99,;61.37,-14.75,;58.71,-16.31,;57.37,-17.09,;56.03,-16.31,;56.04,-14.77,;54.7,-14,;53.37,-14.77,)|

BDBM50577741

CCCCc1[nH]c(=O)c(C(=O)NCc2ccccc2)c(O)c1-c1c(OC)cccc1OC |(66.14,-11.32,;67.48,-12.09,;68.81,-11.32,;70.14,-12.08,;71.48,-11.31,;71.48,-9.77,;72.81,-9,;72.82,-7.46,;74.15,-9.77,;75.48,-9,;75.48,-7.46,;76.81,-9.77,;78.15,-9,;79.48,-9.77,;79.48,-11.31,;80.81,-12.08,;82.14,-11.31,;82.14,-9.76,;80.81,-9,;74.15,-11.3,;75.48,-12.07,;72.81,-12.07,;72.82,-13.6,;74.16,-14.37,;75.49,-13.59,;76.82,-14.36,;74.16,-15.92,;72.82,-16.69,;71.49,-15.92,;71.49,-14.37,;70.16,-13.6,;68.82,-14.37,)|

BDBM50577742

CCCCc1[nH]c(=O)c(C(=O)N(CCC)Cc2ccccc2)c(O)c1-c1c(OC)cccc1OC |(4.34,-34.51,;5.67,-35.28,;7.01,-34.5,;8.34,-35.27,;9.67,-34.5,;9.68,-32.95,;11.01,-32.18,;11.01,-30.64,;12.34,-32.95,;13.68,-32.18,;13.68,-30.64,;15.01,-32.96,;15.01,-34.5,;16.34,-35.27,;16.34,-36.81,;16.35,-32.19,;17.68,-32.96,;17.67,-34.5,;19,-35.27,;20.34,-34.5,;20.34,-32.95,;19,-32.19,;12.34,-34.49,;13.68,-35.26,;11.01,-35.26,;11.02,-36.79,;12.35,-37.55,;13.68,-36.78,;15.02,-37.54,;12.36,-39.1,;11.02,-39.87,;9.69,-39.1,;9.69,-37.56,;8.35,-36.79,;7.02,-37.56,)|

BDBM50577743

CCCCc1[nH]c(=O)c(C(=O)N(C)CCc2ccc(Cl)cc2)c(O)c1-c1c(OC)cccc1OC |(24.44,-33.85,;25.77,-34.62,;27.1,-33.85,;28.44,-34.62,;29.77,-33.84,;29.77,-32.3,;31.11,-31.53,;31.11,-29.99,;32.44,-32.3,;33.78,-31.53,;33.78,-29.99,;35.11,-32.3,;35.11,-33.84,;36.44,-31.53,;37.78,-32.3,;39.11,-31.54,;40.44,-32.31,;41.77,-31.55,;41.77,-30,;43.11,-29.23,;40.43,-29.23,;39.1,-30.01,;32.44,-33.83,;33.78,-34.6,;31.11,-34.61,;31.11,-36.13,;32.45,-36.9,;33.78,-36.12,;35.12,-36.89,;32.46,-38.45,;31.12,-39.22,;29.78,-38.45,;29.79,-36.91,;28.45,-36.14,;27.12,-36.91,)|

BDBM50577744

CCCCc1[nH]c(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1-c1c(OC)cccc1OC |r,wU:14.16,(45.46,-32.95,;46.8,-33.72,;48.13,-32.95,;49.46,-33.71,;50.8,-32.94,;50.8,-31.4,;52.13,-30.63,;52.13,-29.09,;53.46,-31.4,;54.8,-30.63,;54.8,-29.09,;56.13,-31.4,;56.29,-32.92,;57.8,-33.25,;58.57,-31.91,;57.54,-30.77,;60.1,-31.75,;61,-33,;62.53,-32.84,;63.16,-31.44,;62.24,-30.19,;60.72,-30.35,;53.47,-32.93,;54.8,-33.7,;52.13,-33.7,;52.14,-35.23,;53.47,-36,;54.8,-35.22,;56.14,-35.99,;53.48,-37.55,;52.14,-38.32,;50.81,-37.55,;50.81,-36,;49.48,-35.23,;48.14,-36,)|

BDBM50577745

CCCCc1[nH]c(=O)c(C(=O)N2CC[C@H](C2)c2ccccc2)c(O)c1-c1c(OC)cccc1OC |r,wD:14.16,(65.8,-33.08,;67.14,-33.84,;68.47,-33.07,;69.8,-33.84,;71.13,-33.07,;71.14,-31.52,;72.47,-30.75,;72.47,-29.21,;73.8,-31.52,;75.14,-30.75,;75.14,-29.21,;76.47,-31.53,;76.63,-33.05,;78.14,-33.37,;78.91,-32.04,;77.88,-30.89,;80.44,-31.88,;81.34,-33.13,;82.87,-32.97,;83.5,-31.56,;82.58,-30.31,;81.06,-30.48,;73.81,-33.06,;75.14,-33.83,;72.47,-33.83,;72.48,-35.36,;73.81,-36.12,;75.14,-35.35,;76.48,-36.11,;73.82,-37.67,;72.48,-38.44,;71.15,-37.67,;71.15,-36.13,;69.82,-35.36,;68.48,-36.13,)|

BDBM50577746

CCCCc1nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)n1-c1c(OC)cccc1OC |r,wU:14.16,(5.13,-48.76,;6.47,-49.53,;7.8,-48.76,;9.14,-49.53,;10.49,-48.76,;10.48,-47.22,;11.81,-46.46,;11.81,-44.9,;13.13,-47.22,;14.47,-46.44,;14.47,-44.9,;15.8,-47.21,;15.96,-48.74,;17.47,-49.06,;18.24,-47.72,;17.21,-46.58,;19.77,-47.56,;20.67,-48.81,;22.2,-48.66,;22.83,-47.25,;21.92,-46,;20.39,-46.16,;13.14,-48.74,;14.47,-49.51,;11.81,-49.51,;11.81,-51.04,;13.15,-51.81,;14.48,-51.03,;15.81,-51.8,;13.15,-53.36,;11.81,-54.13,;10.48,-53.36,;10.48,-51.82,;9.15,-51.05,;7.81,-51.82,)|

BDBM50577747

CCCCc1nc(=O)c(C(=O)N2CC[C@H](C2)c2ccccc2)c(O)n1-c1c(OC)cccc1OC |r,wD:14.16,(25.17,-48.11,;26.5,-48.88,;27.83,-48.11,;29.17,-48.87,;30.52,-48.11,;30.52,-46.57,;31.84,-45.8,;31.84,-44.24,;33.17,-46.57,;34.51,-45.79,;34.51,-44.25,;35.84,-46.56,;36,-48.08,;37.51,-48.4,;38.28,-47.07,;37.25,-45.92,;39.81,-46.91,;40.71,-48.16,;42.24,-48,;42.86,-46.59,;41.95,-45.34,;40.42,-45.51,;33.17,-48.09,;34.51,-48.86,;31.85,-48.85,;31.85,-50.39,;33.18,-51.15,;34.51,-50.38,;35.85,-51.14,;33.19,-52.7,;31.85,-53.48,;30.51,-52.71,;30.52,-51.16,;29.18,-50.39,;27.85,-51.16,)|

BDBM50577748

CCOCc1nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)n1-c1c(OC)cccc1OC |r,wU:14.16,(46,-48.12,;47.33,-48.89,;48.66,-48.11,;50,-48.88,;51.35,-48.11,;51.35,-46.58,;52.67,-45.81,;52.67,-44.25,;54,-46.58,;55.34,-45.8,;55.34,-44.26,;56.67,-46.57,;56.83,-48.09,;58.34,-48.41,;59.11,-47.08,;58.08,-45.93,;60.64,-46.92,;61.54,-48.17,;63.07,-48.01,;63.7,-46.6,;62.78,-45.35,;61.25,-45.52,;54,-48.1,;55.34,-48.87,;52.68,-48.86,;52.68,-50.4,;54.01,-51.16,;55.34,-50.39,;56.68,-51.15,;54.02,-52.71,;52.68,-53.49,;51.34,-52.71,;51.35,-51.17,;50.01,-50.4,;48.68,-51.17,)|

BDBM50577749

CCCCc1nc(=O)c(C(=O)N2CCC(C2)c2ccc(Cl)cc2)c(O)n1-c1c(OC)cccc1OC |(66.4,-48.76,;67.73,-49.53,;69.07,-48.76,;70.4,-49.53,;71.75,-48.76,;71.75,-47.22,;73.07,-46.46,;73.07,-44.9,;74.4,-47.22,;75.74,-46.44,;75.74,-44.9,;77.07,-47.21,;77.23,-48.74,;78.74,-49.06,;79.51,-47.72,;78.48,-46.58,;81.04,-47.56,;81.94,-48.81,;83.47,-48.66,;84.1,-47.25,;85.63,-47.09,;83.18,-46,;81.66,-46.16,;74.4,-48.74,;75.74,-49.51,;73.08,-49.51,;73.08,-51.04,;74.41,-51.81,;75.74,-51.03,;77.08,-51.8,;74.42,-53.36,;73.08,-54.13,;71.74,-53.36,;71.75,-51.82,;70.41,-51.05,;69.08,-51.82,)|

BDBM50577750

CCCCc1nc(=O)c(C(=O)N2CCC(C2)c2ccccn2)c(O)n1-c1c(OC)cccc1OC |(24.48,-6.08,;25.82,-6.85,;27.15,-6.07,;28.49,-6.84,;29.84,-6.07,;29.84,-4.54,;31.16,-3.77,;31.16,-2.21,;32.48,-4.54,;33.82,-3.76,;33.82,-2.22,;35.16,-4.53,;35.32,-6.05,;36.82,-6.37,;37.59,-5.04,;36.56,-3.89,;39.12,-4.88,;40.02,-6.13,;41.55,-5.97,;42.18,-4.56,;41.27,-3.31,;39.74,-3.48,;32.49,-6.06,;33.82,-6.83,;31.16,-6.82,;31.16,-8.36,;32.5,-9.12,;33.83,-8.35,;35.16,-9.11,;32.5,-10.67,;31.16,-11.45,;29.83,-10.68,;29.83,-9.13,;28.5,-8.36,;27.17,-9.13,)|

BDBM50577751

CCCCc1nc(=O)c(C(=O)N2CCC(C2)c2cccnc2)c(O)n1-c1c(OC)cccc1OC |(64.87,-8.89,;66.21,-9.66,;67.54,-8.88,;68.88,-9.65,;70.23,-8.88,;70.22,-7.35,;71.55,-6.58,;71.55,-5.02,;72.87,-7.34,;74.21,-6.56,;74.21,-5.02,;75.54,-7.34,;75.7,-8.86,;77.21,-9.18,;77.98,-7.85,;76.95,-6.7,;79.51,-7.69,;80.41,-8.94,;81.94,-8.78,;82.57,-7.37,;81.66,-6.12,;80.13,-6.29,;72.88,-8.87,;74.21,-9.64,;71.55,-9.63,;71.55,-11.17,;72.89,-11.93,;74.22,-11.16,;75.55,-11.92,;72.89,-13.48,;71.55,-14.25,;70.22,-13.48,;70.22,-11.94,;68.89,-11.17,;67.55,-11.94,)|

BDBM50577752

CCCCc1nc(=O)c(C(=O)N2CCC(C2)c2ccncc2)c(O)n1-c1c(OC)cccc1OC |(23.15,-20.44,;24.49,-21.21,;25.82,-20.43,;27.16,-21.2,;28.51,-20.43,;28.51,-18.9,;29.83,-18.13,;29.83,-16.57,;31.16,-18.89,;32.49,-18.12,;32.49,-16.58,;33.83,-18.89,;33.99,-20.41,;35.49,-20.73,;36.26,-19.4,;35.23,-18.25,;37.8,-19.24,;38.69,-20.49,;40.22,-20.33,;40.85,-18.92,;39.94,-17.67,;38.41,-17.84,;31.16,-20.42,;32.49,-21.19,;29.83,-21.18,;29.83,-22.72,;31.17,-23.48,;32.5,-22.71,;33.83,-23.47,;31.17,-25.03,;29.84,-25.8,;28.5,-25.03,;28.5,-23.49,;27.17,-22.72,;25.84,-23.49,)|

BDBM50577753

CCCCc1nc(=O)c(C(=O)N2CC[C@H](C2)c2ccc(Cl)cn2)c(O)n1-c1c(OC)cccc1OC |r,wD:14.16,(65.16,-22.29,;66.5,-23.06,;67.83,-22.28,;69.16,-23.05,;70.51,-22.28,;70.51,-20.75,;71.84,-19.98,;71.83,-18.42,;73.16,-20.75,;74.5,-19.97,;74.5,-18.43,;75.83,-20.74,;75.99,-22.26,;77.5,-22.58,;78.27,-21.25,;77.24,-20.1,;79.8,-21.09,;80.7,-22.34,;82.23,-22.18,;82.86,-20.77,;84.39,-20.61,;81.94,-19.52,;80.42,-19.69,;73.17,-22.27,;74.5,-23.04,;71.84,-23.03,;71.84,-24.57,;73.17,-25.33,;74.5,-24.56,;75.84,-25.32,;73.18,-26.88,;71.84,-27.65,;70.51,-26.88,;70.51,-25.34,;69.18,-24.57,;67.84,-25.34,)|

BDBM50577754

CCCCc1nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccc(Cl)cn2)c(O)n1-c1c(OC)cccc1OC |r,wU:14.16,(2.45,-36.58,;3.78,-37.34,;5.12,-36.57,;6.45,-37.34,;7.8,-36.57,;7.8,-35.04,;9.13,-34.27,;9.12,-32.71,;10.45,-35.03,;11.79,-34.25,;11.79,-32.71,;13.12,-35.02,;13.28,-36.55,;14.79,-36.87,;15.56,-35.54,;14.53,-34.39,;17.09,-35.38,;17.99,-36.63,;19.52,-36.47,;20.15,-35.06,;21.68,-34.9,;19.23,-33.81,;17.71,-33.97,;10.45,-36.56,;11.79,-37.32,;9.13,-37.32,;9.13,-38.86,;10.46,-39.62,;11.79,-38.85,;13.13,-39.61,;10.47,-41.17,;9.13,-41.94,;7.8,-41.17,;7.8,-39.63,;6.46,-38.86,;5.13,-39.63,)|

BDBM50577755

CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(C)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(56.32,-36.8,;57.65,-37.57,;58.99,-36.8,;60.32,-37.56,;61.65,-36.79,;61.65,-35.25,;62.99,-34.48,;62.99,-32.94,;64.32,-35.25,;65.66,-34.48,;67.06,-35.1,;68.09,-33.96,;67.32,-32.63,;67.95,-31.22,;69.48,-31.06,;70.1,-29.66,;71.62,-29.49,;72.54,-30.74,;74.07,-30.58,;71.91,-32.15,;70.38,-32.31,;65.81,-32.95,;64.32,-36.78,;65.66,-37.55,;62.99,-37.55,;63,-39.08,;64.33,-39.85,;65.66,-39.07,;67,-39.84,;64.34,-41.4,;63,-42.17,;61.66,-41.4,;61.67,-39.85,;60.33,-39.08,;59,-39.85,)|

BDBM50583256

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50583257

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50583258

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1Cc2cncn2C\C=C\C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,t:38|

BDBM50583259

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCN(C\C=C\C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)S(=O)(=O)c1ccccc1[N+]([O-])=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,t:34|

BDBM50583260

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCNC\C=C\C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,t:34|

BDBM50583261

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCN(C)C\C=C\C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,t:35|

BDBM50583262

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:31|

BDBM50583263

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/C[C@H](NC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:31|

BDBM50583264

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCN(C\C=C\C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)S(=O)(=O)c1ccccc1[N+]([O-])=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,t:34|

BDBM50583265

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(O)=O |r,c:31|

BDBM50583266

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1cccc2ccccc12)C(O)=O |r,c:22|

BDBM50583267

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc2ccccc2c1)C(O)=O |r,c:22|

BDBM50583268

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r,c:22|

BDBM50583269

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](Cc1ccc(O)cc1)C(O)=O |r,c:22|

BDBM50583270

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CC(=O)NC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50583271

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50583272

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC=C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50583273

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/C[C@H](NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:31|

BDBM50583274

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/CCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:31|

BDBM50583275

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1C\C=C/C[C@H](N)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:31|

BDBM50583276

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1Cc2cncn2C\C=C\C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,t:38|

BDBM50583277

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(O)=O |r,c:22|

BDBM50583278

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1C\C=C/C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(O)=O |r,c:22|

BDBM50583279

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCCCNC(=O)[C@@H]1C\C=C/C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(O)=O |r,c:25|

BDBM50583280

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(O)=O |r,c:22|

BDBM50583281

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cccc2ccccc12)C(O)=O |r,c:22|

BDBM50583282

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(O)=O |r,c:22|

BDBM50583283

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r,c:22|

BDBM50583284

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(c1)C1CCCC1)C(O)=O |r,c:22|

BDBM50583285

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cc(C2CCCC2)c(OCc2ccccc2)c(c1)C1CCCC1)C(O)=O |r,c:22|

BDBM50583286

CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)C\C=C/C[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OC2CCCC2)c(c1)C1CCCC1)C(O)=O |r,c:22|

BDBM50583287

CCCOc1ccc(C[C@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]2C\C=C/C[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N2)C(O)=O)cc1C1CCCC1 |r,c:36|

BDBM50588316

CCc1cccc(CC)c1-n1c(O)c(C(=O)N2CC[C@H](C2)c2ncc(Cl)cc2F)c(=O)nc1-c1ccn(C)n1 |r,wD:19.22,(52.86,-13.07,;51.52,-12.3,;50.19,-13.08,;50.2,-14.63,;48.85,-15.4,;47.52,-14.63,;47.52,-13.08,;46.19,-12.31,;44.85,-13.08,;48.85,-12.31,;48.78,-9.76,;50.12,-9,;51.45,-9.76,;50.11,-7.46,;51.44,-6.68,;51.44,-5.14,;52.78,-7.45,;52.94,-8.98,;54.45,-9.29,;55.22,-7.96,;54.18,-6.81,;56.75,-7.79,;57.36,-6.38,;58.88,-6.21,;59.8,-7.46,;61.34,-7.3,;59.18,-8.87,;57.65,-9.04,;57.03,-10.45,;48.77,-6.69,;48.76,-5.15,;47.44,-7.47,;47.45,-9.01,;46.12,-9.79,;44.71,-9.16,;43.69,-10.32,;44.47,-11.65,;43.86,-13.06,;45.98,-11.32,)|

BDBM50588317

COc1cccc(OC)c1-n1c(COC2CC2)nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c1O |r,wU:26.30,(81.03,-31.85,;79.69,-31.08,;78.36,-31.86,;78.37,-33.41,;77.03,-34.18,;75.7,-33.41,;75.7,-31.86,;74.36,-31.1,;73.03,-31.87,;77.03,-31.09,;77.02,-29.55,;75.68,-28.8,;74.36,-29.58,;73.02,-28.82,;71.69,-29.6,;70.15,-29.62,;70.93,-30.95,;75.67,-27.26,;77.01,-26.48,;77,-24.94,;78.35,-27.25,;79.67,-26.47,;79.67,-24.93,;81.01,-27.24,;81.19,-28.76,;82.69,-29.07,;83.46,-27.73,;82.42,-26.59,;84.99,-27.57,;85.89,-28.81,;87.42,-28.64,;88.04,-27.23,;87.12,-25.99,;85.6,-26.16,;78.35,-28.79,;79.69,-29.56,)|

BDBM50588318

COc1cccc(OC)c1-n1c(COC2CCC2)nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c1O |r,wU:27.31,(12.48,-49.41,;11.15,-48.65,;9.82,-49.42,;9.82,-50.97,;8.48,-51.74,;7.15,-50.97,;7.15,-49.43,;5.82,-48.66,;4.49,-49.43,;8.48,-48.66,;8.48,-47.12,;7.14,-46.36,;5.81,-47.14,;4.47,-46.38,;3.15,-47.16,;1.66,-46.78,;1.28,-48.27,;2.77,-48.66,;7.13,-44.83,;8.47,-44.04,;8.46,-42.5,;9.8,-44.81,;11.13,-44.04,;11.12,-42.5,;12.47,-44.8,;12.64,-46.32,;14.15,-46.63,;14.91,-45.3,;13.88,-44.16,;16.44,-45.13,;17.35,-46.37,;18.88,-46.21,;19.5,-44.8,;18.58,-43.55,;17.05,-43.72,;9.81,-46.35,;11.14,-47.12,)|

BDBM50588319

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(=O)nc1CCCC(F)(F)F |r,wU:19.22,(33.2,-48.85,;31.86,-48.09,;30.53,-48.86,;30.53,-50.41,;29.2,-51.18,;27.86,-50.41,;27.86,-48.87,;26.53,-48.1,;25.2,-48.87,;29.19,-48.1,;29.19,-46.56,;30.52,-45.79,;31.85,-46.56,;30.51,-44.25,;31.84,-43.48,;31.83,-41.94,;33.18,-44.24,;33.35,-45.76,;34.86,-46.07,;35.63,-44.74,;34.59,-43.6,;37.16,-44.57,;38.06,-45.81,;39.59,-45.65,;40.21,-44.24,;39.29,-42.99,;37.77,-43.16,;29.18,-43.48,;29.17,-41.94,;27.84,-44.27,;27.85,-45.8,;26.52,-46.58,;25.18,-45.82,;23.86,-46.6,;22.52,-45.84,;21.19,-46.63,;22.5,-44.3,;21.18,-45.07,)|

BDBM50588320

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(=O)nc1C1CCCC1 |r,wU:19.22,(53.52,-49.65,;52.18,-48.89,;50.85,-49.66,;50.86,-51.21,;49.52,-51.98,;48.19,-51.21,;48.19,-49.67,;46.85,-48.9,;45.52,-49.67,;49.52,-48.9,;49.54,-46.32,;50.86,-45.55,;52.2,-46.32,;50.86,-44.01,;52.19,-43.23,;52.18,-41.69,;53.53,-44,;53.7,-45.52,;55.21,-45.83,;55.97,-44.5,;54.94,-43.36,;57.5,-44.33,;58.41,-45.57,;59.94,-45.41,;60.56,-43.99,;59.64,-42.75,;58.11,-42.92,;49.52,-43.24,;49.52,-41.7,;48.19,-44.02,;48.2,-45.56,;46.87,-46.34,;45.46,-45.73,;44.44,-46.88,;45.22,-48.21,;46.72,-47.88,)|

BDBM50588321

CCOCc1nc(=O)c(C(=O)N2CC[C@@H](C2)c2ccccc2F)c(O)n1-c1c(OC)cccc1OC |r,wU:14.16,(62.67,-45.68,;64.01,-46.44,;65.33,-45.66,;66.67,-46.42,;68,-45.64,;67.99,-44.1,;69.32,-43.32,;69.32,-41.78,;70.66,-44.09,;71.99,-43.31,;71.98,-41.77,;73.33,-44.08,;73.5,-45.6,;75.01,-45.91,;75.77,-44.57,;74.74,-43.43,;77.3,-44.4,;77.91,-43,;79.44,-42.83,;80.36,-44.07,;79.74,-45.48,;78.21,-45.65,;77.59,-47.06,;70.67,-45.63,;72,-46.39,;69.34,-46.39,;69.34,-47.93,;70.68,-48.7,;72.01,-47.92,;73.34,-48.69,;70.68,-50.25,;69.34,-51.02,;68.01,-50.25,;68.01,-48.7,;66.68,-47.93,;65.35,-48.7,)|

BDBM50588322

CCOCc1nc(=O)c(C(=O)N2CCC(C2)c2ccc(F)cc2F)c(O)n1-c1c(OC)cccc1OC |(.98,-6.01,;2.32,-6.77,;3.65,-5.99,;4.99,-6.74,;6.32,-5.96,;6.3,-4.43,;7.64,-3.65,;7.63,-2.11,;8.98,-4.41,;10.31,-3.64,;10.3,-2.1,;11.64,-4.4,;11.82,-5.92,;13.33,-6.24,;14.09,-4.9,;13.05,-3.76,;15.62,-4.73,;16.23,-3.33,;17.76,-3.15,;18.68,-4.4,;20.21,-4.23,;18.05,-5.81,;16.53,-5.98,;15.9,-7.38,;8.98,-5.95,;10.32,-6.72,;7.65,-6.72,;7.66,-8.26,;8.99,-9.02,;10.32,-8.25,;11.66,-9.01,;9,-10.57,;7.66,-11.34,;6.33,-10.57,;6.33,-9.03,;4.99,-8.26,;3.66,-9.03,)|

BDBM50588323

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2F)c(=O)nc1-c1ccc(F)cc1 |r,wU:19.22,(32.93,-10.22,;31.6,-9.45,;30.26,-10.23,;30.27,-11.78,;28.93,-12.55,;27.6,-11.78,;27.6,-10.24,;26.27,-9.47,;24.93,-10.24,;28.93,-9.46,;28.95,-6.88,;30.28,-6.12,;31.61,-6.88,;30.27,-4.58,;31.6,-3.8,;31.59,-2.26,;32.94,-4.56,;33.11,-6.09,;34.62,-6.4,;35.38,-5.06,;34.35,-3.92,;36.92,-4.89,;37.52,-3.49,;39.05,-3.32,;39.97,-4.56,;39.35,-5.97,;37.82,-6.14,;37.2,-7.55,;28.94,-3.81,;28.93,-2.27,;27.6,-4.59,;27.61,-6.13,;26.28,-6.91,;24.95,-6.14,;23.62,-6.92,;23.63,-8.46,;22.31,-9.25,;24.98,-9.22,;26.3,-8.44,)|

BDBM50588324

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CCC(C2)c2ccc(F)cc2F)c(=O)nc1-c1ccc(C)nc1 |(53.57,-10.74,;52.24,-9.97,;50.91,-10.75,;50.91,-12.3,;49.57,-13.07,;48.24,-12.3,;48.24,-10.76,;46.91,-9.99,;45.58,-10.76,;49.57,-9.99,;49.59,-7.4,;50.92,-6.64,;52.25,-7.4,;50.92,-5.1,;52.24,-4.32,;52.24,-2.78,;53.58,-5.09,;53.76,-6.61,;55.26,-6.92,;56.03,-5.58,;54.99,-4.44,;57.56,-5.41,;58.17,-4.01,;59.69,-3.84,;60.61,-5.08,;62.14,-4.91,;59.99,-6.49,;58.46,-6.66,;57.84,-8.07,;49.58,-4.33,;49.57,-2.79,;48.24,-5.11,;48.25,-6.65,;46.93,-7.43,;46.94,-8.96,;45.62,-9.74,;44.27,-8.98,;42.95,-9.77,;44.26,-7.44,;45.59,-6.66,)|

BDBM50588325

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CCC(C2)c2ccc(F)cc2F)c(=O)nc1-c1ccc(C)cn1 |(77.13,-11.09,;75.79,-10.32,;74.46,-11.1,;74.47,-12.65,;73.13,-13.42,;71.8,-12.65,;71.8,-11.11,;70.46,-10.34,;69.13,-11.11,;73.13,-10.34,;73.15,-7.75,;74.48,-6.99,;75.81,-7.75,;74.47,-5.45,;75.8,-4.67,;75.79,-3.13,;77.14,-5.44,;77.31,-6.96,;78.82,-7.27,;79.58,-5.93,;78.55,-4.79,;81.11,-5.76,;81.72,-4.36,;83.25,-4.19,;84.17,-5.43,;85.7,-5.26,;83.55,-6.84,;82.02,-7.01,;81.4,-8.42,;73.13,-4.68,;73.13,-3.14,;71.8,-5.46,;71.81,-7,;70.48,-7.78,;70.5,-9.31,;69.18,-10.09,;67.83,-9.33,;66.5,-10.12,;67.82,-7.79,;69.15,-7.01,)|

BDBM50588326

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CCC(C2)c2ccc(F)cc2F)c(=O)nc1-c1csc(C)n1 |(11.18,-24.55,;9.84,-23.79,;8.51,-24.56,;8.52,-26.11,;7.18,-26.88,;5.84,-26.11,;5.85,-24.57,;4.51,-23.8,;3.18,-24.57,;7.17,-23.8,;7.19,-21.22,;8.52,-20.45,;9.86,-21.22,;8.52,-18.91,;9.85,-18.14,;9.84,-16.6,;11.18,-18.9,;11.36,-20.42,;12.87,-20.73,;13.63,-19.4,;12.59,-18.26,;15.16,-19.23,;15.77,-17.82,;17.3,-17.65,;18.22,-18.9,;19.75,-18.72,;17.6,-20.31,;16.07,-20.47,;15.44,-21.88,;7.18,-18.14,;7.18,-16.6,;5.85,-18.93,;5.86,-20.46,;4.53,-21.24,;4.37,-22.77,;2.87,-23.11,;2.09,-21.78,;.56,-21.63,;3.11,-20.63,)|

BDBM50588327

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CCC(C2)c2ccc(F)cc2F)c(=O)nc1-c1cnn(C)c1 |(31.71,-25.37,;30.37,-24.6,;29.04,-25.38,;29.05,-26.93,;27.71,-27.7,;26.38,-26.93,;26.38,-25.39,;25.05,-24.62,;23.71,-25.39,;27.71,-24.62,;27.73,-22.03,;29.06,-21.27,;30.39,-22.03,;29.05,-19.73,;30.38,-18.95,;30.37,-17.41,;31.72,-19.72,;31.89,-21.24,;33.4,-21.55,;34.16,-20.21,;33.13,-19.07,;35.69,-20.04,;36.3,-18.64,;37.83,-18.47,;38.75,-19.71,;40.28,-19.54,;38.13,-21.12,;36.6,-21.29,;35.98,-22.7,;27.71,-18.96,;27.71,-17.42,;26.38,-19.74,;26.39,-21.28,;25.06,-22.06,;24.91,-23.59,;23.4,-23.92,;22.62,-22.6,;21.09,-22.45,;23.64,-21.44,)|

BDBM50588328

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CCC(C2)c2ccc(F)cc2F)c(=O)nc1-c1ccn(C)n1 |(52.2,-24.92,;50.86,-24.15,;49.53,-24.93,;49.53,-26.48,;48.2,-27.25,;46.86,-26.48,;46.86,-24.93,;45.53,-24.16,;44.2,-24.94,;48.19,-24.16,;48.21,-21.58,;49.54,-20.81,;50.88,-21.58,;49.54,-19.28,;50.86,-18.5,;50.86,-16.96,;52.2,-19.26,;52.38,-20.79,;53.89,-21.1,;54.65,-19.76,;53.61,-18.62,;56.18,-19.59,;56.79,-18.19,;58.32,-18.02,;59.24,-19.26,;60.77,-19.09,;58.61,-20.67,;57.09,-20.84,;56.46,-22.25,;48.2,-18.51,;48.19,-16.97,;46.86,-19.29,;46.88,-20.83,;45.55,-21.61,;45.39,-23.14,;43.89,-23.47,;43.11,-22.14,;41.58,-22,;44.13,-20.99,)|

BDBM50588329

COc1cccc(OC)c1-n1c(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2F)c(=O)nc1-c1ccn(C)n1 |r,wU:19.22,(75.12,-26.02,;73.78,-25.25,;72.45,-26.03,;72.46,-27.58,;71.12,-28.35,;69.78,-27.58,;69.79,-26.03,;68.45,-25.26,;67.12,-26.03,;71.12,-25.26,;71.13,-22.68,;72.46,-21.91,;73.8,-22.68,;72.46,-20.37,;73.79,-19.6,;73.78,-18.06,;75.12,-20.36,;75.3,-21.88,;76.81,-22.2,;77.57,-20.86,;76.54,-19.72,;79.1,-20.69,;79.71,-19.29,;81.24,-19.11,;82.16,-20.36,;81.54,-21.77,;80.01,-21.94,;79.38,-23.34,;71.12,-19.61,;71.12,-18.07,;69.79,-20.39,;69.8,-21.92,;68.47,-22.7,;68.32,-24.24,;66.81,-24.57,;66.03,-23.24,;64.5,-23.09,;67.05,-22.09,)|

BDBM50588330

CCc1cccc(CC)c1-n1c(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2F)c(=O)nc1-c1ccn(C)n1 |r,wU:19.22,(13.35,-41.59,;12.01,-40.83,;10.68,-41.6,;10.69,-43.15,;9.35,-43.93,;8.01,-43.15,;8.02,-41.61,;6.68,-40.84,;5.35,-41.61,;9.34,-40.84,;9.36,-38.26,;10.69,-37.49,;12.03,-38.26,;10.69,-35.95,;12.02,-35.18,;12.01,-33.64,;13.35,-35.94,;13.53,-37.46,;15.04,-37.77,;15.8,-36.44,;14.76,-35.3,;17.33,-36.27,;17.94,-34.87,;19.47,-34.69,;20.39,-35.94,;19.77,-37.35,;18.24,-37.52,;17.61,-38.92,;9.35,-35.18,;9.35,-33.64,;8.02,-35.97,;8.03,-37.5,;6.7,-38.28,;6.54,-39.82,;5.04,-40.15,;4.26,-38.82,;2.73,-38.67,;5.28,-37.67,)|

BDBM50588331

CCc1cccc(CC)c1-n1c(O)c(C(=O)N2CCC(C2)c2c(F)cccc2F)c(=O)nc1-c1ccn(C)n1 |(35.11,-41.13,;33.77,-40.37,;32.44,-41.14,;32.45,-42.7,;31.11,-43.47,;29.78,-42.7,;29.78,-41.15,;28.44,-40.38,;27.11,-41.15,;31.11,-40.38,;31.13,-37.8,;32.45,-37.03,;33.79,-37.8,;32.45,-35.49,;33.78,-34.72,;33.77,-33.18,;35.12,-35.48,;35.29,-37,;36.8,-37.32,;37.56,-35.98,;36.53,-34.84,;39.09,-35.81,;40,-37.06,;39.38,-38.46,;41.53,-36.89,;42.15,-35.48,;41.23,-34.23,;39.7,-34.41,;38.79,-33.17,;31.11,-34.73,;31.11,-33.19,;29.78,-35.51,;29.79,-37.04,;28.46,-37.82,;28.31,-39.36,;26.8,-39.69,;26.02,-38.36,;24.49,-38.21,;27.04,-37.21,)|

BDBM50588332

CCc1cccc(CC)c1-n1c(O)c(C(=O)N2CCC(C2)c2ncccc2F)c(=O)nc1-c1ccn(C)n1 |(57.1,-39.85,;55.76,-39.09,;54.43,-39.86,;54.44,-41.41,;53.1,-42.18,;51.76,-41.41,;51.77,-39.87,;50.43,-39.1,;49.1,-39.87,;53.09,-39.1,;53.11,-36.52,;54.44,-35.75,;55.78,-36.52,;54.44,-34.21,;55.77,-33.43,;55.76,-31.89,;57.1,-34.2,;57.28,-35.72,;58.79,-36.03,;59.55,-34.7,;58.51,-33.56,;61.08,-34.53,;61.99,-35.77,;63.52,-35.61,;64.14,-34.19,;63.22,-32.95,;61.69,-33.12,;60.77,-31.89,;53.1,-33.44,;53.09,-31.9,;51.77,-34.22,;51.78,-35.76,;50.45,-36.54,;50.29,-38.07,;48.79,-38.41,;48.01,-37.08,;46.48,-36.93,;49.03,-35.93,)|

BDBM50588333

CCc1cccc(CC)c1-n1c(O)c(C(=O)N2CC[C@H](C2)c2ncc(F)cc2F)c(=O)nc1-c1ccn(C)n1 |r,wD:19.22,(77.45,-40.32,;76.11,-39.55,;74.78,-40.33,;74.79,-41.88,;73.45,-42.65,;72.12,-41.88,;72.12,-40.34,;70.79,-39.57,;69.45,-40.34,;73.45,-39.56,;73.47,-36.98,;74.8,-36.21,;76.13,-36.98,;74.79,-34.68,;76.12,-33.9,;76.11,-32.36,;77.46,-34.66,;77.63,-36.19,;79.14,-36.5,;79.9,-35.16,;78.87,-34.02,;81.44,-34.99,;82.34,-36.24,;83.87,-36.07,;84.49,-34.66,;86.02,-34.49,;83.57,-33.42,;82.04,-33.59,;81.13,-32.35,;73.46,-33.91,;73.45,-32.37,;72.12,-34.69,;72.13,-36.23,;70.8,-37.01,;70.65,-38.54,;69.14,-38.87,;68.36,-37.54,;66.83,-37.4,;69.39,-36.39,)|

BDBM50589276

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N(C)c1ccccc1 |r|

BDBM50589277

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N(C)c1ccccc1OC |r|

BDBM50589278

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N(C)c1cccc(OC)c1 |r|

BDBM50589279

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N(C)c1ccc(OC)cc1 |r|

BDBM50589280

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N(CC)c1ccccc1 |r|

BDBM50589281

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N(C(C)C)c1ccccc1 |r|

BDBM50589282

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N1CCCc2ccccc12 |r|

BDBM50589283

CCCCc1nc(O)c(C(=O)N2CC[C@@H](C2)c2ccccc2)c(O)c1N1CCc2ccccc12 |r|

BDBM50589284

CCCCc1nc(O)c(C(=O)N2CC[C@H](C2)c2ccccc2)c(O)c1N(CC)c1ccccc1 |r|

BDBM50589285

CCCCc1nc(O)c(C(=O)N2CCN(Cc3cccc(Cl)c3Cl)CC2)c(O)c1N(CC)c1ccccc1

BDBM50589286

CCCCc1nc(O)c(C(=O)N2CCC(C2)c2ccccc2F)c(O)c1N(CC)c1ccccc1

BDBM50589287

CCCCc1nc(O)c(C(=O)N2CCC(C2)c2ccc(Cl)cn2)c(O)c1N(CC)c1ccccc1

BDBM50589288

CCCCc1nc(O)c(C(=O)N2CCC(C2)c2ncc(Cl)cc2F)c(O)c1N(CC)c1ccccc1

BDBM50589289

CCCCc1nc(O)c(C(=O)N2CCC(C2)c2ncc(F)cc2F)c(O)c1N(CC)c1ccccc1

BDBM50589290

CCN(c1ccccc1)c1c(CC2CC2)nc(O)c(C(=O)N2CCC(C2)c2ncc(F)cc2F)c1O

BDBM50589291

CCN(c1ccccc1)c1c(O)c(C(=O)N2CCC(C2)c2ncc(F)cc2F)c(O)nc1-c1cccc(C)c1

BDBM50589292

CCN(c1ccccc1)c1c(O)c(C(=O)N2CCC(C2)c2ncc(F)cc2F)c(O)nc1-c1ccn(C)n1

BDBM50600613

COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r,wU:23.26,(57.22,-33.55,;58.36,-34.58,;58.04,-36.08,;56.58,-36.56,;56.26,-38.07,;57.42,-39.1,;58.87,-38.62,;60.02,-39.64,;59.71,-41.15,;59.19,-37.11,;60.64,-36.64,;61.12,-35.17,;62.66,-35.17,;63.13,-36.63,;61.89,-37.54,;61.9,-39.08,;60.66,-39.99,;61.13,-41.45,;62.67,-41.45,;63.15,-39.99,;63.56,-33.92,;62.93,-32.52,;65.09,-34.08,;65.99,-32.83,;65.37,-31.43,;66.27,-30.18,;65.64,-28.77,;66.55,-27.52,;65.93,-26.12,;64.4,-25.96,;63.49,-27.2,;64.12,-28.62,;67.53,-32.99,;68.43,-31.74,;67.8,-30.34,;69.96,-31.9,;70.87,-30.66,;72.38,-30.41,;72.14,-28.89,;70.62,-29.14,)|

BDBM50600614

COc1cccc(F)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r,wU:22.25,(-6.64,.33,;-5.55,-.76,;-5.94,-2.25,;-7.43,-2.65,;-7.82,-4.13,;-6.73,-5.22,;-5.25,-4.83,;-4.16,-5.92,;-4.85,-3.34,;-3.36,-2.94,;-2.9,-1.48,;-1.36,-1.48,;-.9,-2.98,;-2.12,-3.86,;-2.12,-5.4,;-.78,-6.17,;-1.13,-7.7,;-2.63,-7.85,;-3.25,-6.44,;-.59,-.15,;-1.36,1.19,;.95,-.15,;1.72,1.19,;.95,2.52,;1.72,3.85,;.95,5.19,;1.72,6.52,;.95,7.85,;-.59,7.85,;-1.36,6.52,;-.59,5.19,;3.26,1.19,;4.03,2.52,;3.26,3.85,;5.57,2.52,;6.34,3.85,;7.82,4.25,;7.42,5.77,;5.93,5.37,)|

BDBM50600615

CCc1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600616

CC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600617

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2ccccc2C2CC2)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600618

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600619

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCOCC1)CC(=O)NC1CCC1 |r|

BDBM50600620

FC(F)(F)[C@@H]1CCCCN1CC[C@@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1 |r|

BDBM50600621

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCC(F)(F)C1)CC(=O)NC1CCC1 |r|

BDBM50600622

CN(CC[C@@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1)C1CCCCC1 |r|

BDBM50600623

CC(C)CN(C)CC[C@@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1 |r|

BDBM50600624

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CN1CC(F)(F)C1)CC(=O)NC1CCC1 |r|

BDBM50600625

Fc1ccc(CC[C@@H](CC(=O)NC2CCC2)NC(=O)c2cc(-c3ccccc3C(F)(F)F)n(n2)C2CCCC2)cc1 |r|

BDBM50600626

Cc1cnn(CC[C@@H](CC(=O)NC2CCC2)NC(=O)c2cc(-c3ccccc3C(F)(F)F)n(n2)C2CCCC2)c1 |r|

BDBM50600627

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCC(F)(F)C1)CC(=O)Nc1nnn[nH]1 |r|

BDBM50600628

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2ccccc2)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600629

FC(F)(F)COc1cccc(OCC(F)(F)F)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r,wU:31.34,(-6.45,-8.57,;-6.05,-7.09,;-7.14,-6,;-7.54,-7.48,;-4.56,-6.69,;-4.16,-5.2,;-5.25,-4.11,;-6.73,-4.51,;-7.82,-3.42,;-7.43,-1.94,;-5.95,-1.53,;-5.55,-.04,;-6.64,1.05,;-6.24,2.53,;-7.33,3.62,;-4.75,2.93,;-5.84,4.02,;-4.85,-2.62,;-3.36,-2.22,;-2.91,-.76,;-1.36,-.76,;-.9,-2.26,;-2.12,-3.14,;-2.12,-4.68,;-.78,-5.45,;-1.13,-6.99,;-2.63,-7.14,;-3.25,-5.72,;-.59,.57,;-1.36,1.9,;.95,.57,;1.72,1.9,;.95,3.24,;1.72,4.57,;.95,5.91,;1.72,7.24,;.95,8.57,;-.59,8.57,;-1.36,7.24,;-.59,5.91,;3.26,1.9,;4.03,3.24,;3.26,4.57,;5.57,3.24,;6.34,4.57,;7.82,4.97,;7.42,6.48,;5.93,6.09,)|

BDBM50600630

Cc1cccc(C)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r,wU:21.24,(-4.16,-5.92,;-5.25,-4.83,;-6.73,-5.22,;-7.82,-4.14,;-7.43,-2.65,;-5.95,-2.25,;-5.55,-.76,;-4.85,-3.34,;-3.36,-2.94,;-2.91,-1.48,;-1.36,-1.48,;-.9,-2.98,;-2.12,-3.86,;-2.12,-5.4,;-.78,-6.17,;-1.13,-7.7,;-2.63,-7.85,;-3.25,-6.44,;-.59,-.15,;-1.36,1.19,;.95,-.15,;1.72,1.19,;.95,2.52,;1.72,3.85,;.95,5.19,;1.72,6.52,;.95,7.85,;-.59,7.85,;-1.36,6.52,;-.59,5.19,;3.26,1.19,;4.03,2.52,;3.26,3.85,;5.57,2.52,;6.34,3.85,;7.82,4.25,;7.42,5.77,;5.93,5.37,)|

BDBM50600631

CCc1cc(F)ccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600632

Fc1ccc(-c2cc(nn2C2CCCC2)C(=O)N[C@@H](CCN2CCCCC2)CC(=O)NC2CCC2)c(OCC(F)(F)F)c1 |r|

BDBM50600633

Fc1cc(F)c(-c2cc(nn2C2CCCC2)C(=O)N[C@@H](CCN2CCCCC2)CC(=O)NC2CCC2)c(F)c1 |r,wU:19.21,(-8.57,-4.53,;-7.08,-4.13,;-5.99,-5.22,;-4.51,-4.83,;-3.42,-5.92,;-4.11,-3.34,;-2.62,-2.94,;-2.16,-1.48,;-.62,-1.48,;-.15,-2.98,;-1.37,-3.86,;-1.37,-5.4,;-.04,-6.17,;-.39,-7.7,;-1.88,-7.85,;-2.5,-6.44,;.15,-.15,;-.62,1.19,;1.69,-.15,;2.46,1.19,;1.69,2.52,;2.46,3.85,;1.69,5.19,;2.46,6.52,;1.69,7.85,;.15,7.85,;-.62,6.52,;.15,5.19,;4,1.19,;4.77,2.52,;4,3.85,;6.31,2.52,;7.08,3.85,;8.57,4.25,;8.16,5.77,;6.67,5.37,;-5.2,-2.25,;-4.8,-.76,;-6.69,-2.65,)|

BDBM50600634

CCOc1cc(F)c(-c2cc(nn2C2CCCC2)C(=O)N[C@@H](CCN2CCCCC2)CC(=O)NC2CCC2)c(F)c1 |r,wU:21.23,(-9.51,-6.42,;-8.02,-6.02,;-7.62,-4.53,;-6.14,-4.13,;-5.05,-5.22,;-3.56,-4.83,;-2.47,-5.92,;-3.16,-3.34,;-1.68,-2.94,;-1.22,-1.48,;.32,-1.48,;.79,-2.98,;-.43,-3.86,;-.43,-5.4,;.9,-6.17,;.56,-7.7,;-.94,-7.85,;-1.56,-6.44,;1.09,-.15,;.32,1.19,;2.63,-.15,;3.4,1.19,;2.63,2.52,;3.4,3.85,;2.63,5.19,;3.4,6.52,;2.63,7.85,;1.09,7.85,;.32,6.52,;1.09,5.19,;4.94,1.19,;5.71,2.52,;4.94,3.85,;7.25,2.52,;8.02,3.85,;9.51,4.25,;9.1,5.77,;7.62,5.37,;-4.26,-2.25,;-3.86,-.76,;-5.74,-2.65,)|

BDBM50600635

COc1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600636

CSc1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600637

CS(=O)(=O)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600638

CC(C)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600639

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2ccccc2C#C)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600640

FC(F)(F)Oc1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600641

Clc1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600642

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2cncnc2)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600643

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2ccccn2)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600644

[O-][n+]1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600645

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2cccs2)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600646

FC(F)(F)c1sccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r|

BDBM50600647

O=C(C[C@H](CCN1CCCCC1)NC(=O)c1cc(-c2cscn2)n(n1)C1CCCC1)NC1CCC1 |r|

BDBM50600648

Cc1noc(C)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(=O)NC1CCC1 |r,wU:20.23,(-4.4,-5.92,;-5.49,-4.83,;-7.06,-4.83,;-7.59,-3.49,;-6.38,-2.52,;-6.38,-.98,;-5.09,-3.34,;-3.6,-2.94,;-3.14,-1.48,;-1.6,-1.48,;-1.13,-2.98,;-2.35,-3.86,;-2.35,-5.4,;-1.02,-6.17,;-1.36,-7.7,;-2.86,-7.85,;-3.48,-6.44,;-.83,-.15,;-1.6,1.19,;.71,-.15,;1.48,1.19,;.71,2.52,;1.48,3.85,;.71,5.19,;1.48,6.52,;.71,7.85,;-.83,7.85,;-1.6,6.52,;-.83,5.19,;3.02,1.19,;3.79,2.52,;3.02,3.85,;5.33,2.52,;6.1,3.85,;7.59,4.25,;7.18,5.77,;5.7,5.37,)|

BDBM50600649

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CC2CCC1CC2)CC(=O)NC1CCC1 |r,wU:23.26,(-5.21,1.3,;-5.57,-.2,;-4.09,.24,;-6.68,.87,;-5.93,-1.69,;-7.41,-2.14,;-7.76,-3.63,;-6.65,-4.69,;-5.18,-4.26,;-4.81,-2.76,;-3.34,-2.33,;-2.97,-.79,;-1.42,-.79,;-.92,-2.29,;-2.09,-3.2,;-2.09,-4.74,;-3.19,-5.81,;-2.54,-7.21,;-1.04,-7.02,;-.73,-5.48,;-.65,.54,;-1.42,1.88,;.89,.54,;1.66,1.88,;.89,3.21,;-.65,3.21,;-1.42,4.54,;-.65,5.88,;-1.42,7.21,;-2.96,7.21,;-3.73,5.88,;-2.96,4.54,;-2.84,6.12,;-1.48,5.68,;3.2,1.88,;3.97,3.21,;3.2,4.54,;5.51,3.21,;6.28,4.54,;7.76,4.94,;7.36,6.45,;5.87,6.06,)|

BDBM50600650

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CC2(COC2)C1)CC(=O)NC1CCC1 |r|

BDBM50600651

CN(C)CC[C@@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1 |r|

BDBM50600652

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCNC(=O)C1COC1)CC(=O)NC1CCC1 |r|

BDBM50600653

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@H](CN1CCCC(F)(F)C1)CC(=O)NC1CCC1 |r|

BDBM50600654

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@H](CN1CCC(F)(F)C1)CC(=O)NC1CCC1 |r|

BDBM50600655

CN(C[C@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1)C1CCCCC1 |r|

BDBM50600656

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@H](CC(=O)NC1CCC1)C(=O)NC1CCCCC1 |r|

BDBM50600657

CN(C1CCCCC1)C(=O)[C@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1 |r|

BDBM50600658

FC(F)(F)c1ccccc1-c1cc(nn1C1CCCC1)C(=O)N[C@H](CC(=O)NC1CCC1)C(=O)NC1CCOCC1 |r|

BDBM50600659

Cc1cc(C)n(CC[C@@H](CC(=O)NC2CCC2)NC(=O)c2cc(-c3ccccc3C(F)(F)F)n(n2)C2CCCC2)n1 |r|

BDBM50393894

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(cc3)C(F)(F)F)co2)n1

BDBM50393895

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(cc3)C#N)co2)n1

BDBM50393896

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(cc3)[N+]([O-])=O)co2)n1

BDBM50393897

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(Cl)cc3)co2)n1

BDBM50393898

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3cccc(c3)[N+]([O-])=O)co2)n1

BDBM50393899

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(C)c(c3)[N+]([O-])=O)co2)n1

BDBM50393900

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccccc3)co2)n1

BDBM50393901

COc1cc(C(=O)Oc2coc(CSc3ncccn3)cc2=O)c(cc1OC)[N+]([O-])=O

BDBM50393902

O=C(Oc1coc(CSc2ncccn2)cc1=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1

BDBM50393903

O=C(Oc1coc(CSc2ncccn2)cc1=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

BDBM50393904

CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393905

O=C(Oc1coc(CSc2ncccn2)cc1=O)c1ccc(cc1)-c1ccccc1

BDBM50393906

Cc1c(cccc1[N+]([O-])=O)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393907

[O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393908

[O-][N+](=O)c1ccc(Cl)cc1C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393909

Cc1ccc(cc1C)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393910

O=C(Oc1coc(CSc2ncccn2)cc1=O)c1ccc(cc1)S(=O)(=O)N1CCCC1

BDBM50393911

CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393912

Fc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393913

CC(C)(C)c1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393914

CCCCOc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393915

CC(C)Oc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393916

CCOc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393917

COc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393918

Cc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393919

Brc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393920

FC(F)(F)c1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393921

O=C(Oc1coc(CSc2ncccn2)cc1=O)c1ccc(cc1)C#N

BDBM50393922

Clc1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393923

[O-][N+](=O)c1cccc(c1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393924

Cc1ccc(cc1[N+]([O-])=O)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393925

[O-][N+](=O)c1cc(ccc1Cl)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50393926

O=C(Oc1coc(CSc2ncccn2)cc1=O)c1ccccc1

BDBM50393928

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(cc3)S(=O)(=O)N3CCCC3)co2)n1

BDBM50393929

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(F)cc3)co2)n1

BDBM50393930

COc1ccc(cc1)C(=O)Oc1coc(CSc2nccc(C)n2)cc1=O

BDBM50393931

Cc1ccc(cc1)C(=O)Oc1coc(CSc2nccc(C)n2)cc1=O

BDBM50393932

Cc1ccnc(n1)S(=O)(=O)Cc1cc(=O)c(OC(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)co1

BDBM50393933

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3cnco3)co2)n1

BDBM50393934

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(o3)[N+]([O-])=O)co2)n1

BDBM50393935

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccsc3)co2)n1

BDBM50393936

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccco3)co2)n1

BDBM50393937

Cc1ccnc(SCc2cc(=O)c(NC(=O)c3ccc(cc3)[N+]([O-])=O)co2)n1

BDBM50393938

Cc1ccnc(SCc2cc(=O)c(NC(=O)c3ccccc3)co2)n1

BDBM50393939

Cc1cc(C)nc(SCc2cc(=O)c(OS(=O)(=O)c3ccc(cc3)[N+]([O-])=O)co2)n1

BDBM50393940

Cc1cc(C)nc(SCc2cc(=O)c(OS(=O)(=O)c3ccccc3)co2)n1

BDBM50393941

CC(=O)Oc1coc(CSc2nccc(C)n2)cc1=O

BDBM50393942

CC(C)C(=O)Oc1coc(CSc2nccc(C)n2)cc1=O

BDBM50393943

Cc1ccnc(SCc2cc(=O)c(OC(=O)C(C)(C)C)co2)n1

BDBM50393944

Cc1ccnc(SCc2cc(=O)c(OCc3ccc(Cl)c(c3)[N+]([O-])=O)co2)n1

BDBM50393945

Cc1ccnc(SCc2cc(=O)c(OCc3ccccc3)co2)n1

BDBM50393946

[O-][N+](=O)c1cc(ccc1Cl)C(=O)Oc1coc(CSc2ccccc2)cc1=O

BDBM50393947

Cc1ccc(SCc2cc(=O)c(OC(=O)c3ccc(Cl)c(c3)[N+]([O-])=O)co2)cc1

BDBM50393948

[O-][N+](=O)c1cc(ccc1Cl)C(=O)Oc1coc(CSc2ccc(Cl)cc2)cc1=O

BDBM50393949

[O-][N+](=O)c1cc(ccc1Cl)C(=O)Oc1coc(CSc2ccc(OC(F)(F)F)cc2)cc1=O

BDBM50393950

COc1ccc(SCc2cc(=O)c(OC(=O)c3ccc(Cl)c(c3)[N+]([O-])=O)co2)cc1

BDBM50393951

Cc1cc(C)nc(SCc2cc(=O)c(O)co2)n1

BDBM50393952

Cc1ccnc(SCc2cc(=O)c(O)co2)n1

BDBM50393953

Oc1coc(CSc2ncccn2)cc1=O

BDBM50393954

Oc1coc(CSc2ccc(F)cc2)cc1=O

BDBM50393955

Oc1coc(CSc2ccccc2)cc1=O

BDBM50393956

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3cccc(c3)C#N)co2)n1

BDBM50393957

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccc(OC(F)(F)F)cc3)co2)n1

BDBM50393958

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccccc3C)co2)n1

BDBM50393959

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3cccc(Cl)c3)co2)n1

BDBM50393960

Cc1cccc(c1)C(=O)Oc1coc(CSc2nccc(C)n2)cc1=O

BDBM50393961

COc1cccc(c1)C(=O)Oc1coc(CSc2nccc(C)n2)cc1=O

BDBM50393962

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccccc3Cl)co2)n1

BDBM50393963

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3cc(ccc3Cl)[N+]([O-])=O)co2)n1

BDBM50393927

Cc1ccnc(SCc2cc(=O)c(OC(=O)c3cc(Cl)ccc3[N+]([O-])=O)co2)n1

BDBM50393964

[O-][N+](=O)c1ccc(cc1)C(=O)Oc1coc(CSc2ncccn2)cc1=O

BDBM50014605

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014606

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(C)=O)C(N)=O |r|

BDBM50014607

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)NCCCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(N)=O |r|

BDBM50014608

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014609

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O |r|

BDBM50014610

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014611

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(C)=O)C(N)=O |r|

BDBM50014612

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(N)=O |r|

BDBM50014613

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)NCC(N)=O |r|

BDBM50014614

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(N)=O |r|

BDBM50014615

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O |r|

BDBM50014616

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(N)=O |r|

BDBM50014617

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)C(F)(F)F)NC(C)=O)C(N)=O |r|

BDBM50014618

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CCCCCCCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014621

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014622

CC(C)C[C@H](NC(=O)[C@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014623

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014624

CCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(N)=O |r|

BDBM50014625

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(N)=O |r|

BDBM50014626

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014627

CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|

BDBM50014628

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014629

BDBM50014630

BDBM50014631

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014632

CCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(N)=O |r|

BDBM50014635

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|

BDBM50014653

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(N)=O |r|

BDBM50014659

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50014663

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50014679

BDBM50027830

CCCCCCCCCCCCCCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027831

CCCCCCCCCCCCCCCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027832

CCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027833

CCCCCCCCCCCCCCCC(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50027834

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027836

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027837

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027842

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027843

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027844

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027845

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027847

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027848

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027849

CCCCCCCCCCCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027850

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027851

CCCCCCCCCCCCCCCC(=O)N[C@H](C(C)C)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCNC(N)=N)C(N)=O |r|

CCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027892

CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027894

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50027918

CCCCCCCCCCCCCCCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(N)=O |r|

BDBM50027921

BDBM50027922

CCCCCCCCCCCCCCCCN[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|

CCCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r|

BDBM50078012

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r|

BDBM50078013

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](N)CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r|

BDBM50078014

CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(O)=O |r|

BDBM50172361

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)NC(C)C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172362

CSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50172363

BDBM50172365

CSCCC(NC(=O)C(N)CS)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172366

BDBM50172368

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(N)CS)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172369

CSCCC(NC(=O)C1CSSCC(N)C(=O)NC(CC(C)C)C(=O)NC(CCC(N)=O)C(=O)NC(CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172370

CSCCC(NC(=O)C(NC(=O)C(CC(C)C)NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C1CCCN1C(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(C)C)C(C)O)C(=O)NC(CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CCCNC(N)=N)C(=O)NC(CCCCN)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CC(N)=O)C(=O)NC1CSSCC(NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCC(N)=O)NC(=O)C(CC(C)C)NC1=O)C(=O)NC(CCSC)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CCCNC(N)=N)C(=O)NC(CO)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172372

CSCCC(NC(=O)C(CS)NC(=O)C(C)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172375

CSCCC(NC(=O)C(C)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172376

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|

BDBM50172377

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172378

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172382

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172383

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(C)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172385

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172386

BDBM50172387

CCCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172388

CSCCC(NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172389

BDBM50172390

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C(C)N)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50172391

CSCCC(NC(=O)C(CS)NC(=O)C(CCCNC(N)=N)NC(=O)C(C)NC(=O)C1CCC(=O)N1)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CO)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)N1CCCC1C(O)=O

BDBM50183335

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)Nc1ccccc1C(O)=O |(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;6.18,-7.61,;6.8,-9.02,;5.89,-10.26,;4.36,-10.1,;3.74,-8.69,;2.21,-8.53,;1.7,-7.4,;1.48,-9.53,)|

BDBM50183337

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C(C)C)C(O)=O |r,wU:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;6.18,-7.61,;6.67,-8.74,;6.91,-6.62,;3.74,-8.69,;2.51,-8.56,;4.23,-9.82,)|

BDBM50019419

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)NC1(C2CC3CC(C2)CC1C3)C(O)=O |TLB:34:33:31:27.28.29,24:25:27.34.28:32.30.31,THB:34:28:25.33.32:31,29:28:25:32.30.31,29:30:25:27.34.28,35:25:27.34.28:32.30.31,24:25:31:27.28.29,(56.32,-26.53,;57,-27.91,;56.16,-29.2,;54.62,-29.11,;53.77,-30.4,;54.48,-31.78,;56.01,-31.87,;56.7,-33.24,;55.87,-34.52,;56.85,-30.58,;58.38,-30.66,;58.85,-32.13,;60.39,-32.13,;60.87,-30.67,;59.62,-29.75,;59.62,-28.21,;60.96,-27.45,;60.96,-25.91,;59.62,-25.13,;59.62,-23.59,;58.28,-25.92,;58.29,-27.45,;61.3,-33.38,;60.67,-34.79,;62.83,-33.22,;63.74,-34.46,;64.93,-33.19,;66.26,-33.67,;67.66,-33.33,;67.67,-31.8,;66.27,-31.22,;64.92,-31.7,;65.23,-32.45,;65.24,-34.04,;66.65,-34.6,;63.1,-35.87,;61.57,-36.03,;64.01,-37.12,)|

BDBM50183339

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N1CC[C@@H](C1)C(O)=O |r,wD:27.32,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.51,-7.48,;3.26,-8.38,;2.01,-7.47,;2.5,-6.01,;.55,-7.94,;.28,-9.14,;-.36,-7.11,)|

BDBM50183340

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@H]1CC[C@@H](CC1)C(O)=O |r,wU:28.34,wD:25.27,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;5.89,-10.26,;6.8,-9.02,;6.18,-7.61,;6.52,-11.67,;5.8,-12.66,;7.75,-11.8,)|

BDBM50019423

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)NC1(CCCCC1)C(O)=O |(18.77,-17.38,;19.54,-16.04,;21.08,-16.04,;21.85,-17.38,;23.39,-17.38,;24.16,-16.04,;23.39,-14.71,;24.16,-13.38,;25.7,-13.38,;21.85,-14.71,;20.85,-12.98,;21.48,-11.57,;20.33,-10.54,;19,-11.31,;19.32,-12.81,;18.29,-13.96,;18.76,-15.42,;17.73,-16.57,;16.23,-16.25,;15.2,-17.39,;15.75,-14.78,;16.78,-13.64,;20.49,-9.01,;21.9,-8.38,;19.25,-8.1,;19.41,-6.57,;20.9,-7,;21.99,-5.92,;21.62,-4.43,;20.13,-4,;19.04,-5.09,;17.87,-6.68,;17.01,-5.4,;17.2,-8.06,)|

BDBM50183343

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@H](CC(O)=O)C1CCCCC1 |r,wD:25.32,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;6.18,-7.61,;7.09,-6.36,;6.59,-5.24,;8.31,-6.49,;3.74,-8.69,;4.36,-10.1,;3.44,-11.34,;1.91,-11.17,;1.29,-9.76,;2.21,-8.52,)|

BDBM50183344

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CC(C)C)CC(O)=O |r,wU:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;6.18,-7.61,;6.8,-9.02,;8.02,-9.16,;6.07,-10.02,;3.74,-8.69,;4.36,-10.1,;5.58,-10.23,;3.63,-11.09,)|

BDBM50183346

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CC(C)C)C(O)=O |r,wU:25.28,(59.81,-27.67,;60.52,-26.3,;59.69,-25.01,;58.16,-25.08,;57.32,-23.77,;58.04,-22.41,;59.58,-22.34,;60.29,-20.98,;59.47,-19.68,;60.4,-23.65,;61.93,-23.58,;62.4,-25.04,;63.94,-25.04,;64.42,-23.58,;63.17,-22.67,;63.17,-21.13,;64.51,-20.36,;64.5,-18.82,;63.17,-18.05,;63.16,-16.53,;61.83,-18.83,;61.84,-20.37,;64.85,-26.29,;64.22,-27.7,;66.38,-26.13,;67.28,-27.38,;68.81,-27.22,;69.72,-28.47,;71.25,-28.31,;69.09,-29.87,;66.65,-28.79,;65.12,-28.95,;67.55,-30.04,)|

BDBM50183348

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CCCCN)C(O)=O |r,wD:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;3.45,-11.34,;4.07,-12.75,;3.34,-13.75,;6.18,-7.61,;6.91,-6.62,;6.67,-8.74,)|

BDBM50183349

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(O)=O |r,wD:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;3.45,-11.34,;4.07,-12.75,;3.16,-14,;3.78,-15.41,;5.01,-15.54,;2.87,-16.65,;3.49,-18.06,;2.77,-19.05,;4.72,-18.19,;3.99,-19.19,;6.18,-7.61,;6.91,-6.62,;6.67,-8.74,)|

BDBM50183350

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CCC(N)=O)C(O)=O |r,wD:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;3.45,-11.34,;2.22,-11.21,;3.95,-12.47,;6.18,-7.61,;6.91,-6.62,;6.67,-8.74,)|

BDBM50183353

Cc1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(O)=O |r|

BDBM50183357

OC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)n(n1)-c1ccc(F)cc1)C1CCCCC1 |r|

BDBM50183358

COc1cccc(O)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(O)=O |r,wU:24.27,(-1.19,-7.54,;.05,-7.58,;.77,-8.93,;-.04,-10.24,;.69,-11.6,;2.22,-11.65,;3.04,-10.34,;4.27,-10.38,;2.31,-8.99,;3.22,-7.74,;2.75,-6.28,;3.99,-5.4,;5.24,-6.29,;4.76,-7.75,;5.66,-9,;7.19,-8.96,;8,-10.27,;7.26,-11.62,;7.91,-12.67,;5.72,-11.66,;4.92,-10.35,;4,-3.86,;5.07,-3.24,;2.66,-3.08,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;4,-.78,;4.01,.45,;5.07,-1.4,)|

BDBM50183360

OC(=O)[C@@H](NC(=O)c1cc(-c2c(O)cccc2O)n(n1)-c1ccc(F)cc1)C1CCCCC1 |r,wU:3.29,(4.01,.45,;4,-.78,;5.07,-1.4,;2.67,-1.54,;2.66,-3.08,;4,-3.86,;5.07,-3.24,;3.99,-5.4,;2.75,-6.28,;3.22,-7.74,;2.31,-8.99,;3.04,-10.34,;4.27,-10.38,;2.22,-11.65,;.69,-11.6,;-.04,-10.24,;.77,-8.93,;.19,-7.85,;4.76,-7.75,;5.24,-6.29,;5.66,-9,;7.19,-8.96,;8,-10.27,;7.26,-11.62,;7.91,-12.67,;5.72,-11.66,;4.92,-10.35,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,)|

BDBM50183361

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(=O)NCC(O)=O |r,wD:25.28,(3.74,-.92,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-3.74,-.92,;,-1.54,;,-3.08,;1.25,-3.96,;.77,-5.43,;-.77,-5.43,;-1.24,-3.97,;-2.71,-3.48,;-3.14,-2.01,;-4.63,-1.65,;-5.7,-2.76,;-6.89,-2.47,;-5.27,-4.24,;-3.77,-4.6,;1.68,-6.67,;2.9,-6.54,;1.05,-8.08,;1.96,-9.33,;1.33,-10.73,;-.2,-10.9,;-.82,-12.31,;.08,-13.55,;1.62,-13.39,;2.24,-11.98,;3.49,-9.16,;4.21,-10.16,;4.11,-7.75,;5.65,-7.59,;6.27,-6.18,;5.54,-5.19,;7.5,-6.05,)|

BDBM50183362

COC(=O)CNC(=O)[C@@H](NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)-c1ccc(F)cc1)C1CCCCC1 |r,wD:8.36,(8.3,-4.89,;7.8,-6.02,;6.27,-6.18,;5.54,-5.19,;5.65,-7.59,;4.11,-7.75,;3.49,-9.16,;4.21,-10.16,;1.96,-9.33,;1.05,-8.08,;1.68,-6.67,;2.9,-6.54,;.77,-5.43,;1.25,-3.96,;,-3.08,;,-1.54,;1.33,-.77,;2.67,-1.54,;3.74,-.92,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-3.74,-.92,;-1.24,-3.97,;-.77,-5.43,;-2.71,-3.48,;-3.14,-2.01,;-4.63,-1.65,;-5.7,-2.76,;-6.89,-2.47,;-5.27,-4.24,;-3.77,-4.6,;1.33,-10.73,;-.2,-10.9,;-.82,-12.31,;.08,-13.55,;1.62,-13.39,;2.24,-11.98,)|

BDBM50183363

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(=O)NO |r,wD:25.28,(3.74,-.92,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-3.74,-.92,;,-1.54,;,-3.08,;1.25,-3.96,;.77,-5.43,;-.77,-5.43,;-1.24,-3.97,;-2.71,-3.48,;-3.14,-2.01,;-4.63,-1.65,;-5.7,-2.76,;-6.89,-2.47,;-5.27,-4.24,;-3.77,-4.6,;1.68,-6.67,;2.9,-6.54,;1.05,-8.08,;1.96,-9.33,;1.33,-10.73,;2.23,-11.98,;1.6,-13.39,;.07,-13.55,;-.83,-12.3,;-.2,-10.89,;3.49,-9.16,;4.21,-10.16,;4.11,-7.75,;5.34,-7.62,)|

BDBM50183365

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(=O)NCc1ccccc1 |r,wU:25.28,(3.74,-.92,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-3.74,-.92,;,-1.54,;,-3.08,;1.25,-3.96,;.77,-5.43,;-.77,-5.43,;-1.24,-3.97,;-2.71,-3.48,;-3.14,-2.01,;-4.63,-1.65,;-5.7,-2.76,;-6.89,-2.47,;-5.27,-4.24,;-3.77,-4.6,;1.68,-6.67,;2.9,-6.54,;1.05,-8.08,;1.96,-9.33,;3.49,-9.17,;4.12,-7.76,;5.65,-7.6,;6.55,-8.85,;5.92,-10.25,;4.39,-10.41,;1.33,-10.73,;.1,-10.86,;2.23,-11.98,;1.61,-13.39,;2.51,-14.64,;1.89,-16.04,;2.8,-17.29,;4.33,-17.13,;4.95,-15.72,;4.04,-14.47,)|

BDBM50183366

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(=O)N(C)C |r,wD:25.28,(3.74,-.92,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-3.74,-.92,;,-1.54,;,-3.08,;1.25,-3.96,;.77,-5.43,;-.77,-5.43,;-1.24,-3.97,;-2.71,-3.48,;-3.14,-2.01,;-4.63,-1.65,;-5.7,-2.76,;-6.89,-2.47,;-5.27,-4.24,;-3.77,-4.6,;1.68,-6.67,;2.9,-6.54,;1.05,-8.08,;1.96,-9.33,;1.33,-10.73,;2.23,-11.98,;1.6,-13.39,;.07,-13.55,;-.83,-12.3,;-.2,-10.89,;3.49,-9.16,;4.21,-10.16,;4.11,-7.75,;5.34,-7.62,;3.39,-6.76,)|

BDBM50183367

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](C1CCCCC1)C(N)=O |r,wU:25.28,(8.13,.14,;6.93,-.15,;5.87,.96,;6.3,2.44,;5.24,3.56,;3.74,3.19,;3.31,1.71,;1.81,1.35,;.96,2.24,;4.37,.6,;4.06,-.91,;5.09,-2.05,;4.31,-3.38,;2.81,-3.06,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-2.4,1.39,;-1.33,-.77,;,-1.54,;4.94,-4.79,;4.22,-5.79,;6.47,-4.95,;7.1,-6.36,;8.63,-6.52,;9.26,-7.92,;10.79,-8.08,;11.7,-6.83,;11.07,-5.43,;9.53,-5.27,;6.19,-7.6,;6.69,-8.73,;4.97,-7.47,)|

BDBM50183368

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)NCC1CCCCC1 |(4.75,-11.88,;4.33,-10.72,;2.82,-10.43,;1.82,-11.6,;.31,-11.32,;-.21,-9.87,;.79,-8.7,;.28,-7.25,;-.93,-7.02,;2.31,-8.99,;3.22,-7.74,;2.75,-6.28,;3.99,-5.4,;5.24,-6.29,;4.76,-7.75,;5.66,-9,;7.19,-8.96,;8,-10.27,;7.26,-11.62,;7.91,-12.67,;5.72,-11.66,;4.92,-10.35,;4,-3.86,;5.07,-3.24,;2.66,-3.08,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,)|

BDBM50183369

COC(=O)[C@@H](NC(=O)c1cc(-c2c(OC)cccc2OC)n(n1)-c1ccc(F)cc1)C1CCCCC1 |r,wU:4.32,(6.41,-.94,;5.34,-1.55,;4,-.78,;4.01,.45,;2.67,-1.54,;2.66,-3.08,;4,-3.86,;5.07,-3.24,;3.99,-5.4,;2.75,-6.28,;3.22,-7.74,;2.31,-8.99,;2.82,-10.43,;4.33,-10.72,;4.75,-11.88,;1.82,-11.6,;.31,-11.32,;-.21,-9.87,;.79,-8.7,;.28,-7.25,;-.93,-7.02,;4.76,-7.75,;5.24,-6.29,;5.66,-9,;7.19,-8.96,;8,-10.27,;7.26,-11.62,;7.91,-12.67,;5.72,-11.66,;4.92,-10.35,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,)|

BDBM50183372

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@H](C1CCCCC1)C(O)=O |r,wD:25.28,(4.75,-11.88,;4.33,-10.72,;2.82,-10.43,;1.82,-11.6,;.31,-11.32,;-.21,-9.87,;.79,-8.7,;.28,-7.25,;-.93,-7.02,;2.31,-8.99,;3.22,-7.74,;2.75,-6.28,;3.99,-5.4,;5.24,-6.29,;4.76,-7.75,;5.66,-9,;7.19,-8.96,;8,-10.27,;7.26,-11.62,;7.91,-12.67,;5.72,-11.66,;4.92,-10.35,;4,-3.86,;5.07,-3.24,;2.66,-3.08,;2.67,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;4,-.78,;4.01,.45,;5.07,-1.4,)|

BDBM50183373

COc1cccc(OC)c1-c1cc(C(=O)N[C@@H](C2CCCCC2)C(O)=O)n(n1)-c1ccc(F)cc1 |r|

BDBM50183374

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](CCc1ccccc1)CC(O)=O |r,wD:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;3.45,-11.34,;4.07,-12.75,;3.16,-13.99,;1.63,-13.82,;1.01,-12.41,;1.92,-11.17,;6.18,-7.61,;6.8,-9.02,;6.07,-10.02,;8.02,-9.16,)|

BDBM50183378

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,wD:25.28,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;3.74,-8.69,;4.36,-10.1,;3.45,-11.34,;4.07,-12.75,;5.61,-12.91,;6.51,-11.67,;5.89,-10.26,;6.18,-7.61,;6.91,-6.62,;6.67,-8.74,)|

BDBM50183379

COc1cccc(OC)c1-c1cc(nn1-c1ccc(F)cc1)C(=O)N[C@H](C(O)=O)c1ccccc1 |r,wD:25.31,(2.66,2.78,;2.67,1.54,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;-0,-3.08,;-1.07,-3.7,;1.33,-.77,;2.67,-1.54,;2.81,-3.06,;4.31,-3.38,;5.09,-2.05,;4.06,-.91,;4.37,.6,;3.31,1.71,;3.74,3.19,;5.24,3.56,;5.58,4.74,;6.3,2.44,;5.87,.96,;4.93,-4.79,;6.16,-4.92,;4.02,-6.03,;4.65,-7.44,;6.18,-7.61,;6.68,-8.73,;6.9,-6.61,;3.74,-8.69,;4.36,-10.1,;3.44,-11.34,;1.91,-11.17,;1.29,-9.76,;2.21,-8.52,)|

BDBM50183380

CC1=CC(=O)C(=C\C1=N\OS(=O)(=O)c1ccccc1)C1CCCCC1 |c:5,t:1|