Compound Name

SMILES String

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccccc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCOCC1)-c1cccc2[nH]ncc12

Cc1ccc(cc1)-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1ccc(cn1)-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccc(cc1)C#N)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccc(cc1)-c1ccccc1)-c1cccc2[nH]ncc12

Nc1ccc(cn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)C1CC1)-c1cccc2[nH]ncc12

Cc1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCNCC1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCN(C2CC2)C(=O)C1)-c1cccc2[nH]ncc12

CN(C)c1ccc(cn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)C1CCOCC1)-c1cccc2[nH]ncc12

CS(=O)(=O)c1ccc(cc1)-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccnc(c1)N1CCOCC1)-c1cccc2[nH]ncc12

Nc1ccc(cc1)-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

CC(=O)Nc1ccc(cc1)-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1cccc(c1)N1CCOCC1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(NC2CCOC2)nc1)-c1cccc2[nH]ncc12

Cc1cccc(c1)-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1cccc(c1)C#N)-c1cccc2[nH]ncc12

Cc1ccc(O)c(C)c1-c1cc(C2CC2)c2nc([nH]c(=O)c2c1N)-c1ccncc1 |(4.72,-.11,;4.96,1.08,;6.18,1.91,;6.94,3.06,;5.67,3.25,;6.07,4.6,;4.25,2.5,;3.18,2.82,;3.73,1.36,;2.4,.59,;2.4,-.95,;1.07,-1.72,;1.07,-3.26,;.3,-4.6,;1.84,-4.6,;-.27,-.95,;-1.6,-1.72,;-2.93,-.95,;-2.93,.59,;-1.6,1.36,;-1.6,2.9,;-.27,.59,;1.07,1.36,;1.07,2.9,;-4.27,-1.72,;-5.6,-.95,;-6.94,-1.72,;-6.94,-3.26,;-5.6,-4.03,;-4.27,-3.26,)|

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(NCCN2CCCC2)nc1)-c1cccc2[nH]ncc12

CN1CCN(CC1)c1ccc(cn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCOCC1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCN(CC1)C1CC1)-c1cccc2[nH]ncc12

Cc1ccc(O)c(C)c1-c1cc(-c2cnn(c2)C2CC2)c2nc([nH]c(=O)c2c1N)-c1ccncc1 |(4.72,1.85,;4.96,3.03,;6.18,3.86,;6.94,5.01,;5.67,5.21,;6.07,6.55,;4.25,4.46,;3.18,4.77,;3.73,3.31,;2.4,2.54,;2.4,1,;1.07,.23,;1.07,-1.31,;2.31,-2.21,;1.84,-3.68,;.3,-3.68,;-.18,-2.21,;-.47,-5.01,;-1.81,-5.78,;-.47,-6.55,;-.27,1,;-1.6,.23,;-2.93,1,;-2.93,2.54,;-1.6,3.31,;-1.6,4.85,;-.27,2.54,;1.07,3.31,;1.07,4.85,;-4.27,.23,;-5.6,1,;-6.94,.23,;-6.94,-1.31,;-5.6,-2.08,;-4.27,-1.31,)|

Nc1c(cc(-c2nccs2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

COCCNc1ccc(cn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccnc(c1)N1CCNCC1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCC(CC1)C(O)=O)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCC2(COC2)CC1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(NC2COC2)nc1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCN(CCO)CC1)-c1cccc2[nH]ncc12

COCCNc1cc(ccn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

CN1CCN(CC1)c1cc(ccn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1ccc(CN2CCOCC2)cc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1cccc(CN2CCOCC2)c1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1cccnn1)-c1cccc2[nH]ncc12

COCc1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCCCC1CO)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(nc1)N1CCC(O)CC1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc(Cc3ccccc3)[nH]c(=O)c12)-c1cccc2[nH]ncc12

CC1(O)CCN(CC1)c1ccc(cn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccc(F)cc2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccc(c2)C(F)(F)F)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccc(OCCN3CCOCC3)n2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(c2CNC(=O)c2c1N)-c1ccnnc1 |(-.08,4.97,;1.28,4.24,;2.61,5.01,;3.94,4.24,;3.94,2.7,;5.09,1.67,;4.46,.26,;2.93,.43,;2.61,1.93,;1.28,2.7,;-.05,1.92,;-.05,.38,;-1.38,-.39,;-2.72,.38,;-4.18,-.1,;-5.09,1.15,;-4.18,2.39,;-4.69,3.85,;-2.72,1.92,;-1.38,2.69,;-1.38,4.23,;-1.41,-1.93,;-2.75,-2.7,;-2.75,-4.24,;-1.41,-5.01,;-.08,-4.24,;-.08,-2.7,)|

Nc1c(cc(-c2cccc(OCCN3CCOCC3)c2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cnn(c2)C2CC2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccc(OCCN3CCCC3)n2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccc(OC[C@@H]3CCCO3)n2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12 |r|

CN1CCC(=CC1)c1cc(c(N)c2c1nc([nH]c2=O)-c1ccncc1)-c1cccc2[nH]ncc12 |c:4|

CC(=O)N1CCC(=CC1)c1cc(c(N)c2c1nc([nH]c2=O)-c1ccncc1)-c1cccc2[nH]ncc12 |c:6|

Nc1c(cc(-c2cnn(c2)C2COC2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(C2CC2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

CN1CCC(CC1)n1cc(cn1)-c1cc(c(N)c2c1nc([nH]c2=O)-c1ccncc1)-c1cccc2[nH]ncc12

Cn1ccc(n1)-c1cc(c(N)c2c1nc([nH]c2=O)-c1ccncc1)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(c2CNC(=O)c2c1N)-c1ccc(F)cn1 |(-.08,5.74,;1.27,5.01,;2.61,5.78,;3.94,5.01,;3.94,3.47,;5.09,2.44,;4.46,1.04,;2.93,1.2,;2.61,2.7,;1.27,3.47,;-.05,2.69,;-.05,1.15,;-1.38,.38,;-2.72,1.15,;-4.18,.67,;-5.09,1.92,;-4.18,3.16,;-4.7,4.61,;-2.72,2.69,;-1.38,3.46,;-1.38,5,;-1.45,-1.16,;-2.78,-1.93,;-2.78,-3.47,;-1.45,-4.24,;-1.45,-5.78,;-.11,-3.47,;-.11,-1.93,)|

Cc1ccc2[nH]ncc2c1-c1cc(c2CNC(=O)c2c1N)-c1nccs1 |(-.09,4.58,;1.28,3.88,;2.61,4.65,;3.95,3.88,;3.95,2.34,;5.09,1.31,;4.46,-.1,;2.93,.07,;2.61,1.57,;1.28,2.34,;-.05,1.57,;-.05,.03,;-1.39,-.74,;-2.72,.03,;-4.18,-.45,;-5.09,.8,;-4.18,2.04,;-4.68,3.5,;-2.72,1.57,;-1.39,2.34,;-1.39,3.88,;-1.42,-2.28,;-.17,-3.19,;-.65,-4.65,;-2.19,-4.65,;-2.66,-3.19,)|

Nc1c(cc(C2=CCOCC2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12 |t:5|

Nc1c(cc(-c2cccc(OC3CCOCC3)c2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

CO[C@H](C)COc1cccc(c1)-c1cc(c(N)c2c1nc([nH]c2=O)-c1ccncc1)-c1cccc2[nH]ncc12 |r|

Nc1c(cc(-c2cnn(c2)C2CCOCC2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cnn(CC3CC3)c2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Cc1ccc(O)cc1-c1cc(Br)c2CNC(=O)c2c1N

Nc1c(cc(-c2cccc(OC[C@H]3CCCO3)n2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12 |r|

Nc1c(cc(C2=CCC(F)(F)CC2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12 |t:5|

Nc1c(cc(-c2cnn(c2)C2CC2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cnn(c2)C(F)F)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-n2ccc(n2)C2CC2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-n2cc(F)cn2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-n2ccc(n2)C2CCOCC2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-n2cccn2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(C2=CC3CCC(C2)O3)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12 |t:5|

Nc1c(cc(-n2cccn2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccc(=O)[nH]2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cnn(c2)C2CCOCC2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccccn2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccnnc2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ccc(O)cc1-c1ccc2CNC(=O)c2c1N

Nc1c(cc(-n2cc3CCCc3n2)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Nc1c(cc(-n2cc(cn2)C(F)(F)F)c2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCCN3CCOCC3)n2)c2nc[nH]c(=O)c2c1N |(-1.42,4.94,;-.04,4.27,;1.29,5.04,;2.63,4.27,;2.63,2.73,;3.77,1.7,;3.15,.29,;1.61,.45,;1.29,1.96,;-.04,2.73,;-1.34,1.91,;-1.34,.37,;-2.68,-.4,;-2.67,-1.94,;-4,-2.71,;-4,-4.25,;-2.67,-5.02,;-1.33,-4.25,;0,-5.02,;1.34,-4.26,;2.67,-5.03,;4.01,-4.27,;4.01,-2.73,;5.35,-1.96,;6.68,-2.73,;6.68,-4.27,;5.35,-5.04,;-1.33,-2.71,;-4.01,.37,;-5.35,-.4,;-6.68,.37,;-6.68,1.91,;-5.35,2.68,;-5.35,4.22,;-4.01,1.91,;-2.68,2.68,;-2.68,4.22,)|

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCCN3CCCC3)n2)c2nc[nH]c(=O)c2c1N |(-1.28,4.94,;.11,4.27,;1.44,5.04,;2.78,4.27,;2.78,2.73,;3.92,1.69,;3.29,.29,;1.76,.45,;1.44,1.96,;.11,2.73,;-1.2,1.91,;-1.2,.37,;-2.53,-.4,;-2.52,-1.94,;-3.85,-2.71,;-3.85,-4.25,;-2.52,-5.02,;-1.18,-4.25,;.15,-5.02,;1.49,-4.27,;2.82,-5.04,;4.16,-4.27,;5.63,-4.75,;6.53,-3.5,;5.63,-2.26,;4.16,-2.73,;-1.18,-2.71,;-3.86,.37,;-5.2,-.4,;-6.53,.37,;-6.53,1.91,;-5.2,2.68,;-5.21,4.22,;-3.86,1.91,;-2.53,2.68,;-2.53,4.22,)|

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCc3nccn3C)n2)c2nc[nH]c(=O)c2c1N |(-.51,5.95,;.81,5.16,;2.15,5.93,;3.48,5.16,;3.48,3.62,;4.63,2.59,;4,1.18,;2.47,1.34,;2.15,2.85,;.81,3.62,;-.52,2.85,;-.52,1.31,;-1.85,.54,;-1.88,-1,;-3.22,-1.77,;-3.22,-3.31,;-1.88,-4.08,;-.55,-3.31,;.77,-4.11,;2.09,-3.31,;3.42,-4.1,;3.58,-5.63,;5.08,-5.95,;5.85,-4.62,;4.82,-3.47,;5.14,-1.96,;-.55,-1.77,;-3.19,1.31,;-4.52,.54,;-5.85,1.31,;-5.85,2.85,;-4.52,3.62,;-4.52,5.16,;-3.19,2.85,;-1.85,3.62,;-1.85,5.16,)|

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCc3ncco3)n2)c2nc[nH]c(=O)c2c1N |(-.52,6.01,;.82,5.24,;2.15,6.01,;3.48,5.24,;3.48,3.7,;4.63,2.67,;4,1.27,;2.47,1.43,;2.15,2.93,;.82,3.7,;-.52,2.93,;-.52,1.39,;-1.85,.62,;-1.85,-.92,;-3.19,-1.69,;-3.19,-3.23,;-1.85,-4,;-.52,-3.23,;.82,-4,;2.15,-3.23,;3.48,-4,;3.48,-5.54,;4.95,-6.01,;5.85,-4.77,;4.95,-3.52,;-.52,-1.69,;-3.19,1.39,;-4.52,.62,;-5.85,1.39,;-5.85,2.93,;-4.52,3.7,;-4.52,5.24,;-3.19,2.93,;-1.85,3.7,;-1.85,5.24,)|

Nc1c(cc(C2CC2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nccs1

Nc1c(cc(-c2cccc(OCC(O)=O)c2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccc(OCc3ncco3)c2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(ccc2nc([nH]c(=O)c12)-c1ccncc1)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OC[C@H]3COCCO3)n2)c2nc[nH]c(=O)c2c1N |r,wD:20.21,(-.67,6.16,;.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;4.48,2.82,;3.85,1.41,;2.32,1.57,;2,3.08,;.67,3.85,;-.67,3.08,;-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-3.33,-3.08,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;3.33,-5.39,;4.67,-6.16,;6,-5.39,;6,-3.85,;4.67,-3.08,;-.67,-1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-6,3.08,;-4.67,3.85,;-4.67,5.39,;-3.33,3.08,;-2,3.85,;-2,5.39,)|

Cc1ccc2[nH]ncc2c1-c1cc(-c2nccs2)c2nc[nH]c(=O)c2c1N |(.09,4.65,;1.43,3.88,;2.76,4.65,;4.1,3.88,;4.1,2.34,;5.24,1.31,;4.61,-.1,;3.08,.06,;2.76,1.57,;1.43,2.34,;.09,1.57,;.09,.03,;-1.24,-.74,;-1.24,-2.28,;.01,-3.19,;-.47,-4.65,;-2.01,-4.65,;-2.48,-3.19,;-2.57,.03,;-3.91,-.74,;-5.24,.03,;-5.24,1.57,;-3.91,2.34,;-3.91,3.88,;-2.57,1.57,;-1.24,2.34,;-1.24,3.88,)|

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(F)n2)c2nc[nH]c(=O)c2c1N |(.09,5,;1.43,4.23,;2.76,5,;4.1,4.23,;4.1,2.69,;5.24,1.66,;4.61,.26,;3.08,.42,;2.76,1.93,;1.43,2.69,;.09,1.93,;.09,.38,;-1.24,-.38,;-1.24,-1.93,;-2.57,-2.69,;-2.57,-4.23,;-1.24,-5,;.09,-4.23,;1.43,-5,;.09,-2.69,;-2.57,.38,;-3.91,-.38,;-5.24,.38,;-5.24,1.93,;-3.91,2.69,;-3.91,4.23,;-2.57,1.93,;-1.24,2.69,;-1.24,4.23,)|

Nc1c(cc(-c2cnn(c2)C2COC2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OC[C@@H]3COCCO3)n2)c2nc[nH]c(=O)c2c1N |r,wU:20.21,(-.67,6.16,;.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;4.48,2.82,;3.85,1.41,;2.32,1.57,;2,3.08,;.67,3.85,;-.67,3.08,;-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-3.33,-3.08,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;3.33,-5.39,;4.67,-6.16,;6,-5.39,;6,-3.85,;4.67,-3.08,;-.67,-1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-6,3.08,;-4.67,3.85,;-4.67,5.39,;-3.33,3.08,;-2,3.85,;-2,5.39,)|

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OCc3ncccn3)n2)c2nc[nH]c(=O)c2c1N |(-.67,6.16,;.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;4.48,2.82,;3.85,1.41,;2.32,1.57,;2,3.08,;.67,3.85,;-.67,3.08,;-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-3.33,-3.08,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;3.33,-5.39,;4.67,-6.16,;6,-5.39,;6,-3.85,;4.67,-3.08,;-.67,-1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-6,3.08,;-4.67,3.85,;-4.67,5.39,;-3.33,3.08,;-2,3.85,;-2,5.39,)|

COCCOc1ccc(cn1)-c1nc2c(Br)cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12

Nc1c(cc(Br)c2nc([nH]c(=O)c12)-c1ccc(OCCN2CCCC2)nc1)-c1cccc2[nH]ncc12

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)C1=CCOCC1 |t:22|

Nc1c(cc(Br)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nc(cs2)C#N)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncccn1

Nc1c(ccc2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(-c2cccc(OC3CCOCC3)n2)c2nc[nH]c(=O)c2c1N |(,5,;1.33,4.23,;2.67,5,;4,4.23,;4,2.69,;5.15,1.66,;4.52,.26,;2.99,.42,;2.67,1.93,;1.33,2.69,;,1.93,;,.38,;-1.33,-.38,;-1.33,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-1.33,-5,;,-4.23,;1.33,-5,;2.67,-4.23,;4,-5,;5.33,-4.23,;5.33,-2.69,;4,-1.93,;2.67,-2.69,;,-2.69,;-2.67,.38,;-4,-.38,;-5.33,.38,;-5.33,1.93,;-4,2.69,;-4,4.23,;-2.67,1.93,;-1.33,2.69,;-1.33,4.23,)|

Nc1c(cc(-c2nccs2)c2nc([nH]c(=O)c12)-c1cccnc1)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nccs2)c2nc(CCc3cccnc3)[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ncccc1-c1nc2c(cc(c(N)c2c(=O)[nH]1)-c1cccc2[nH]ncc12)-c1nccs1

Nc1c(cc(-c2ncc(Cl)s2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ncc(s2)C(F)(F)F)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nc(Cl)cs2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccc(F)s2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccc(s2)C#N)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2nc(cs2)C(F)(F)F)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ncc(F)cn2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ccc(s1)-c1cc(c(N)c2c1nc[nH]c2=O)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ncccn2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccc(Cl)s2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cc(F)cc(F)c2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccc(cc2)C(F)(F)F)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccc(s2)C(F)(F)F)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(C2CC2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ncc(s2)C#N)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cn1ccc(n1)-c1cc(c(N)c2c1nc[nH]c2=O)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cnccn2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2cccnn2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Nc1c(cc(-c2ccns2)c2nc[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ccc2[nH]ncc2c1-c1cc(Br)c2nc[nH]c(=O)c2c1N |(.09,3.47,;1.43,2.69,;2.76,3.47,;4.1,2.69,;4.1,1.15,;5.24,.12,;4.61,-1.28,;3.08,-1.12,;2.76,.38,;1.43,1.15,;.09,.38,;.09,-1.15,;-1.24,-1.93,;-1.24,-3.47,;-2.57,-1.15,;-3.91,-1.93,;-5.24,-1.15,;-5.24,.38,;-3.91,1.15,;-3.91,2.69,;-2.57,.38,;-1.24,1.15,;-1.24,2.69,)|

Cc1ccc(O)c(C)c1-c1cc(C2CC2)c2nc([nH]c(=O)c2c1N)-c1ccncc1 |(2,4.13,;3.33,3.36,;4.67,4.13,;6,3.36,;6,1.82,;7.34,1.05,;4.67,1.05,;4.67,-.49,;3.33,1.82,;2,1.05,;2,-.49,;.67,-1.26,;.67,-2.8,;-.1,-4.13,;1.44,-4.13,;-.67,-.49,;-2,-1.26,;-3.33,-.49,;-3.33,1.05,;-2,1.82,;-2,3.36,;-.67,1.05,;.67,1.82,;.67,3.36,;-4.67,-1.26,;-6,-.49,;-7.34,-1.26,;-7.34,-2.8,;-6,-3.57,;-4.67,-2.8,)|

Cc1ccc(O)c(C)c1-c1cc(-c2ccn(n2)C2CC2)c2nc([nH]c(=O)c2c1N)-c1ccncc1 |(2,6.09,;3.33,5.32,;4.67,6.09,;6,5.32,;6,3.78,;7.34,3.01,;4.67,3.01,;4.67,1.47,;3.33,3.78,;2,3.01,;2,1.47,;.67,.7,;.67,-.84,;1.91,-1.75,;1.44,-3.21,;-.1,-3.21,;-.58,-1.75,;-.87,-4.55,;-2.21,-5.32,;-.87,-6.09,;-.67,1.47,;-2,.7,;-3.33,1.47,;-3.33,3.01,;-2,3.78,;-2,5.32,;-.67,3.01,;.67,3.78,;.67,5.32,;-4.67,.7,;-6,1.47,;-7.34,.7,;-7.34,-.84,;-6,-1.61,;-4.67,-.84,)|

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ccccn1

Cc1ccc(O)cc1-c1cc(-c2ccccn2)c2nc[nH]c(=O)c2c1N

Cc1ccc(O)cc1-c1cc(Br)c2nc[nH]c(=O)c2c1N

Cc1ccc(O)c(C)c1-c1cc(c2CNC(=O)c2c1N)-c1nccs1 |(-.15,4.65,;1.18,3.88,;2.52,4.65,;3.85,3.88,;3.85,2.34,;5.19,1.57,;2.52,1.57,;2.52,.03,;1.18,2.34,;-.15,1.57,;-.15,.03,;-1.48,-.74,;-2.82,.03,;-4.28,-.45,;-5.19,.8,;-4.28,2.05,;-5.05,3.38,;-2.82,1.57,;-1.48,2.34,;-1.48,3.88,;-1.48,-2.28,;-.24,-3.19,;-.71,-4.65,;-2.25,-4.65,;-2.73,-3.19,)|

Cc1ccc(O)c(C)c1-c1cc(c2CNC(=O)c2c1N)-c1ccc(F)cn1 |(-.15,5.78,;1.18,5,;2.52,5.78,;3.85,5,;3.85,3.47,;5.19,2.69,;2.52,2.69,;2.52,1.15,;1.18,3.47,;-.15,2.69,;-.15,1.15,;-1.48,.38,;-2.82,1.15,;-4.28,.68,;-5.19,1.93,;-4.28,3.17,;-5.05,4.5,;-2.82,2.69,;-1.48,3.47,;-1.48,5,;-1.48,-1.15,;-2.82,-1.93,;-2.82,-3.47,;-1.48,-4.23,;-1.48,-5.78,;-.15,-3.47,;-.15,-1.93,)|

Cc1ccc(O)c(C)c1-c1cc(Br)c2CNC(=O)c2c1N |(-.15,3.47,;1.18,2.69,;2.52,3.47,;3.85,2.69,;3.85,1.15,;5.19,.38,;2.52,.38,;2.52,-1.15,;1.18,1.15,;-.15,.38,;-.15,-1.15,;-1.48,-1.93,;-1.48,-3.47,;-2.82,-1.15,;-4.28,-1.63,;-5.19,-.38,;-4.28,.86,;-5.05,2.19,;-2.82,.38,;-1.48,1.15,;-1.48,2.69,)|

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(NC(=O)C2CC2)s1

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(CN2CCOCC2)s1

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(NC(=O)C2CCOCC2)cs1

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(cs1)C(=O)NCCO

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(CN2CCOCC2)cs1

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(s1)C(=O)NCCO

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(s1)C(O)=O

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(cs1)C(F)(F)F

CNC(=O)c1cnc(s1)-c1cc(c(N)c2C(=O)NCc12)-c1cc(O)ccc1C

CN(C)C(=O)c1csc(n1)-c1cc(c(N)c2C(=O)NCc12)-c1cc(O)ccc1C

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(s1)C(=O)N1CCOCC1

CC(C)NC(=O)c1cnc(s1)-c1cc(c(N)c2C(=O)NCc12)-c1cc(O)ccc1C

CN(C)C(=O)c1cnc(s1)-c1cc(c(N)c2C(=O)NCc12)-c1cc(O)ccc1C

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(s1)C#N

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ncc(Cl)s1

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(cs1)C(=O)N1CCOCC1

CC(C)NC(=O)c1csc(n1)-c1cc(c(N)c2C(=O)NCc12)-c1cc(O)ccc1C

CNC(=O)c1csc(n1)-c1cc(c(N)c2C(=O)NCc12)-c1cc(O)ccc1C

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(cs1)C#N

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(Cl)cs1

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1nc(cs1)C(O)=O

Cc1ccc(O)cc1-c1cc(c2CNC(=O)c2c1N)-c1ccccc1

Cc1ccc(O)cc1-c1cc(-c2nccs2)c2cc[nH]c(=O)c2c1N

Nc1c(cc(-c2nccs2)c2nc(Oc3ccccc3)[nH]c(=O)c12)-c1cccc2[nH]ncc12

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C#CCc1ccccc1 |(2.64,2.02,;2.96,3.53,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;.99,7.1,;1.82,4.56,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;-1.66,-.05,;-.12,-.05,;.65,1.29,;-.12,2.62,;-2.43,-1.38,;-3.2,-2.71,;-3.97,-4.05,;-3.2,-5.38,;-3.97,-6.72,;-3.2,-8.05,;-1.66,-8.05,;-.89,-6.72,;-1.66,-5.38,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(CCC3CCCN3)cnc12 |(2.68,1.27,;2.97,2.78,;4.43,3.28,;4.73,4.79,;3.58,5.8,;3.89,7.31,;2.12,5.31,;.96,6.33,;1.82,3.8,;.37,3.27,;-.88,4.18,;-.89,5.72,;-2.12,3.27,;-3.58,3.76,;-4.73,2.74,;-3.89,5.27,;-1.65,1.81,;-2.42,.47,;-1.65,-.86,;-2.41,-2.2,;-1.65,-3.54,;-2.42,-4.87,;-1.8,-6.28,;-2.94,-7.31,;-4.28,-6.54,;-3.96,-5.03,;-.11,-.86,;.66,.47,;-.11,1.81,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C#CC1CCCN1 |(3.2,1.25,;3.49,2.77,;4.96,3.24,;5.28,4.74,;4.14,5.78,;4.5,7.27,;2.67,5.3,;1.56,6.37,;2.35,3.8,;.9,3.3,;-.35,4.2,;-.36,5.74,;-1.6,3.3,;-3.06,3.78,;-4.21,2.76,;-3.37,5.29,;-1.12,1.83,;-1.89,.5,;-1.12,-.84,;.42,-.84,;1.19,.5,;.42,1.83,;-1.89,-2.17,;-2.65,-3.51,;-3.43,-4.84,;-2.8,-6.24,;-3.95,-7.27,;-5.28,-6.5,;-4.96,-5,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(Cl)ccc12 |(2.67,-1.27,;2.97,.24,;4.43,.74,;4.72,2.25,;3.56,3.26,;3.91,4.76,;2.1,2.76,;1.81,1.25,;.37,.71,;-.88,1.62,;-.88,3.16,;-2.13,.71,;-3.6,1.16,;-4.72,.11,;-3.95,2.66,;-1.65,-.75,;-2.42,-2.08,;-1.65,-3.42,;-2.4,-4.76,;-.11,-3.42,;.66,-2.08,;-.11,-.75,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1cn[nH]c1 |(2.71,-.05,;3.02,1.46,;4.46,2.01,;4.7,3.53,;3.51,4.5,;3.85,6,;2.07,3.95,;1.83,2.43,;.38,1.89,;-.86,2.8,;-.86,4.34,;-2.11,1.89,;-3.58,2.34,;-4.7,1.28,;-3.93,3.84,;-1.63,.43,;-2.4,-.91,;-1.63,-2.24,;-.09,-2.24,;.68,-.91,;-.09,.43,;-2.42,-3.56,;-3.95,-3.72,;-4.27,-5.23,;-2.94,-6,;-1.79,-4.97,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)C1=CCCC1 |t:24,(2.7,-.05,;2.99,1.46,;4.44,1.98,;4.72,3.49,;3.54,4.49,;3.9,5.99,;2.09,3.97,;1.82,2.46,;.38,1.9,;-.86,2.8,;-.84,4.34,;-2.11,1.9,;-3.58,2.37,;-4.72,1.33,;-3.9,3.87,;-1.63,.43,;-2.4,-.9,;-1.63,-2.23,;-.09,-2.23,;.68,-.9,;-.09,.43,;-2.43,-3.55,;-3.97,-3.71,;-4.29,-5.22,;-2.95,-5.99,;-1.81,-4.96,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccc(nc1)N1CCOCC1 |(3.85,2.07,;4.13,3.58,;5.58,4.09,;5.86,5.61,;4.69,6.61,;5.05,8.1,;3.24,6.09,;2.96,4.58,;1.51,4.05,;.26,4.96,;.26,6.5,;-.98,4.05,;-2.46,4.49,;-3.58,3.44,;-2.81,5.99,;-.51,2.59,;-1.28,1.25,;-.51,-.08,;1.03,-.08,;1.8,1.25,;1.03,2.59,;-1.26,-1.42,;-2.8,-1.42,;-3.57,-2.76,;-2.8,-4.09,;-1.26,-4.09,;-.49,-2.76,;-3.55,-5.44,;-5.09,-5.44,;-5.86,-6.77,;-5.09,-8.1,;-3.55,-8.1,;-2.78,-6.77,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccc(N)nc1 |(2.69,.72,;2.98,2.23,;4.44,2.73,;4.74,4.24,;3.58,5.26,;3.94,6.75,;2.12,4.76,;1.82,3.25,;.37,2.73,;-.87,3.64,;-.87,5.18,;-2.12,2.73,;-3.57,3.23,;-3.87,4.74,;-4.74,2.22,;-1.64,1.27,;-2.41,-.07,;-1.64,-1.4,;-.1,-1.4,;.67,-.07,;-.1,1.27,;-2.41,-2.74,;-3.95,-2.74,;-4.72,-4.07,;-3.95,-5.4,;-4.7,-6.75,;-2.41,-5.4,;-1.64,-4.07,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1cccc(c1)C(O)=O |(2.69,1.39,;2.98,2.9,;4.44,3.39,;4.74,4.9,;3.59,5.92,;3.89,7.43,;2.13,5.43,;1.83,3.92,;.38,3.38,;-.86,4.28,;-.88,5.82,;-2.11,3.38,;-3.55,3.93,;-3.79,5.45,;-4.74,2.96,;-1.63,1.91,;-2.4,.58,;-1.63,-.75,;-.09,-.75,;.68,.58,;-.09,1.91,;-2.39,-2.1,;-3.93,-2.1,;-4.7,-3.43,;-3.93,-4.76,;-2.39,-4.76,;-1.62,-3.43,;-1.66,-6.12,;-2.48,-7.43,;-.12,-6.12,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccc(cc1)C(O)=O |(3.43,1.39,;3.69,2.91,;5.15,3.4,;5.45,4.91,;4.29,5.93,;4.6,7.44,;2.83,5.43,;2.53,3.92,;1.1,3.37,;-.15,4.28,;-.16,5.82,;-1.4,3.37,;-2.84,3.9,;-3.11,5.41,;-4.02,2.9,;-.92,1.91,;-1.69,.57,;-.92,-.76,;.62,-.76,;1.39,.57,;.62,1.91,;-1.67,-2.11,;-3.21,-2.11,;-3.98,-3.44,;-3.21,-4.77,;-1.67,-4.77,;-.9,-3.44,;-3.91,-6.15,;-3.07,-7.44,;-5.45,-6.15,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1cc[nH]n1 |(2.69,-.04,;2.98,1.47,;4.44,1.96,;4.74,3.47,;3.59,4.49,;3.93,5.99,;2.13,4,;1.82,2.49,;.39,1.93,;-.86,2.84,;-.86,4.38,;-2.11,1.93,;-3.54,2.49,;-3.78,4.01,;-4.74,1.52,;-1.63,.47,;-2.4,-.86,;-1.63,-2.2,;-.09,-2.2,;.68,-.86,;-.09,.47,;-2.36,-3.55,;-3.89,-3.71,;-4.21,-5.22,;-2.88,-5.99,;-1.74,-4.96,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccn(C)n1 |(2.73,.72,;2.99,2.24,;4.45,2.74,;4.74,4.25,;3.57,5.26,;3.88,6.77,;2.12,4.76,;1.83,3.25,;.39,2.69,;-.86,3.6,;-.86,5.14,;-2.1,2.69,;-3.53,3.25,;-3.76,4.78,;-4.74,2.29,;-1.63,1.23,;-2.4,-.11,;-1.63,-1.44,;-.09,-1.44,;.68,-.11,;-.09,1.23,;-2.33,-2.81,;-3.87,-2.97,;-4.19,-4.47,;-2.85,-5.24,;-2.66,-6.77,;-1.71,-4.21,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccc(cc1)N1CCN(CCO)CC1 |(3.89,4.1,;4.13,5.62,;5.58,6.15,;5.84,7.67,;4.66,8.66,;4.99,10.16,;3.21,8.13,;2.95,6.61,;1.52,6.02,;.28,6.93,;.32,8.47,;-.97,6.02,;-2.42,6.54,;-2.69,8.06,;-3.59,5.55,;-.49,4.56,;-1.26,3.23,;-.49,1.89,;1.05,1.89,;1.82,3.23,;1.05,4.56,;-1.24,.54,;-.47,-.79,;-1.24,-2.12,;-2.78,-2.12,;-3.55,-.79,;-2.78,.54,;-3.51,-3.48,;-5.05,-3.48,;-5.82,-4.81,;-5.05,-6.15,;-5.8,-7.49,;-5.05,-8.84,;-5.84,-10.16,;-3.51,-6.15,;-2.74,-4.81,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1cccc(c1)C#N |(2.7,1.38,;3,2.89,;4.45,3.4,;4.74,4.91,;3.57,5.91,;3.92,7.41,;2.12,5.4,;1.83,3.89,;.39,3.36,;-.86,4.27,;-.89,5.81,;-2.11,3.36,;-3.55,3.89,;-3.82,5.41,;-4.73,2.9,;-1.63,1.9,;-2.4,.56,;-1.63,-.77,;-.09,-.77,;.68,.56,;-.09,1.9,;-2.43,-2.09,;-3.97,-2.09,;-4.74,-3.42,;-3.97,-4.76,;-2.43,-4.76,;-1.66,-3.42,;-1.65,-6.09,;-.87,-7.41,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccc(F)c(Cl)c1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-4.74,-6.72,;-2.43,-5.38,;-1.66,-6.72,;-1.66,-4.05,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)C#CCN1CCOCC1 |(2.64,2.02,;2.96,3.53,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;1.82,4.56,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;-1.66,-.05,;-.12,-.05,;.65,1.29,;-.12,2.62,;-2.43,-1.38,;-3.2,-2.71,;-3.97,-4.05,;-3.2,-5.38,;-3.97,-6.72,;-3.2,-8.05,;-1.66,-8.05,;-.89,-6.72,;-1.66,-5.38,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)C#CCC(C)(C)O |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-.12,-.71,;.65,.62,;-.12,1.95,;-2.43,-2.05,;-3.2,-3.38,;-3.97,-4.71,;-3.2,-6.05,;-3.97,-7.38,;-1.66,-6.05,;-2.43,-7.38,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(CCCN3CCOCC3)ccc12 |(2.64,2.02,;2.96,3.53,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;1.82,4.56,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;-1.66,-.05,;-2.43,-1.38,;-1.66,-2.71,;-2.43,-4.05,;-1.66,-5.38,;-2.43,-6.72,;-1.66,-8.05,;-.12,-8.05,;.65,-6.72,;-.12,-5.38,;-.12,-.05,;.65,1.29,;-.12,2.62,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(CCCC(C)(C)O)ccc12 |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-1.66,-6.05,;-2.43,-7.38,;-.12,-6.05,;-.89,-7.38,;-.12,-.71,;.65,.62,;-.12,1.95,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1cccc(CC(O)=O)c1 |(2.64,2.02,;2.96,3.53,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;1.82,4.56,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;-1.66,-.05,;-.12,-.05,;.65,1.29,;-.12,2.62,;-2.43,-1.38,;-3.97,-1.38,;-4.74,-2.71,;-3.97,-4.05,;-2.43,-4.05,;-1.66,-5.38,;-2.43,-6.72,;-1.66,-8.05,;-3.97,-6.72,;-1.66,-2.71,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccc(CC(O)=O)cc1 |(2.64,2.02,;2.96,3.53,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;1.82,4.56,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;-1.66,-.05,;-.12,-.05,;.65,1.29,;-.12,2.62,;-2.43,-1.38,;-3.97,-1.38,;-4.74,-2.71,;-3.97,-4.05,;-4.74,-5.38,;-3.97,-6.72,;-4.74,-8.05,;-2.43,-6.72,;-2.43,-4.05,;-1.66,-2.71,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ccnc(N)c1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-2.43,-5.38,;-1.66,-6.72,;-1.66,-4.05,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1ncccn1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1nccs1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)-c1cccc(F)n1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-2.43,-5.38,;-1.66,-6.72,;-1.66,-4.05,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)C1=CCCN(C1)C(=O)OC(C)(C)C |t:24,(2.64,2.69,;2.96,4.2,;4.43,4.67,;4.75,6.18,;3.6,7.21,;3.92,8.72,;2.14,6.73,;1.82,5.23,;.35,4.75,;-.89,5.66,;-.89,7.2,;-2.14,4.75,;-3.6,5.23,;-3.92,6.73,;-4.75,4.2,;-1.66,3.29,;-2.43,1.95,;-1.66,.62,;-.12,.62,;.65,1.95,;-.12,3.29,;-2.43,-.71,;-3.97,-.71,;-4.74,-2.05,;-3.97,-3.38,;-2.43,-3.38,;-1.66,-2.05,;-1.66,-4.72,;-.12,-4.72,;-2.43,-6.05,;-1.66,-7.38,;-2.43,-8.72,;-.12,-7.38,;-.89,-8.72,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(ccc12)C1=CCCNC1 |t:24,(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-3.97,-3.38,;-4.74,-4.72,;-3.97,-6.05,;-2.43,-6.05,;-1.66,-4.72,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |(3.88,-2.75,;4.17,-1.55,;5.65,-1.12,;6.01,.38,;4.9,1.44,;5.19,2.64,;3.42,1.01,;2.53,1.86,;3.06,-.49,;1.55,-.81,;.93,-2.21,;1.54,-3.28,;-.61,-2.05,;-1.63,-3.2,;-2.84,-2.94,;-1.25,-4.37,;-.92,-.55,;-2.26,.22,;-2.26,1.76,;-.92,2.53,;.41,1.76,;.41,.22,;-3.59,2.53,;-3.74,4.05,;-5.24,4.37,;-6.01,3.04,;-4.98,1.89,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |c:7,t:3|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(-c3nccs3)c(C)nc12 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,;-.12,-2.16,;.65,-3.5,;.65,-.83,;-.12,.5,)|

Cc1nc(sc1C)-c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-2.32,-6.7,;-2.48,-5.17,;-1.33,-4.14,;-1.96,-2.73,;-3.49,-2.89,;-3.81,-4.4,;-5.22,-5.02,;-1.19,-1.4,;.35,-1.4,;1.12,-.06,;.35,1.27,;.83,2.74,;-.42,3.64,;-.42,5.18,;-1.67,2.74,;-3.13,3.21,;-3.45,4.72,;-4.28,2.18,;-1.19,1.27,;-1.96,-.06,;2.29,3.21,;3.43,2.18,;3.11,.67,;4.9,2.66,;5.22,4.16,;4.07,5.19,;4.39,6.7,;2.61,4.72,;1.47,5.75,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(-c3nccs3)c(Br)nc12 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,;-.12,-2.16,;.65,-3.5,;.65,-.83,;-.12,.5,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccccn1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-3.97,-3.38,;-4.74,-4.72,;-3.97,-6.05,;-2.43,-6.05,;-1.66,-4.72,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccnc(c1)C(F)(F)F |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;.99,6.43,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-.12,-.71,;.65,.62,;-.12,1.95,;-2.43,-2.05,;-3.97,-2.05,;-4.74,-3.38,;-3.97,-4.72,;-2.43,-4.72,;-1.66,-3.38,;-1.66,-6.05,;-2.43,-7.38,;-.12,-6.05,;-.89,-7.38,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1cc(ccn1)C(F)(F)F |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;.99,6.43,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-.12,-.71,;.65,.62,;-.12,1.95,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-3.97,-4.72,;-4.74,-3.38,;-3.97,-2.05,;-1.66,-6.05,;-2.43,-7.38,;-.12,-6.05,;-.89,-7.38,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1cncs1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-1.81,-4.9,;-2.95,-5.93,;-4.28,-5.16,;-3.96,-3.66,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1cnccn1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-3.97,-3.38,;-4.74,-4.72,;-3.97,-6.05,;-2.43,-6.05,;-1.66,-4.72,)|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1cnccn1 |r,c:4,7|

C[C@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1cnccn1 |r,c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccns1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-1.81,-4.9,;-2.95,-5.93,;-4.28,-5.16,;-3.96,-3.66,)|

Cc1c(O)ccc(Cl)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |(.99,4.98,;2.14,3.95,;3.6,4.43,;3.92,5.93,;4.75,3.4,;4.43,1.89,;2.96,1.41,;2.64,-.09,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |(4.54,-2.98,;4.83,-1.78,;6.31,-1.35,;6.67,.15,;5.56,1.21,;5.85,2.41,;4.08,.78,;3.19,1.63,;3.72,-.72,;2.21,-1.04,;1.59,-2.45,;2.2,-3.52,;.05,-2.29,;-.97,-3.43,;-2.18,-3.18,;-.59,-4.61,;-.27,-.78,;-1.6,-.01,;-1.6,1.53,;-.27,2.3,;1.07,1.53,;1.07,-.01,;-2.94,2.3,;-4.27,1.53,;-5.6,2.29,;-5.6,3.83,;-6.67,4.45,;-4.27,4.61,;-2.94,3.84,;-1.87,4.46,)|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |r,c:4,7|

C[C@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |r,c:7,t:3|

CNC(=O)C1CCN(CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-3.97,-8.05,;-3.2,-6.72,;-3.97,-5.38,;-5.51,-5.38,;-3.2,-4.05,;-1.66,-4.05,;-.89,-2.71,;-1.66,-1.38,;-3.2,-1.38,;-3.97,-2.71,;-.89,-.05,;.65,-.05,;1.42,1.29,;.65,2.62,;1.12,4.08,;-.12,4.99,;-.12,6.53,;-1.37,4.08,;-2.84,4.56,;-3.16,6.07,;-3.98,3.53,;-.89,2.62,;-1.66,1.29,;2.59,4.56,;3.73,3.53,;3.41,2.02,;5.19,4.01,;5.51,5.51,;4.37,6.54,;4.69,8.05,;2.91,6.07,;1.76,7.1,)|

CNC(=O)C1CCN(CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)C1=C(C)C(O)=CCC1C |c:26,30|

CNC(=O)C1CCN(CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)C1=C(C)C=C[C@@H](O)[C@@H]1C |r,c:26,29|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccc(Cl)cn1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-4.74,-6.72,;-2.43,-5.38,;-1.66,-4.05,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccc(Cl)cn1 |c:7,t:3|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccc(Cl)cn1 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCC(C)(O)CC1 |(2.92,.79,;3.24,2.3,;4.71,2.78,;5.03,4.28,;3.88,5.31,;4.2,6.82,;2.42,4.84,;1.27,5.87,;2.1,3.33,;.63,2.85,;-.61,3.76,;-.61,5.3,;-1.86,2.85,;-3.32,3.33,;-3.64,4.84,;-4.47,2.3,;-1.38,1.39,;-2.15,.06,;-1.38,-1.28,;.16,-1.28,;.93,.06,;.16,1.39,;-2.15,-2.61,;-1.38,-3.95,;-2.15,-5.28,;-3.69,-5.28,;-3.69,-6.82,;-5.03,-6.05,;-4.46,-3.95,;-3.69,-2.61,)|

CN1CCN(CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-4.74,-6.72,;-3.97,-5.38,;-2.43,-5.38,;-1.66,-4.05,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;1.82,3.23,;2.96,2.2,;2.64,.69,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCOCC1 |(4,-2.98,;4.3,-1.78,;5.77,-1.35,;6.14,.15,;5.02,1.21,;5.32,2.41,;3.55,.78,;2.65,1.63,;3.19,-.72,;1.68,-1.04,;1.05,-2.45,;1.67,-3.52,;-.48,-2.29,;-1.51,-3.43,;-2.71,-3.18,;-1.12,-4.61,;-.8,-.78,;-2.13,-.01,;-2.13,1.53,;-.8,2.3,;.53,1.53,;.53,-.01,;-3.47,2.3,;-4.8,1.53,;-6.14,2.29,;-6.14,3.83,;-4.81,4.61,;-3.47,3.84,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)N1CCOCC1 |c:7,t:3|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)N1CCOCC1 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccncn1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-3.97,-3.38,;-4.74,-4.72,;-3.97,-6.05,;-2.43,-6.05,;-1.66,-4.72,)|

CN(C)C(=O)C1CCC(=CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |c:8,(-1.66,-6.72,;-3.2,-6.72,;-3.97,-8.05,;-3.97,-5.38,;-5.51,-5.38,;-3.2,-4.05,;-1.66,-4.05,;-.89,-2.71,;-1.66,-1.38,;-3.2,-1.38,;-3.97,-2.71,;-.89,-.05,;.65,-.05,;1.42,1.29,;.65,2.62,;1.12,4.08,;-.12,4.99,;-.12,6.53,;-1.37,4.08,;-2.84,4.56,;-3.16,6.07,;-3.98,3.53,;-.89,2.62,;-1.66,1.29,;2.59,4.56,;3.73,3.53,;3.41,2.02,;5.19,4.01,;5.51,5.51,;4.37,6.54,;4.69,8.05,;2.91,6.07,;1.76,7.1,)|

CC1CN(CCO1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-1.66,-6.72,;-2.43,-5.38,;-1.66,-4.05,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;1.82,3.23,;2.96,2.2,;2.64,.69,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncco1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,)|

Cc1ccc(nc1)-c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-4.74,-6.72,;-3.97,-5.38,;-4.74,-4.05,;-3.97,-2.71,;-2.43,-2.71,;-1.66,-4.05,;-2.43,-5.38,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;1.82,3.23,;2.96,2.2,;2.64,.69,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,)|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccc(C)cn1 |r,c:4,7|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccc(C)cn1 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccc(F)cn1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-4.74,-6.72,;-2.43,-5.38,;-1.66,-4.05,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1c[nH]cn1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCNC(=O)C1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-3.97,-2.71,;-4.74,-4.05,;-3.97,-5.38,;-2.43,-5.38,;-1.66,-6.72,;-1.66,-4.05,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCNCC1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCC(F)(F)CC1 |(3,.79,;3.32,2.3,;4.78,2.78,;5.1,4.28,;3.96,5.31,;4.28,6.82,;2.49,4.84,;1.35,5.87,;2.17,3.33,;.71,2.85,;-.54,3.76,;-.54,5.3,;-1.78,2.85,;-3.25,3.33,;-3.57,4.84,;-4.39,2.3,;-1.31,1.39,;-2.08,.06,;-1.31,-1.28,;.23,-1.28,;1,.06,;.23,1.39,;-2.08,-2.61,;-1.31,-3.95,;-2.08,-5.28,;-3.62,-5.28,;-3.62,-6.82,;-5.1,-5.68,;-4.39,-3.95,;-3.62,-2.61,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCSCC1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)N1CCSCC1 |r,c:4,7|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)N1CCSCC1 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccn(C)n1 |(2.64,.67,;2.96,2.18,;4.43,2.66,;4.75,4.16,;3.6,5.19,;3.92,6.7,;2.14,4.72,;.99,5.75,;1.82,3.21,;.35,2.74,;-.89,3.64,;-.89,5.18,;-2.14,2.74,;-3.6,3.21,;-3.92,4.72,;-4.75,2.18,;-1.66,1.27,;-2.43,-.06,;-1.66,-1.4,;-.12,-1.4,;.65,-.06,;-.12,1.27,;-2.43,-2.73,;-3.96,-2.89,;-4.28,-4.4,;-2.95,-5.17,;-2.79,-6.7,;-1.81,-4.14,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCC(O)CC1 |(2.64,.69,;2.96,2.2,;4.43,2.67,;4.75,4.18,;3.6,5.21,;3.92,6.72,;2.14,4.73,;.99,5.76,;1.82,3.23,;.35,2.75,;-.89,3.66,;-.89,5.2,;-2.14,2.75,;-3.6,3.23,;-3.92,4.73,;-4.75,2.2,;-1.66,1.29,;-2.43,-.05,;-1.66,-1.38,;-.12,-1.38,;.65,-.05,;-.12,1.29,;-2.43,-2.71,;-1.66,-4.05,;-2.43,-5.38,;-3.97,-5.38,;-4.74,-6.72,;-4.74,-4.05,;-3.97,-2.71,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCC(CC1)N1CCOCC1 |(3.79,2.02,;4.12,3.53,;5.58,4.01,;5.9,5.51,;4.76,6.54,;5.08,8.05,;3.29,6.07,;2.15,7.1,;2.97,4.56,;1.51,4.08,;.26,4.99,;.26,6.53,;-.99,4.08,;-2.45,4.56,;-2.77,6.07,;-3.59,3.53,;-.51,2.62,;-1.28,1.29,;-.51,-.05,;1.03,-.05,;1.8,1.29,;1.03,2.62,;-1.28,-1.38,;-.51,-2.71,;-1.28,-4.05,;-2.82,-4.05,;-3.59,-2.71,;-2.82,-1.38,;-3.59,-5.38,;-5.13,-5.38,;-5.9,-6.72,;-5.13,-8.05,;-3.59,-8.05,;-2.82,-6.72,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCS(=O)(=O)CC1 |(3,.77,;3.32,2.27,;4.78,2.75,;5.1,4.26,;3.96,5.29,;4.28,6.79,;2.49,4.81,;1.35,5.84,;2.17,3.3,;.71,2.83,;-.54,3.73,;-.54,5.27,;-1.78,2.83,;-3.25,3.3,;-3.57,4.81,;-4.39,2.27,;-1.31,1.36,;-2.08,.03,;-1.31,-1.3,;.23,-1.3,;1,.03,;.23,1.36,;-2.08,-2.64,;-1.31,-3.97,;-2.08,-5.31,;-3.62,-5.31,;-5.1,-5.7,;-3.22,-6.79,;-4.39,-3.97,;-3.62,-2.64,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1cn(C)cn1 |(2.64,.67,;2.96,2.18,;4.43,2.66,;4.75,4.16,;3.6,5.19,;3.92,6.7,;2.14,4.72,;.99,5.75,;1.82,3.21,;.35,2.74,;-.89,3.64,;-.89,5.18,;-2.14,2.74,;-3.6,3.21,;-3.92,4.72,;-4.75,2.18,;-1.66,1.27,;-2.43,-.06,;-1.66,-1.4,;-.12,-1.4,;.65,-.06,;-.12,1.27,;-2.43,-2.73,;-1.81,-4.14,;-2.95,-5.17,;-2.79,-6.7,;-4.28,-4.4,;-3.96,-2.89,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccn[nH]1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-1.81,-4.9,;-2.95,-5.93,;-4.28,-5.16,;-3.96,-3.66,)|

CNC(=O)[C@H]1CCCN(C1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |r,wU:4.3,(-1.66,-8.05,;-2.43,-6.72,;-1.66,-5.38,;-.12,-5.38,;-2.43,-4.05,;-3.97,-4.05,;-4.74,-2.71,;-3.97,-1.38,;-2.43,-1.38,;-1.66,-2.71,;-1.66,-.05,;-.12,-.05,;.65,1.29,;-.12,2.62,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;1.82,4.56,;2.96,3.53,;2.64,2.02,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;.99,7.1,)|

CNC(=O)[C@@H]1CCCN(C1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |r,wD:4.3,(-1.66,-8.05,;-2.43,-6.72,;-1.66,-5.38,;-.12,-5.38,;-2.43,-4.05,;-3.97,-4.05,;-4.74,-2.71,;-3.97,-1.38,;-2.43,-1.38,;-1.66,-2.71,;-1.66,-.05,;-.12,-.05,;.65,1.29,;-.12,2.62,;.35,4.08,;-.89,4.99,;-.89,6.53,;-2.14,4.08,;-3.6,4.56,;-3.92,6.07,;-4.75,3.53,;-1.66,2.62,;-2.43,1.29,;1.82,4.56,;2.96,3.53,;2.64,2.02,;4.43,4.01,;4.75,5.51,;3.6,6.54,;3.92,8.05,;2.14,6.07,;.99,7.1,)|

CN(C)C(=O)C1CCN(CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-3.97,-8.05,;-3.2,-6.72,;-1.66,-6.72,;-3.97,-5.38,;-5.51,-5.38,;-3.2,-4.05,;-1.66,-4.05,;-.89,-2.71,;-1.66,-1.38,;-3.2,-1.38,;-3.97,-2.71,;-.89,-.05,;.65,-.05,;1.42,1.29,;.65,2.62,;1.12,4.08,;-.12,4.99,;-.12,6.53,;-1.37,4.08,;-2.84,4.56,;-3.16,6.07,;-3.98,3.53,;-.89,2.62,;-1.66,1.29,;2.59,4.56,;3.73,3.53,;3.41,2.02,;5.19,4.01,;5.51,5.51,;4.37,6.54,;4.69,8.05,;2.91,6.07,;1.76,7.1,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCCCC1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CCCCC1 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C1CCCCC1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CCCCC1 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CCCC1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-3.96,-3.66,;-4.28,-5.16,;-2.95,-5.93,;-1.81,-4.9,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C1=CCCCC1 |t:25,(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

CC(=O)N1CCN(CC1)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-3.2,-7.38,;-3.97,-6.05,;-5.51,-6.05,;-3.2,-4.72,;-1.66,-4.72,;-.89,-3.38,;-1.66,-2.05,;-3.2,-2.05,;-3.97,-3.38,;-.89,-.71,;.65,-.71,;1.42,.62,;.65,1.95,;1.12,3.42,;-.12,4.32,;-.12,5.86,;-1.37,3.42,;-2.84,3.89,;-3.16,5.4,;-3.98,2.86,;-.89,1.95,;-1.66,.62,;2.59,3.89,;3.73,2.86,;3.41,1.36,;5.19,3.34,;5.51,4.85,;4.37,5.88,;4.69,7.38,;2.91,5.4,;1.76,6.43,)|

CCN(CC)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-2.43,-6.05,;-1.66,-4.72,;-2.43,-3.38,;-3.97,-3.38,;-4.74,-4.72,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;1.82,2.56,;2.96,1.53,;2.64,.02,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,)|

CCN(CC)c1cnc2n(c(N)c(C(N)=O)c2n1)C1=C(C)C(O)=CCC1C |c:20,24|

CCN(CC)c1cnc2n(c(N)c(C(N)=O)c2n1)C1=C(C)C=CC(O)C1C |c:20,23|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccn1C |(1.48,-.05,.07;1.65,.76,.07;2.44,1.01,.07;2.61,1.82,.07;2,2.37,.07;2.17,3.18,.07;1.21,2.12,.07;.6,2.67,.07;1.04,1.31,-.07;.26,1.05,.07;-.41,1.54,.07;-.41,2.36,.07;-1.08,1.05,.07;-1.86,1.31,.07;-2.04,2.12,.07;-2.48,.76,.07;-.82,.27,.07;-1.24,-.44,.07;-.82,-1.16,.07;0,-1.16,.07;.41,-.44,.07;0,.27,.07;-1.24,-1.87,.07;-.9,-2.63,.07;-1.51,-3.18,.07;-2.23,-2.77,.07;-2.06,-1.96,.07;-2.61,-1.35,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CC2CCC(C1)O2 |THB:18:22:25.26:29,(1.49,.18,.07;1.66,.99,.07;2.44,1.25,.07;2.62,2.05,.07;2,2.6,.07;2.17,3.41,.07;1.22,2.35,.07;.6,2.9,.07;1.05,1.54,-.07;.26,1.29,.07;-.41,1.77,.07;-.41,2.6,.07;-1.07,1.29,.07;-1.86,1.54,.07;-2.03,2.35,.07;-2.47,.99,.07;-.82,.5,.07;-1.23,-.21,.07;-.82,-.93,.07;.01,-.93,.07;.42,-.21,.07;.01,.5,.07;-1.23,-1.64,.07;-2.05,-1.58,.07;-2.62,-2.18,.07;-2.49,-3,.07;-1.78,-3.41,.07;-1.01,-3.11,.07;-.77,-2.32,.07;-1.56,-2.18,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)N1CC2CCC(C1)O2 |c:7,t:3,THB:18:22:25.26:29|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C1CC1 |(3.4,-2.47,;3.69,-1.27,;5.17,-.84,;5.53,.66,;4.42,1.72,;4.71,2.92,;2.94,1.29,;2.05,2.14,;2.58,-.21,;1.07,-.53,;.45,-1.94,;1.06,-3.01,;-1.09,-1.78,;-2.11,-2.92,;-3.32,-2.67,;-1.73,-4.1,;-1.4,-.27,;-2.74,.5,;-2.74,2.04,;-1.4,2.81,;-.07,2.04,;-.07,.5,;-4.07,2.81,;-5.53,2.81,;-4.76,4.1,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CC1 |c:7,t:3|

CCCCc1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-.89,-3.6,.07;-1.3,-2.88,.07;-.89,-2.17,.07;-1.3,-1.45,.07;-.89,-.74,.07;-.07,-.74,.07;.35,-.03,.07;-.07,.69,.07;.19,1.47,.07;-.48,1.96,.07;-.48,2.78,.07;-1.15,1.47,.07;-1.93,1.73,.07;-2.1,2.54,.07;-2.54,1.18,.07;-.89,.69,.07;-1.3,-.03,.07;.97,1.73,-.07;1.59,1.18,.07;1.42,.37,.07;2.37,1.43,.07;2.54,2.24,.07;1.93,2.79,.07;2.1,3.6,.07;1.15,2.54,.07;.53,3.09,.07)|

CC(=O)c1c(N)n(-c2c(C)ccc(O)c2C)c2ncc(nc12)-c1cnccn1 |(-2.1,2.18,.07;-1.93,1.37,.07;-2.54,.82,.07;-1.15,1.12,.07;-.48,1.6,.07;-.48,2.43,.07;.19,1.12,.07;.97,1.37,-.07;1.59,.82,.07;1.42,.01,.07;2.37,1.07,.07;2.54,1.88,.07;1.93,2.43,.07;2.1,3.24,.07;1.15,2.18,.07;.53,2.73,.07;-.07,.33,.07;.35,-.38,.07;-.07,-1.1,.07;-.89,-1.1,.07;-1.3,-.38,.07;-.89,.33,.07;-1.3,-1.81,.07;-2.13,-1.81,.07;-2.54,-2.53,.07;-2.13,-3.24,.07;-1.3,-3.24,.07;-.89,-2.53,.07)|

CC1C(O)C=CC(C)=C1n1c(N)c(C(C)=O)c2nc(cnc12)-c1cnccn1 |c:4,7|

CC1CC=C(O)C(C)=C1n1c(N)c(C(C)=O)c2nc(cnc12)-c1cnccn1 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(C3CC3)c(C)nc12 |(1.42,-.29,.07;1.59,.52,.07;2.37,.77,.07;2.54,1.58,.07;1.93,2.13,.07;2.1,2.94,.07;1.15,1.88,.07;.53,2.43,.07;.97,1.07,-.07;.19,.81,.07;-.48,1.3,.07;-.48,2.12,.07;-1.15,.81,.07;-1.93,1.07,.07;-2.1,1.88,.07;-2.54,.52,.07;-.89,.03,.07;-1.3,-.68,.07;-.89,-1.4,.07;-1.3,-2.11,.07;-2.02,-2.53,.07;-1.3,-2.94,.07;-.07,-1.4,.07;.35,-2.11,.07;.35,-.68,.07;-.07,.03,.07)|

CCCCc1nc2c(C(N)=O)c(N)n(-c3c(C)ccc(O)c3C)c2nc1C |(-.89,-3.6,.07;-1.3,-2.88,.07;-.89,-2.17,.07;-1.3,-1.45,.07;-.89,-.74,.07;-1.3,-.03,.07;-.89,.69,.07;-1.15,1.47,.07;-1.93,1.73,.07;-2.1,2.54,.07;-2.54,1.18,.07;-.48,1.96,.07;-.48,2.78,.07;.19,1.47,.07;.97,1.73,-.07;1.59,1.18,.07;1.42,.37,.07;2.37,1.43,.07;2.54,2.24,.07;1.93,2.79,.07;2.1,3.6,.07;1.15,2.54,.07;.53,3.09,.07;-.07,.69,.07;.35,-.03,.07;-.07,-.74,.07;.35,-1.45,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(C=C)c(nc12)C(F)(F)F |(1.42,-.34,.07;1.59,.46,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.53,2.37,.07;.97,1.01,-.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;-.89,-1.45,.07;-1.3,-2.17,.07;-.89,-2.88,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;.35,-2.17,.07;1.17,-2.17,.07;-.07,-2.88,.07;.76,-2.88,.07)|

Cc1ccc(O)c(Cl)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C1CC1 |(1.42,-.29,.07;1.59,.52,.07;2.37,.77,.07;2.54,1.58,.07;1.93,2.13,.07;2.1,2.94,.07;1.15,1.88,.07;.53,2.43,.07;.97,1.07,-.07;.19,.81,.07;-.48,1.3,.07;-.48,2.12,.07;-1.15,.81,.07;-1.93,1.07,.07;-2.1,1.88,.07;-2.54,.52,.07;-.89,.03,.07;-1.3,-.68,.07;-.89,-1.4,.07;-.07,-1.4,.07;.35,-.68,.07;-.07,.03,.07;-1.3,-2.11,.07;-2.02,-2.53,.07;-1.3,-2.94,.07)|

CC1=C(C(Cl)C(O)C=C1)n1c(N)c(C(N)=O)c2nc(cnc12)C1CC1 |c:7,t:1|

CC1CC=C(O)C(Cl)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CC1 |c:7,t:3|

CCCCc1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(Cl)ccc(O)c1C |(-.89,-3.6,.07;-1.3,-2.88,.07;-.89,-2.17,.07;-1.3,-1.45,.07;-.89,-.74,.07;-.07,-.74,.07;.35,-.03,.07;-.07,.69,.07;.19,1.47,.07;-.48,1.96,.07;-.48,2.78,.07;-1.15,1.47,.07;-1.93,1.73,.07;-2.1,2.54,.07;-2.54,1.18,.07;-.89,.69,.07;-1.3,-.03,.07;.97,1.73,-.07;1.59,1.18,.07;1.42,.37,.07;2.37,1.43,.07;2.54,2.24,.07;1.93,2.79,.07;2.1,3.6,.07;1.15,2.54,.07;.53,3.09,.07)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C3CC3)c(C)nc12 |r,c:7,t:3,@:19|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C3CC3)c(C)nc12 |r,c:4,7,@:19|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CC1 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C1CC1 |(1.78,2.14,;2.68,1.29,;4.15,1.72,;5.27,.66,;4.9,-.84,;5.8,-1.69,;3.43,-1.27,;3.13,-2.47,;2.32,-.21,;.81,-.53,;.18,-1.94,;.8,-3.01,;-1.35,-1.78,;-2.38,-2.92,;-3.58,-2.67,;-1.99,-4.09,;-1.67,-.27,;-3,.5,;-3,2.04,;-1.67,2.81,;-.33,2.04,;-.33,.5,;-4.34,2.81,;-5.8,2.81,;-5.03,4.09,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C1CC1 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C1CC1 |c:4,7|

Cc1cnc2n(c(N)c(C(N)=O)c2c1)-c1c(C)ccc(O)c1C |(-4.93,3.3,;-3.87,2.68,;-2.53,3.45,;-1.2,2.68,;-1.2,1.14,;-.05,.11,;-.68,-1.3,;-.06,-2.36,;-2.21,-1.13,;-3.24,-2.28,;-4.44,-2.03,;-2.86,-3.45,;-2.53,.37,;-3.87,1.14,;1.45,.43,;1.81,1.93,;.92,2.78,;3.29,2.36,;4.41,1.3,;4.04,-.2,;4.93,-1.05,;2.56,-.63,;2.27,-1.83,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(C)cnc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(C)cnc12 |c:4,7|

Cc1cnc2n(c(N)c(C(N)=O)c2c1C)-c1c(C)ccc(O)c1C |(-1.3,-2.53,.07;-.89,-1.81,.07;-.07,-1.81,.07;.35,-1.1,.07;-.07,-.38,.07;.19,.4,.07;-.48,.89,.07;-.48,1.71,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.89,-.38,.07;-1.3,-1.1,.07;-2.13,-1.1,.07;.97,.66,-.07;1.59,.1,.07;1.42,-.7,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.53,2.02,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2c(C)c(C)cnc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2c(C)c(C)cnc12 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C(C)(C)O |(1.42,-.34,.07;1.59,.46,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.53,2.37,.07;.97,1.01,-.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;-.89,-1.45,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;-1.3,-2.17,.07;-2.13,-2.17,.07;-1.72,-1.45,.07;-.89,-2.88,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |(.92,2.78,;1.81,1.93,;3.29,2.36,;4.41,1.3,;4.04,-.2,;4.93,-1.05,;2.56,-.63,;2.27,-1.83,;1.45,.43,;-.05,.11,;-.68,-1.3,;-.06,-2.36,;-2.21,-1.13,;-3.24,-2.28,;-4.44,-2.03,;-2.86,-3.45,;-2.53,.37,;-3.87,1.14,;-3.87,2.68,;-4.93,3.3,;-2.53,3.45,;-1.2,2.68,;-1.2,1.14,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |c:4,7|

CC(C)c1cnc2n(c(N)c(C(N)=O)c2c1)-c1c(C)ccc(O)c1C |(-2.13,-2.17,.07;-1.3,-2.17,.07;-.89,-2.88,.07;-.89,-1.45,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;.97,1.01,-.07;1.59,.46,.07;1.42,-.34,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.53,2.37,.07)|

CC(C)c1cnc2n(c(N)c(C(N)=O)c2c1)C1=C(C)C(O)=CCC1C |c:18,22|

CC(C)c1cnc2n(c(N)c(C(N)=O)c2c1)C1=C(C)C=CC(O)C1C |c:18,21|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(Br)cnc12 |(1.42,-.7,.07;1.59,.1,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.53,2.02,.07;.97,.66,-.07;.19,.4,.07;-.48,.89,.07;-.48,1.71,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.89,-.38,.07;-1.3,-1.1,.07;-.89,-1.81,.07;-1.3,-2.53,.07;-.07,-1.81,.07;.35,-1.1,.07;-.07,-.38,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(Br)cnc12 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1cc(C(N)=O)c2cc(cnc12)C1CC1 |(1.42,-.29,.07;1.59,.52,.07;2.37,.77,.07;2.54,1.58,.07;1.93,2.13,.07;2.1,2.94,.07;1.15,1.88,.07;.53,2.43,.07;.97,1.07,-.07;.19,.81,.07;-.48,1.3,.07;-1.15,.81,.07;-1.93,1.07,.07;-2.1,1.88,.07;-2.54,.52,.07;-.89,.03,.07;-1.3,-.68,.07;-.89,-1.4,.07;-.07,-1.4,.07;.35,-.68,.07;-.07,.03,.07;-1.3,-2.11,.07;-2.02,-2.53,.07;-1.3,-2.94,.07)|

CC1CC=C(O)C(C)=C1n1cc(C(N)=O)c2cc(cnc12)C1CC1 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1cc(C(N)=O)c2cc(cnc12)C1CC1 |c:4,7|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nccnc12 |(1.42,-1.06,.07;1.59,-.25,.07;2.37,0,.07;2.54,.81,.07;1.93,1.36,.07;2.1,2.17,.07;1.15,1.11,.07;.97,.3,-.07;.19,.04,.07;-.48,.53,.07;-.48,1.35,.07;-1.15,.04,.07;-1.93,.3,.07;-2.1,1.11,.07;-2.54,-.25,.07;-.89,-.74,.07;-1.3,-1.45,.07;-.89,-2.17,.07;-.07,-2.17,.07;.35,-1.45,.07;-.07,-.74,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nccnc12 |(2.29,-1.88,;2.58,-.68,;4.06,-.25,;4.42,1.25,;3.31,2.31,;3.6,3.51,;1.83,1.88,;.94,2.73,;1.47,.38,;-.03,.06,;-.66,-1.35,;-.04,-2.42,;-2.19,-1.19,;-3.22,-2.33,;-4.42,-2.08,;-2.84,-3.51,;-2.51,.32,;-3.85,1.09,;-3.85,2.63,;-2.51,3.4,;-1.18,2.63,;-1.18,1.09,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nccnc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nccnc12 |c:4,7|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(nc12)-c1ccccc1 |(1.42,.01,.07;1.59,.82,.07;2.37,1.07,.07;2.54,1.88,.07;1.93,2.43,.07;2.1,3.24,.07;1.15,2.18,.07;.97,1.37,-.07;.19,1.12,.07;-.48,1.6,.07;-.48,2.43,.07;-1.15,1.12,.07;-1.93,1.37,.07;-2.1,2.18,.07;-2.54,.82,.07;-.89,.33,.07;-1.3,-.38,.07;-.89,-1.1,.07;-.07,-1.1,.07;.35,-.38,.07;-.07,.33,.07;.35,-1.81,.07;-.07,-2.53,.07;.35,-3.24,.07;1.17,-3.24,.07;1.58,-2.53,.07;1.17,-1.81,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(OCc3ccccc3)nc12 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,-1.1,.07;-.07,-1.81,.07;.35,-2.53,.07;-.07,-3.24,.07;.35,-3.95,.07;1.17,-3.95,.07;1.58,-3.24,.07;1.17,-2.53,.07;.35,.33,.07;-.07,1.05,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |(1.42,-.7,.07;1.59,.1,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.97,.66,-.07;.19,.4,.07;-.48,.89,.07;-.48,1.71,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.89,-.38,.07;-1.3,-1.1,.07;-.89,-1.81,.07;-1.3,-2.53,.07;-.07,-1.81,.07;.35,-2.53,.07;.35,-1.1,.07;-.07,-.38,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(OCc3cccnc3)nc12 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,-1.1,.07;-.07,-1.81,.07;.35,-2.53,.07;-.07,-3.24,.07;.35,-3.95,.07;1.17,-3.95,.07;1.58,-3.24,.07;1.17,-2.53,.07;.35,.33,.07;-.07,1.05,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(OCCN3CCOCC3)nc12 |(1.42,1.08,.07;1.59,1.89,.07;2.37,2.15,.07;2.54,2.95,.07;1.93,3.51,.07;2.1,4.31,.07;1.15,3.25,.07;.97,2.44,-.07;.19,2.19,.07;-.48,2.67,.07;-.48,3.5,.07;-1.15,2.19,.07;-1.93,2.44,.07;-2.1,3.25,.07;-2.54,1.89,.07;-.89,1.4,.07;-1.3,.69,.07;-.89,-.03,.07;-.07,-.03,.07;.35,-.74,.07;-.07,-1.45,.07;.35,-2.17,.07;-.07,-2.88,.07;-.89,-2.88,.07;-1.3,-3.6,.07;-.89,-4.31,.07;-.07,-4.31,.07;.35,-3.6,.07;.35,.69,.07;-.07,1.4,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(nc12)-c1cn[nH]c1 |(1.42,-.05,.07;1.59,.76,.07;2.37,1.01,.07;2.54,1.82,.07;1.93,2.37,.07;2.1,3.18,.07;1.15,2.12,.07;.97,1.31,-.07;.19,1.05,.07;-.48,1.54,.07;-.48,2.36,.07;-1.15,1.05,.07;-1.93,1.31,.07;-2.1,2.12,.07;-2.54,.76,.07;-.89,.27,.07;-1.3,-.44,.07;-.89,-1.16,.07;-.07,-1.16,.07;.35,-.44,.07;-.07,.27,.07;.35,-1.87,.07;1.17,-1.96,.07;1.34,-2.77,.07;.62,-3.18,.07;.01,-2.63,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(nc12)-c1cccc(c1)C(N)=O |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,.33,.07;-.07,1.05,.07;.35,-1.1,.07;1.17,-1.1,.07;1.58,-1.81,.07;1.17,-2.53,.07;.35,-2.53,.07;-.07,-1.81,.07;-.07,-3.24,.07;.35,-3.95,.07;-.89,-3.24,.07)|

CC(=O)Nc1cccc(c1)-c1cnc2c(C(N)=O)c(N)n(-c3cc(O)ccc3C)c2n1 |(-.07,-4.31,.07;.35,-3.6,.07;1.17,-3.6,.07;-.07,-2.88,.07;.35,-2.17,.07;1.17,-2.17,.07;1.58,-1.45,.07;1.17,-.74,.07;.35,-.74,.07;-.07,-1.45,.07;-.07,-.03,.07;-.89,-.03,.07;-1.3,.69,.07;-.89,1.4,.07;-1.15,2.19,.07;-1.93,2.44,.07;-2.1,3.25,.07;-2.54,1.89,.07;-.48,2.67,.07;-.48,3.5,.07;.19,2.19,.07;.97,2.44,-.07;1.15,3.25,.07;1.93,3.51,.07;2.1,4.31,.07;2.54,2.95,.07;2.37,2.15,.07;1.59,1.89,.07;1.42,1.08,.07;-.07,1.4,.07;.35,.69,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(nc12)C#Cc1ccccn1 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,.33,.07;-.07,1.05,.07;.35,-1.1,.07;.76,-1.81,.07;1.17,-2.53,.07;.76,-3.24,.07;1.17,-3.95,.07;2,-3.95,.07;2.41,-3.24,.07;2,-2.53,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(CCc3ccccn3)nc12 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,-1.1,.07;-.07,-1.81,.07;.35,-2.53,.07;-.07,-3.24,.07;.35,-3.95,.07;1.17,-3.95,.07;1.58,-3.24,.07;1.17,-2.53,.07;.35,.33,.07;-.07,1.05,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(nc12)C#Cc1cccnc1 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,.33,.07;-.07,1.05,.07;.35,-1.1,.07;.76,-1.81,.07;1.17,-2.53,.07;.76,-3.24,.07;1.17,-3.95,.07;2,-3.95,.07;2.41,-3.24,.07;2,-2.53,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(CCCN3CCOCC3)nc12 |(1.42,1.08,.07;1.59,1.89,.07;2.37,2.15,.07;2.54,2.95,.07;1.93,3.51,.07;2.1,4.31,.07;1.15,3.25,.07;.97,2.44,-.07;.19,2.19,.07;-.48,2.67,.07;-.48,3.5,.07;-1.15,2.19,.07;-1.93,2.44,.07;-2.1,3.25,.07;-2.54,1.89,.07;-.89,1.4,.07;-1.3,.69,.07;-.89,-.03,.07;-.07,-.03,.07;.35,-.74,.07;-.07,-1.45,.07;.35,-2.17,.07;-.07,-2.88,.07;-.89,-2.88,.07;-1.3,-3.6,.07;-.89,-4.31,.07;-.07,-4.31,.07;.35,-3.6,.07;.35,.69,.07;-.07,1.4,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(CCc3cccnc3)nc12 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,-1.1,.07;-.07,-1.81,.07;.35,-2.53,.07;-.07,-3.24,.07;.35,-3.95,.07;1.17,-3.95,.07;1.58,-3.24,.07;1.17,-2.53,.07;.35,.33,.07;-.07,1.05,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CCN1CCOCC1 |(1.42,1.08,.07;1.59,1.89,.07;2.37,2.15,.07;2.54,2.95,.07;1.93,3.5,.07;2.1,4.31,.07;1.15,3.25,.07;.97,2.44,-.07;.19,2.19,.07;-.48,2.67,.07;-.48,3.5,.07;-1.15,2.19,.07;-1.93,2.44,.07;-2.1,3.25,.07;-2.54,1.89,.07;-.89,1.4,.07;-1.3,.69,.07;-.89,-.03,.07;-.07,-.03,.07;.35,.69,.07;-.07,1.4,.07;.35,-.74,.07;.76,-1.45,.07;1.17,-2.17,.07;.76,-2.88,.07;-.07,-2.88,.07;-.48,-3.6,.07;-.07,-4.31,.07;.76,-4.31,.07;1.17,-3.6,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |c:4,7|

Cc1cnc2c(C(N)=O)c(N)n(-c3cc(O)ccc3C)c2n1 |(.35,-2.53,.07;-.07,-1.81,.07;-.89,-1.81,.07;-1.3,-1.1,.07;-.89,-.38,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.48,.89,.07;-.48,1.71,.07;.19,.4,.07;.97,.66,-.07;1.15,1.46,.07;1.93,1.72,.07;2.1,2.53,.07;2.54,1.17,.07;2.37,.36,.07;1.59,.1,.07;1.42,-.7,.07;-.07,-.38,.07;.35,-1.1,.07)|

Cc1nc2c(C(N)=O)c(N)n(-c3c(Cl)ccc(O)c3C)c2nc1C |(-1.3,-2.53,.07;-.89,-1.81,.07;-1.3,-1.1,.07;-.89,-.38,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.48,.89,.07;-.48,1.71,.07;.19,.4,.07;.97,.66,-.07;1.59,.1,.07;1.42,-.7,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.53,2.02,.07;-.07,-.38,.07;.35,-1.1,.07;-.07,-1.81,.07;.35,-2.53,.07)|

CC1=C(C(Cl)C(O)C=C1)n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |c:7,t:1|

CC1CC=C(O)C(Cl)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C1CCC1 |(1.42,-.2,.07;1.59,.61,.07;2.37,.87,.07;2.54,1.67,.07;1.93,2.22,.07;2.1,3.03,.07;1.15,1.97,.07;.53,2.52,.07;.97,1.16,-.07;.19,.91,.07;-.48,1.39,.07;-.48,2.22,.07;-1.15,.91,.07;-1.93,1.16,.07;-2.1,1.97,.07;-2.54,.61,.07;-.89,.12,.07;-1.3,-.59,.07;-.89,-1.31,.07;-.07,-1.31,.07;.35,-.59,.07;-.07,.12,.07;-1.3,-2.02,.07;-2.1,-2.23,.07;-1.89,-3.03,.07;-1.09,-2.82,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CCC1 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1CCC1 |c:4,7|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C)cnc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C)cnc12 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C(C)(C)F |(1.42,-.34,.07;1.59,.46,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.53,2.37,.07;.97,1.01,-.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;-.89,-1.45,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;-1.3,-2.17,.07;-.89,-2.88,.07;-2.13,-2.17,.07;-1.72,-2.88,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C(C)(C)F |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C(C)(C)F |c:4,7|

Cc1ccc(c(c1n2c(c(c3c2nc(c(c3)C)C)C(=O)N)N)C)O

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(C)c(C)nc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(C)c(C)nc12 |c:4,7|

CC(=O)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-.89,-2.88,.07;-1.3,-2.17,.07;-2.13,-2.17,.07;-.89,-1.45,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;.97,1.01,-.07;1.59,.46,.07;1.42,-.34,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.53,2.37,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C(C)=O |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C(C)=O |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(Br)c(C)nc12 |(1.42,-.7,.07;1.59,.1,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.53,2.02,.07;.97,.66,-.07;.19,.4,.07;-.48,.89,.07;-.48,1.71,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.89,-.38,.07;-1.3,-1.1,.07;-.89,-1.81,.07;-1.3,-2.53,.07;-.07,-1.81,.07;.35,-2.53,.07;.35,-1.1,.07;-.07,-.38,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(Br)c(C)nc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(Br)c(C)nc12 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C(C)(C)O |(3.2,-2.6,;3.49,-1.4,;4.97,-.97,;5.34,.53,;4.22,1.59,;4.51,2.79,;2.74,1.16,;1.85,2.01,;2.38,-.34,;.88,-.66,;.25,-2.07,;.87,-3.13,;-1.28,-1.9,;-2.31,-3.05,;-3.51,-2.8,;-1.93,-4.22,;-1.6,-.4,;-2.93,.37,;-2.93,1.91,;-1.6,2.68,;-.27,1.91,;-.27,.37,;-4.27,2.68,;-5.34,2.07,;-4.27,4.22,;-5.34,3.3,)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(c(C)nc12)C(C)(C)O |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(c(C)nc12)C(C)(C)O |c:4,7|

Cc1ccc2c(C(N)=O)c(N)n(-c3c(C)ccc(O)c3C)c2n1 |(.35,-2.53,.07;-.07,-1.81,.07;-.89,-1.81,.07;-1.3,-1.1,.07;-.89,-.38,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.48,.89,.07;-.48,1.71,.07;.19,.4,.07;.97,.66,-.07;1.59,.1,.07;1.42,-.7,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.53,2.02,.07;-.07,-.38,.07;.35,-1.1,.07)|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2ccc(C)nc12 |c:4,7|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2ccc(C)nc12 |c:7,t:3|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2ncc(C)nc12 |c:7,t:3|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2ncc(C)nc12 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C1(CC1)C(F)(F)F |@:22,@@:25,(-.81,-1.4,-1.63;-.86,-.59,-.39;-.74,.81,-.51;-.75,1.64,.61;-.92,1.09,1.89;-.91,1.95,2.94;-1.09,-.31,2.06;-1.33,-.84,3.43;-1.04,-1.16,.91;-1.19,-2.52,1.05;-.35,-3.39,1.67;.83,-3.04,2.23;-.87,-4.7,1.64;-.34,-5.87,2.23;-.93,-7.07,2.1;.7,-5.84,2.92;-2.05,-4.58,.91;-2.96,-5.51,.5;-4.05,-5.15,-.24;-4.23,-3.78,-.57;-3.31,-2.87,-.14;-2.22,-3.25,.57;-5.02,-6.19,-.66;-5.23,-6.36,-2.18;-4.41,-7.4,-1.41;-6.22,-6.46,.29;-7.09,-7.43,-.15;-6.95,-5.31,.46;-5.76,-6.85,1.53)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1(CC1)C(F)(F)F |r,c:7,t:3,@:22,@@:25|

C[C@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C1(CC1)C(F)(F)F |r,c:4,7,@:22,@@:25|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(Cl)c(C)nc12 |(.92,2.16,;1.81,1.31,;3.29,1.75,;4.41,.68,;4.04,-.81,;4.93,-1.66,;2.56,-1.25,;2.27,-2.44,;1.45,-.18,;-.05,-.5,;-.68,-1.91,;-.06,-2.98,;-2.21,-1.75,;-3.24,-2.9,;-4.44,-2.64,;-2.86,-4.07,;-2.53,-.25,;-3.87,.52,;-3.87,2.06,;-4.93,2.68,;-2.53,2.84,;-2.53,4.07,;-1.2,2.06,;-1.2,.52,)|

CC(=C)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-.89,-2.88,.07;-1.3,-2.17,.07;-2.13,-2.17,.07;-.89,-1.45,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;.97,1.01,-.07;1.59,.46,.07;1.42,-.34,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.53,2.37,.07)|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(Cl)c(C)nc12 |c:7,t:3|

CC(C)c1cnc2n(c(N)c(C(N)=O)c2n1)C1=C(C)C(O)=CCC1C |c:18,22|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(Cl)c(C)nc12 |c:4,7|

CCc1cnc2n(c(N)c(C(N)=O)c2n1)C1=C(C)C(O)=CCC1C |c:17,21|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)C#C |c:7,t:3|

Cc1ccc(O)c(C)c1-n1cc(C(N)=O)c2nc(C)c(C)nc12 |(1.42,-.7,.07;1.59,.1,.07;2.37,.36,.07;2.54,1.17,.07;1.93,1.72,.07;2.1,2.53,.07;1.15,1.46,.07;.53,2.02,.07;.97,.66,-.07;.19,.4,.07;-.48,.89,.07;-1.15,.4,.07;-1.93,.66,.07;-2.1,1.46,.07;-2.54,.1,.07;-.89,-.38,.07;-1.3,-1.1,.07;-.89,-1.81,.07;-1.3,-2.53,.07;-.07,-1.81,.07;.35,-2.53,.07;.35,-1.1,.07;-.07,-.38,.07)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2ncc(cc12)C(F)(F)F |(1.42,-.34,.07;1.59,.46,.07;2.37,.72,.07;2.54,1.52,.07;1.93,2.08,.07;2.1,2.88,.07;1.15,1.82,.07;.97,1.01,-.07;.19,.76,.07;-.48,1.24,.07;-.48,2.07,.07;-1.15,.76,.07;-1.93,1.01,.07;-2.1,1.82,.07;-2.54,.46,.07;-.89,-.03,.07;-1.3,-.74,.07;-.89,-1.45,.07;-.07,-1.45,.07;.35,-.74,.07;-.07,-.03,.07;.35,-2.17,.07;-.07,-2.88,.07;1.17,-2.17,.07;.76,-2.88,.07)|

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Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CC1OCCC1O |(1.42,.67,.07;1.59,1.47,.07;2.37,1.73,.07;2.54,2.53,.07;1.93,3.09,.07;2.1,3.89,.07;1.15,2.83,.07;.53,3.38,.07;.97,2.02,-.07;.19,1.77,.07;-.48,2.25,.07;-.48,3.08,.07;-1.15,1.77,.07;-1.93,2.02,.07;-2.1,2.83,.07;-2.54,1.47,.07;-.89,.98,.07;-1.3,.27,.07;-.89,-.44,.07;-.07,-.44,.07;.35,.27,.07;-.07,.98,.07;.35,-1.16,.07;.76,-1.87,.07;1.17,-2.59,.07;.84,-3.34,.07;1.45,-3.89,.07;2.16,-3.48,.07;1.99,-2.67,.07;2.54,-2.06,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CC1(C)CCCO1 |(1.42,.65,.07;1.59,1.45,.07;2.37,1.71,.07;2.54,2.52,.07;1.93,3.07,.07;2.1,3.88,.07;1.15,2.81,.07;.53,3.37,.07;.97,2.01,-.07;.19,1.75,.07;-.48,2.24,.07;-.48,3.06,.07;-1.15,1.75,.07;-1.93,2.01,.07;-2.1,2.81,.07;-2.54,1.45,.07;-.89,.97,.07;-1.3,.25,.07;-.89,-.46,.07;-.07,-.46,.07;.35,.25,.07;-.07,.97,.07;.35,-1.18,.07;.76,-1.89,.07;1.17,-2.61,.07;1.58,-1.89,.07;.5,-3.09,.07;.76,-3.88,.07;1.58,-3.88,.07;1.84,-3.09,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CC1(O)CCOC1 |(1.42,.65,.07;1.59,1.45,.07;2.37,1.71,.07;2.54,2.52,.07;1.93,3.07,.07;2.1,3.88,.07;1.15,2.81,.07;.53,3.37,.07;.97,2.01,-.07;.19,1.75,.07;-.48,2.24,.07;-.48,3.06,.07;-1.15,1.75,.07;-1.93,2.01,.07;-2.1,2.81,.07;-2.54,1.45,.07;-.89,.97,.07;-1.3,.25,.07;-.89,-.46,.07;-.07,-.46,.07;.35,.25,.07;-.07,.97,.07;.35,-1.18,.07;.76,-1.89,.07;1.17,-2.61,.07;1.58,-1.89,.07;.5,-3.09,.07;.76,-3.88,.07;1.58,-3.88,.07;1.84,-3.09,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CCC1(O)CCOCC1 |(1.42,1.08,.07;1.59,1.89,.07;2.37,2.15,.07;2.54,2.95,.07;1.93,3.5,.07;2.1,4.31,.07;1.15,3.25,.07;.53,3.8,.07;.97,2.44,-.07;.19,2.19,.07;-.48,2.67,.07;-.48,3.5,.07;-1.15,2.19,.07;-1.93,2.44,.07;-2.1,3.25,.07;-2.54,1.89,.07;-.89,1.4,.07;-1.3,.69,.07;-.89,-.03,.07;-.07,-.03,.07;.35,.69,.07;-.07,1.4,.07;.35,-.74,.07;.76,-1.45,.07;1.17,-2.17,.07;.76,-2.88,.07;1.58,-2.88,.07;-.07,-2.88,.07;-.48,-3.6,.07;-.07,-4.31,.07;.76,-4.31,.07;1.17,-3.6,.07)|

COC(C)(C)C#Cc1cnc2c(C(N)=O)c(N)n(-c3c(C)ccc(O)c3C)c2n1 |(1.17,-3.95,.07;.76,-3.24,.07;1.17,-2.53,.07;1.89,-2.11,.07;1.89,-2.94,.07;.76,-1.81,.07;.35,-1.1,.07;-.07,-.38,.07;-.89,-.38,.07;-1.3,.33,.07;-.89,1.05,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.48,2.32,.07;-.48,3.14,.07;.19,1.83,.07;.97,2.09,-.07;1.59,1.53,.07;1.42,.73,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.53,3.44,.07;-.07,1.05,.07;.35,.33,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CC(C)(C)O |(1.42,.37,.07;1.59,1.18,.07;2.37,1.43,.07;2.54,2.24,.07;1.93,2.79,.07;2.1,3.6,.07;1.15,2.54,.07;.53,3.09,.07;.97,1.73,-.07;.19,1.47,.07;-.48,1.96,.07;-.48,2.78,.07;-1.15,1.47,.07;-1.93,1.73,.07;-2.1,2.54,.07;-2.54,1.18,.07;-.89,.69,.07;-1.3,-.03,.07;-.89,-.74,.07;-.07,-.74,.07;.35,-.03,.07;-.07,.69,.07;.35,-1.45,.07;.76,-2.17,.07;1.17,-2.88,.07;2,-2.88,.07;.76,-3.6,.07;1.58,-3.6,.07)|

COCCOCC#Cc1cnc2n(C(N)=O)c(N)c(-c3c(C)ccc(O)c3C)c2n1 |(-.76,-5.03,.07;-1.17,-4.31,.07;-.76,-3.6,.07;-1.17,-2.88,.07;-.76,-2.17,.07;-1.17,-1.45,.07;-.76,-.74,.07;-.35,-.03,.07;.07,.69,.07;.89,.69,.07;1.3,1.4,.07;.89,2.12,.07;1.15,2.9,.07;1.93,3.16,-.07;2.1,3.96,.07;2.54,2.61,.07;.48,3.39,.07;.48,4.21,.07;-.19,2.9,.07;-.97,3.16,.07;-1.59,2.61,.07;-1.42,1.8,.07;-2.37,2.86,.07;-2.54,3.67,.07;-1.93,4.22,.07;-2.1,5.03,.07;-1.15,3.96,.07;-.53,4.52,.07;.07,2.12,.07;-.35,1.4,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(nc12)C#CC1(O)CCC(F)(F)CC1 |(1.33,1.14,.07;1.5,1.95,.07;2.29,2.2,.07;2.46,3.01,.07;1.85,3.56,.07;2.02,4.37,.07;1.06,3.31,.07;.45,3.86,.07;.89,2.5,-.07;.11,2.24,.07;-.56,2.73,.07;-.56,3.55,.07;-1.23,2.24,.07;-2.01,2.5,.07;-2.19,3.31,.07;-2.63,1.95,.07;-.97,1.46,.07;-1.39,.74,.07;-.97,.03,.07;-.15,.03,.07;.26,.74,.07;-.15,1.46,.07;.26,-.68,.07;.68,-1.4,.07;1.09,-2.11,.07;.26,-2.11,.07;.68,-2.83,.07;1.09,-3.54,.07;1.91,-3.54,.07;1.91,-4.37,.07;2.63,-3.95,.07;2.33,-2.83,.07;1.91,-2.11,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C(=O)Nc1cccnc1 |(1.42,.73,.07;1.59,1.53,.07;2.37,1.79,.07;2.54,2.6,.07;1.93,3.15,.07;2.1,3.95,.07;1.15,2.89,.07;.53,3.44,.07;.97,2.09,-.07;.19,1.83,.07;-.48,2.32,.07;-.48,3.14,.07;-1.15,1.83,.07;-1.93,2.09,.07;-2.1,2.89,.07;-2.54,1.53,.07;-.89,1.05,.07;-1.3,.33,.07;-.89,-.38,.07;-.07,-.38,.07;.35,.33,.07;-.07,1.05,.07;-1.3,-1.1,.07;-2.13,-1.1,.07;-.89,-1.81,.07;-1.3,-2.53,.07;-2.13,-2.53,.07;-2.54,-3.24,.07;-2.13,-3.95,.07;-1.3,-3.95,.07;-.89,-3.24,.07)|

CCNC(=O)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-.89,-3.6,.07;-1.3,-2.88,.07;-.89,-2.17,.07;-1.3,-1.45,.07;-2.13,-1.45,.07;-.89,-.74,.07;-.07,-.74,.07;.35,-.03,.07;-.07,.69,.07;.19,1.47,.07;-.48,1.96,.07;-.48,2.78,.07;-1.15,1.47,.07;-1.93,1.73,.07;-2.1,2.54,.07;-2.54,1.18,.07;-.89,.69,.07;-1.3,-.03,.07;.97,1.73,-.07;1.59,1.18,.07;1.42,.37,.07;2.37,1.43,.07;2.54,2.24,.07;1.93,2.79,.07;2.1,3.6,.07;1.15,2.54,.07;.53,3.09,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C(=O)NCc1ccccc1 |(1.42,1.08,.07;1.59,1.89,.07;2.37,2.15,.07;2.54,2.95,.07;1.93,3.51,.07;2.1,4.31,.07;1.15,3.25,.07;.53,3.8,.07;.97,2.44,-.07;.19,2.19,.07;-.48,2.67,.07;-.48,3.5,.07;-1.15,2.19,.07;-1.93,2.44,.07;-2.1,3.25,.07;-2.54,1.89,.07;-.89,1.4,.07;-1.3,.69,.07;-.89,-.03,.07;-.07,-.03,.07;.35,.69,.07;-.07,1.4,.07;-1.3,-.74,.07;-2.13,-.74,.07;-.89,-1.45,.07;-1.3,-2.17,.07;-.89,-2.88,.07;-1.3,-3.6,.07;-.89,-4.31,.07;-.07,-4.31,.07;.35,-3.6,.07;-.07,-2.88,.07)|

CCN(CC)C(=O)c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-.89,-3.6,.07;-1.3,-2.88,.07;-.89,-2.17,.07;-.07,-2.17,.07;.35,-2.88,.07;-1.3,-1.45,.07;-2.13,-1.45,.07;-.89,-.74,.07;-.07,-.74,.07;.35,-.03,.07;-.07,.69,.07;.19,1.47,.07;-.48,1.96,.07;-.48,2.78,.07;-1.15,1.47,.07;-1.93,1.73,.07;-2.1,2.54,.07;-2.54,1.18,.07;-.89,.69,.07;-1.3,-.03,.07;.97,1.73,-.07;1.59,1.18,.07;1.42,.37,.07;2.37,1.43,.07;2.54,2.24,.07;1.93,2.79,.07;2.1,3.6,.07;1.15,2.54,.07;.53,3.09,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1cc2ccccc2n1C |(1.65,.57,.07;1.82,1.38,.07;2.6,1.63,.07;2.78,2.44,.07;2.16,2.99,.07;2.33,3.8,.07;1.38,2.74,.07;.77,3.29,.07;1.21,1.93,-.07;.42,1.67,.07;-.24,2.16,.07;-.24,2.98,.07;-.91,1.67,.07;-1.7,1.93,.07;-1.87,2.74,.07;-2.31,1.38,.07;-.66,.89,.07;-1.07,.17,.07;-.66,-.54,.07;.17,-.54,.07;.58,.17,.07;.17,.89,.07;-1.07,-1.25,.07;-.73,-2.01,.07;-1.35,-2.56,.07;-1.35,-3.38,.07;-2.06,-3.8,.07;-2.78,-3.38,.07;-2.78,-2.56,.07;-2.06,-2.15,.07;-1.89,-1.34,.07;-2.44,-.73,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nc2ccccc2s1 |(1.65,.57,.07;1.82,1.38,.07;2.6,1.63,.07;2.78,2.44,.07;2.16,2.99,.07;2.33,3.8,.07;1.38,2.74,.07;.77,3.29,.07;1.21,1.93,-.07;.42,1.67,.07;-.24,2.16,.07;-.24,2.98,.07;-.91,1.67,.07;-1.7,1.93,.07;-1.87,2.74,.07;-2.31,1.38,.07;-.66,.89,.07;-1.07,.17,.07;-.66,-.54,.07;.17,-.54,.07;.58,.17,.07;.17,.89,.07;-1.07,-1.25,.07;-.73,-2.01,.07;-1.35,-2.56,.07;-1.35,-3.38,.07;-2.06,-3.8,.07;-2.78,-3.38,.07;-2.78,-2.56,.07;-2.06,-2.15,.07;-1.89,-1.34,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nc2ccccc2o1 |(1.65,.57,.07;1.82,1.38,.07;2.6,1.63,.07;2.78,2.44,.07;2.16,2.99,.07;2.33,3.8,.07;1.38,2.74,.07;.77,3.29,.07;1.21,1.93,-.07;.42,1.67,.07;-.24,2.16,.07;-.24,2.98,.07;-.91,1.67,.07;-1.7,1.93,.07;-1.87,2.74,.07;-2.31,1.38,.07;-.66,.89,.07;-1.07,.17,.07;-.66,-.54,.07;.17,-.54,.07;.58,.17,.07;.17,.89,.07;-1.07,-1.25,.07;-.73,-2.01,.07;-1.35,-2.56,.07;-1.35,-3.38,.07;-2.06,-3.8,.07;-2.78,-3.38,.07;-2.78,-2.56,.07;-2.06,-2.15,.07;-1.89,-1.34,.07)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccnnc1 |(1.42,.01,.07;1.59,.82,.07;2.37,1.07,.07;2.54,1.88,.07;1.93,2.43,.07;2.1,3.24,.07;1.15,2.18,.07;.53,2.73,.07;.97,1.37,-.07;.19,1.12,.07;-.48,1.6,.07;-.48,2.43,.07;-1.15,1.12,.07;-1.93,1.37,.07;-2.1,2.18,.07;-2.54,.82,.07;-.89,.33,.07;-1.3,-.38,.07;-.89,-1.1,.07;-.07,-1.1,.07;.35,-.38,.07;-.07,.33,.07;-1.3,-1.81,.07;-2.13,-1.81,.07;-2.54,-2.53,.07;-2.13,-3.24,.07;-1.3,-3.24,.07;-.89,-2.53,.07)|

CC1C(O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccnnc1 |c:4,7|

CC1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(cnc12)-c1ccnnc1 |c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)N1CC2(COC2)C1 |(2.77,.58,;3.09,2.08,;4.56,2.56,;4.88,4.06,;3.73,5.09,;4.05,6.6,;2.27,4.62,;1.12,5.65,;1.95,3.11,;.48,2.64,;-.76,3.54,;-.76,5.08,;-2.01,2.64,;-3.47,3.11,;-3.79,4.62,;-4.62,2.08,;-1.53,1.17,;-2.3,-.16,;-1.53,-1.5,;.01,-1.5,;.78,-.16,;.01,1.17,;-2.3,-2.83,;-3.79,-3.23,;-3.39,-4.72,;-4.88,-5.11,;-4.48,-6.6,;-2.99,-6.2,;-1.9,-4.32,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nc2ccccc2n1C |(3.08,1.06,;3.4,2.57,;4.86,3.05,;5.18,4.55,;4.04,5.58,;4.36,7.09,;2.57,5.11,;1.43,6.14,;2.25,3.6,;.79,3.12,;-.46,4.03,;-.46,5.57,;-1.7,3.12,;-3.17,3.6,;-3.49,5.11,;-4.31,2.57,;-1.23,1.66,;-2,.33,;-1.23,-1.01,;.31,-1.01,;1.08,.33,;.31,1.66,;-2,-2.34,;-1.37,-3.75,;-2.52,-4.78,;-2.52,-6.32,;-3.85,-7.09,;-5.18,-6.32,;-5.18,-4.78,;-3.85,-4.01,;-3.53,-2.5,;-4.56,-1.36,)|

Cc1nc(oc1C)-c1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-2.32,-6.7,;-2.48,-5.17,;-1.33,-4.14,;-1.96,-2.73,;-3.49,-2.89,;-3.81,-4.4,;-5.22,-5.02,;-1.19,-1.4,;.35,-1.4,;1.12,-.06,;.35,1.27,;.83,2.74,;-.42,3.64,;-.42,5.18,;-1.67,2.74,;-3.13,3.21,;-3.45,4.72,;-4.28,2.18,;-1.19,1.27,;-1.96,-.06,;2.29,3.21,;3.43,2.18,;3.11,.67,;4.9,2.66,;5.22,4.16,;4.07,5.19,;4.39,6.7,;2.61,4.72,;1.47,5.75,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(C3CC3)c(nc12)C1CC1 |(2.64,-.54,;2.96,.97,;4.43,1.44,;4.75,2.95,;3.6,3.98,;3.92,5.49,;2.14,3.5,;.99,4.53,;1.82,2,;.35,1.52,;-.89,2.43,;-.89,3.97,;-2.14,1.52,;-3.6,2,;-3.92,3.5,;-4.75,.97,;-1.66,.06,;-2.43,-1.28,;-1.66,-2.61,;-2.43,-3.95,;-3.77,-4.72,;-2.43,-5.49,;-.12,-2.61,;.65,-1.28,;-.12,.06,;.65,-3.95,;.65,-5.49,;1.98,-4.72,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2ncc(C=C)nc12 |(2.64,-.64,;2.96,.86,;4.43,1.34,;4.75,2.85,;3.6,3.88,;3.92,5.38,;2.14,3.4,;.99,4.43,;1.82,1.89,;.35,1.42,;-.89,2.32,;-.89,3.86,;-2.14,1.42,;-3.6,1.89,;-3.92,3.4,;-4.75,.86,;-1.66,-.05,;-2.43,-1.38,;-1.66,-2.71,;-.12,-2.71,;.65,-4.05,;-.12,-5.38,;.65,-1.38,;-.12,-.05,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1cccc(OC2CCOCC2)n1 |(2.64,2.69,;2.96,4.2,;4.43,4.67,;4.75,6.18,;3.6,7.21,;3.92,8.72,;2.14,6.73,;.99,7.76,;1.82,5.23,;.35,4.75,;-.89,5.66,;-.89,7.2,;-2.14,4.75,;-3.6,5.23,;-3.92,6.73,;-4.75,4.2,;-1.66,3.29,;-2.43,1.95,;-1.66,.62,;-.12,.62,;.65,1.95,;-.12,3.29,;-2.43,-.71,;-3.97,-.71,;-4.74,-2.05,;-3.97,-3.38,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-7.38,;-3.97,-8.72,;-2.43,-8.72,;-1.66,-7.38,;-1.66,-2.05,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(C=C)cnc12 |(2.64,-.64,;2.96,.86,;4.43,1.34,;4.75,2.85,;3.6,3.88,;3.92,5.38,;2.14,3.4,;.99,4.43,;1.82,1.89,;.35,1.42,;-.89,2.32,;-.89,3.86,;-2.14,1.42,;-3.6,1.89,;-3.92,3.4,;-4.75,.86,;-1.66,-.05,;-2.43,-1.38,;-1.66,-2.71,;-2.43,-4.05,;-1.66,-5.38,;-.12,-2.71,;.65,-1.38,;-.12,-.05,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(OC3CC3)cnc12 |(2.64,.13,;2.96,1.63,;4.43,2.11,;4.75,3.62,;3.6,4.65,;3.92,6.15,;2.14,4.17,;.99,5.2,;1.82,2.66,;.35,2.19,;-.89,3.09,;-.89,4.63,;-2.14,2.19,;-3.6,2.66,;-3.92,4.17,;-4.75,1.63,;-1.66,.72,;-2.43,-.61,;-1.66,-1.94,;-2.43,-3.28,;-1.66,-4.61,;-1.66,-6.15,;-.33,-5.38,;-.12,-1.94,;.65,-.61,;-.12,.72,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(NC3CC3)cnc12 |(2.64,.13,;2.96,1.63,;4.43,2.11,;4.75,3.62,;3.6,4.65,;3.92,6.15,;2.14,4.17,;.99,5.2,;1.82,2.66,;.35,2.19,;-.89,3.09,;-.89,4.63,;-2.14,2.19,;-3.6,2.66,;-3.92,4.17,;-4.75,1.63,;-1.66,.72,;-2.43,-.61,;-1.66,-1.94,;-2.43,-3.28,;-1.66,-4.61,;-1.66,-6.15,;-.33,-5.38,;-.12,-1.94,;.65,-.61,;-.12,.72,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc3CCCCc3nc12 |(2.64,-.64,;2.96,.86,;4.43,1.34,;4.75,2.85,;3.6,3.88,;3.92,5.38,;2.14,3.4,;.99,4.43,;1.82,1.89,;.35,1.42,;-.89,2.32,;-.89,3.86,;-2.14,1.42,;-3.6,1.89,;-3.92,3.4,;-4.75,.86,;-1.66,-.05,;-2.43,-1.38,;-1.66,-2.71,;-2.43,-4.05,;-1.66,-5.38,;-.12,-5.38,;.65,-4.05,;-.12,-2.71,;.65,-1.38,;-.12,-.05,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C(F)F |(2.64,-.64,;2.96,.86,;4.43,1.34,;4.75,2.85,;3.6,3.88,;3.92,5.38,;2.14,3.4,;.99,4.43,;1.82,1.89,;.35,1.42,;-.89,2.32,;-.89,3.86,;-2.14,1.42,;-3.6,1.89,;-3.92,3.4,;-4.75,.86,;-1.66,-.05,;-2.43,-1.38,;-1.66,-2.71,;-.12,-2.71,;.65,-1.38,;-.12,-.05,;-2.43,-4.05,;-1.66,-5.38,;-3.97,-4.05,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |c:4,7|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |r,c:4,7|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(Br)nc12 |c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(Br)nc12 |c:4,7|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C)cnc12 |c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2nc(C)cnc12 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(c2nc(cnc12)-c1cnccn1)S(C)(=O)=O |(2.83,.02,;3.15,1.53,;4.61,2.01,;4.93,3.51,;3.79,4.54,;4.11,6.05,;2.32,4.07,;1.18,5.1,;2,2.56,;.54,2.08,;-.71,2.99,;-.71,4.53,;-1.96,2.08,;-1.48,.62,;-2.25,-.71,;-1.48,-2.05,;.06,-2.05,;.83,-.71,;.06,.62,;-2.25,-3.38,;-3.79,-3.38,;-4.56,-4.72,;-3.79,-6.05,;-2.25,-6.05,;-1.48,-4.72,;-3.44,2.48,;-4.93,2.88,;-3.84,1,;-3.04,3.97,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C#CC1CCNC1 |(3.18,1.24,;3.5,2.75,;4.97,3.22,;5.29,4.73,;4.14,5.76,;4.46,7.27,;2.68,5.29,;1.53,6.32,;2.36,3.78,;.89,3.3,;-.35,4.21,;-.35,5.75,;-1.6,3.3,;-3.06,3.78,;-3.38,5.29,;-4.21,2.75,;-1.12,1.84,;-1.89,.5,;-1.12,-.83,;.42,-.83,;1.19,.5,;.42,1.84,;-1.89,-2.16,;-2.66,-3.5,;-3.43,-4.83,;-4.97,-4.99,;-5.29,-6.5,;-3.95,-7.27,;-2.81,-6.24,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(CCC3CCNC3)cnc12 |(2.64,1.24,;2.96,2.75,;4.43,3.22,;4.75,4.73,;3.6,5.76,;3.92,7.27,;2.14,5.29,;.99,6.32,;1.82,3.78,;.35,3.3,;-.89,4.21,;-.89,5.75,;-2.14,3.3,;-3.6,3.78,;-3.92,5.29,;-4.75,2.75,;-1.66,1.84,;-2.43,.5,;-1.66,-.83,;-2.43,-2.16,;-1.66,-3.5,;-2.43,-4.83,;-3.96,-4.99,;-4.28,-6.5,;-2.95,-7.27,;-1.81,-6.24,;-.12,-.83,;.65,.5,;-.12,1.84,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(OCc3ccccc3)cnc12 |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-1.66,-6.05,;-2.43,-7.38,;-3.97,-7.38,;-4.74,-6.05,;-3.97,-4.72,;-.12,-.71,;.65,.62,;-.12,1.95,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(NCc3ccccc3)cnc12 |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-1.66,-6.05,;-2.43,-7.38,;-3.97,-7.38,;-4.74,-6.05,;-3.97,-4.72,;-.12,-.71,;.65,.62,;-.12,1.95,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)C#CC(=O)Nc1ccc(F)cc1 |(3.41,3.36,;3.73,4.86,;5.19,5.34,;5.51,6.85,;4.37,7.88,;4.69,9.38,;2.91,7.4,;1.76,8.43,;2.59,5.89,;1.12,5.42,;-.12,6.32,;-.12,7.86,;-1.37,5.42,;-2.84,5.89,;-3.16,7.4,;-3.98,4.86,;-.89,3.95,;-1.66,2.62,;-.89,1.29,;.65,1.29,;1.42,2.62,;.65,3.95,;-1.66,-.05,;-2.43,-1.38,;-3.2,-2.71,;-4.74,-2.71,;-2.43,-4.05,;-3.2,-5.38,;-2.43,-6.72,;-3.2,-8.05,;-4.74,-8.05,;-5.51,-9.38,;-5.51,-6.72,;-4.74,-5.38,)|

Cc1ccc(O)cc1-n1c(N)c(C(N)=O)c2nc(OCc3cccnc3)cnc12 |(2.64,1.36,;2.96,2.86,;4.43,3.34,;4.75,4.85,;3.6,5.88,;3.92,7.38,;2.14,5.4,;1.82,3.89,;.35,3.42,;-.89,4.32,;-.89,5.86,;-2.14,3.42,;-3.6,3.89,;-3.92,5.4,;-4.75,2.86,;-1.66,1.95,;-2.43,.62,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-3.97,-4.72,;-4.74,-6.05,;-3.97,-7.38,;-2.43,-7.38,;-1.66,-6.05,;-.12,-.71,;.65,.62,;-.12,1.95,)|

Cc1cnc2n(c(N)c(C(N)=O)c2n1)-c1c(C)ccc(O)c1C |(-4.67,3.24,;-3.6,2.63,;-2.27,3.4,;-.93,2.63,;-.93,1.09,;.21,.06,;-.42,-1.35,;.2,-2.42,;-1.95,-1.19,;-2.98,-2.34,;-4.18,-2.08,;-2.59,-3.51,;-2.27,.32,;-3.6,1.09,;1.72,.38,;2.83,-.68,;2.54,-1.88,;4.31,-.25,;4.67,1.25,;3.56,2.31,;3.85,3.51,;2.08,1.88,;1.18,2.73,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |r,c:7,t:3|

Cc1ccc(O)c(Br)c1-n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |(2.64,-1.31,;2.96,.2,;4.43,.67,;4.75,2.18,;3.6,3.21,;3.92,4.72,;2.14,2.73,;.99,3.76,;1.82,1.23,;.35,.75,;-.89,1.66,;-.89,3.2,;-2.14,.75,;-3.6,1.23,;-3.92,2.73,;-4.75,.2,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-.12,-3.38,;.65,-2.05,;-.12,-.71,)|

C[C@@H]1CC=C(O)C(Br)=C1n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |r,c:7,t:3|

CC1=C([C@H](Br)[C@H](O)C=C1)n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |r,c:7,t:1|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(C)c(C)nc12 |c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(C)c(C)nc12 |c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)-c1ccccn1 |(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-1.66,-4.72,;-2.43,-6.05,;-3.97,-6.05,;-4.74,-4.72,;-3.97,-3.38,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)-c1ccccn1 |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)-c1ccccn1 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)N1CCCC1=O |(2.77,-.09,;3.09,1.41,;4.55,1.89,;4.87,3.4,;3.73,4.43,;4.05,5.93,;2.26,3.95,;1.12,4.98,;1.94,2.45,;.48,1.97,;-.77,2.87,;-.77,4.41,;-2.01,1.97,;-3.48,2.45,;-3.8,3.95,;-4.62,1.41,;-1.54,.5,;-2.31,-.83,;-1.54,-2.16,;0,-2.16,;.77,-.83,;0,.5,;-2.31,-3.5,;-1.68,-4.9,;-2.83,-5.93,;-4.16,-5.16,;-3.84,-3.66,;-4.87,-2.51,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)N1CCCC1=O |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)N1CCCC1=O |r,c:4,7|

Cc1c(O)ccc(Br)c1-n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |(.99,3.76,;2.14,2.73,;3.6,3.21,;3.92,4.72,;4.75,2.18,;4.43,.67,;2.96,.2,;2.64,-1.31,;1.82,1.23,;.35,.75,;-.89,1.66,;-.89,3.2,;-2.14,.75,;-3.6,1.23,;-3.92,2.73,;-4.75,.2,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-.12,-3.38,;.65,-2.05,;-.12,-.71,)|

CC1=C([C@H](Br)CC=C1O)n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |r,c:6,t:1|

C[C@@H]1[C@H](O)C=CC(Br)=C1n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C1=CCOCC1 |t:25,(2.64,.02,;2.96,1.53,;4.43,2.01,;4.75,3.51,;3.6,4.54,;3.92,6.05,;2.14,4.07,;.99,5.1,;1.82,2.56,;.35,2.08,;-.89,2.99,;-.89,4.53,;-2.14,2.08,;-3.6,2.56,;-3.92,4.07,;-4.75,1.53,;-1.66,.62,;-2.43,-.71,;-1.66,-2.05,;-.12,-2.05,;.65,-.71,;-.12,.62,;-2.43,-3.38,;-3.97,-3.38,;-4.74,-4.72,;-3.97,-6.05,;-2.43,-6.05,;-1.66,-4.72,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C1=CCOCC1 |r,c:7,t:3,25|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C1=CCOCC1 |r,c:4,7,t:25|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C1CCOCC1 |r,c:7,t:3|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)-c1nccs1 |(2.64,-.09,;2.96,1.41,;4.43,1.89,;4.75,3.4,;3.6,4.43,;3.92,5.93,;2.14,3.95,;.99,4.98,;1.82,2.45,;.35,1.97,;-.89,2.87,;-.89,4.41,;-2.14,1.97,;-3.6,2.45,;-3.92,3.95,;-4.75,1.41,;-1.66,.5,;-2.43,-.83,;-1.66,-2.16,;-.12,-2.16,;.65,-.83,;-.12,.5,;-2.43,-3.5,;-1.81,-4.9,;-2.95,-5.93,;-4.28,-5.16,;-3.96,-3.66,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)-c1nccs1 |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)-c1nccs1 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)S(=O)(=O)C1CC1 |(2.64,.13,;2.96,1.63,;4.43,2.11,;4.75,3.62,;3.6,4.65,;3.92,6.15,;2.14,4.17,;.99,5.2,;1.82,2.66,;.35,2.19,;-.89,3.09,;-.89,4.63,;-2.14,2.19,;-3.6,2.66,;-3.92,4.17,;-4.75,1.63,;-1.66,.72,;-2.43,-.61,;-1.66,-1.94,;-.12,-1.94,;.65,-.61,;-.12,.72,;-2.43,-3.28,;-3.77,-2.51,;-3.77,-4.05,;-1.66,-4.61,;-1.66,-6.15,;-.33,-5.38,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(cnc12)C#N |(2.64,-.64,;2.96,.86,;4.43,1.34,;4.75,2.84,;3.6,3.88,;3.92,5.38,;2.14,3.4,;.99,4.43,;1.82,1.89,;.35,1.42,;-.89,2.32,;-.89,3.86,;-2.14,1.42,;-3.6,1.89,;-3.92,3.4,;-4.75,.86,;-1.66,-.05,;-2.43,-1.38,;-1.66,-2.71,;-.12,-2.71,;.65,-1.38,;-.12,-.05,;-2.43,-4.05,;-3.2,-5.38,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2c(C)c(Cl)cnc12 |(2.64,-1.31,;2.96,.2,;4.43,.67,;4.75,2.18,;3.6,3.21,;3.92,4.72,;2.14,2.73,;.99,3.76,;1.82,1.23,;.35,.75,;-.89,1.66,;-.89,3.2,;-2.14,.75,;-3.6,1.23,;-3.92,2.73,;-4.75,.2,;-1.66,-.71,;-2.43,-2.05,;-3.97,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-.12,-3.38,;.65,-2.05,;-.12,-.71,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2c(C)c(Cl)cnc12 |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2c(C)c(Cl)cnc12 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2c(Cl)c(Cl)cnc12 |(2.64,-1.31,;2.96,.2,;4.43,.67,;4.75,2.18,;3.6,3.21,;3.92,4.72,;2.14,2.73,;.99,3.76,;1.82,1.23,;.35,.75,;-.89,1.66,;-.89,3.2,;-2.14,.75,;-3.6,1.23,;-3.92,2.73,;-4.75,.2,;-1.66,-.71,;-2.43,-2.05,;-3.97,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-.12,-3.38,;.65,-2.05,;-.12,-.71,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2c(Cl)c(Cl)cnc12 |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2c(Cl)c(Cl)cnc12 |r,c:4,7|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cc(I)cnc12 |(2.64,-1.31,;2.96,.2,;4.43,.67,;4.75,2.18,;3.6,3.21,;3.92,4.72,;2.14,2.73,;.99,3.76,;1.82,1.23,;.35,.75,;-.89,1.66,;-.89,3.2,;-2.14,.75,;-3.6,1.23,;-3.92,2.73,;-4.75,.2,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-.12,-3.38,;.65,-2.05,;-.12,-.71,)|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(I)cnc12 |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(I)cnc12 |r,c:4,7|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C(C)(C)O |r,c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(cnc12)C(C)(C)O |r,c:4,7|

C[C@@H]1CC=C(O)C(C)=C1n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |c:7,t:3|

C[C@@H]1[C@H](O)C=CC(C)=C1n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |r,c:4,7|

Cc1ccc(O)c(Cl)c1-n1c(N)c(C(N)=O)c2cc(Cl)cnc12 |(2.64,-1.31,;2.96,.2,;4.43,.67,;4.75,2.18,;3.6,3.21,;3.92,4.72,;2.14,2.73,;.99,3.76,;1.82,1.23,;.35,.75,;-.89,1.66,;-.89,3.2,;-2.14,.75,;-3.6,1.23,;-3.92,2.73,;-4.75,.2,;-1.66,-.71,;-2.43,-2.05,;-1.66,-3.38,;-2.43,-4.72,;-.12,-3.38,;.65,-2.05,;-.12,-.71,)|

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2cccnc12 |(2.64,-1.98,;2.96,-.47,;4.43,.01,;4.75,1.51,;3.6,2.54,;3.92,4.05,;2.14,2.07,;.99,3.1,;1.82,.56,;.35,.08,;-.89,.99,;-.89,2.53,;-2.14,.08,;-3.6,.56,;-3.92,2.07,;-4.75,-.47,;-1.66,-1.38,;-2.43,-2.71,;-1.66,-4.05,;-.12,-4.05,;.65,-2.71,;-.12,-1.38,)|

Cc1ccc(O)c(C)c1-n1nc(-c2nccs2)c(C(N)=O)c1N

Cc1ccc(O)c(C)c1-n1nc(-c2nccs2)c(C(N)=O)c1N

Cc1ccc(O)c(C)c1n3nc(c2nc(C(F)(F)F)cs2)c(C(N)=O)c3N

Cc1csc(-c2nn(-c3c(C)ccc(O)c3C)c(N)c2C(N)=O)n1

Cc1cnc(-c2nn(-c3c(C)ccc(O)c3C)c(N)c2C(N)=O)s1

Cc1c(O)ccc(Cl)c1-n1nc(-c2nccs2)c(C(N)=O)c1N

Cc1c(O)ccc(Cl)c1-n1nc(-c2nc3cnccc3s2)c(C(N)=O)c1N

Cc1ccc(O)c(C)c1-n1nc(-c2ccn(CC(C)(C)O)n2)c(C(N)=O)c1N

Cc1ccc(O)c(C)c1-n1nc(-c2ccn(C(F)F)n2)c(C(N)=O)c1N

Cc1ccc(O)c(C)c1n3nc(c2ccc(C(F)(F)F)cn2)c(C(N)=O)c3N

Cc1ccc(O)c(C)c1-n1nc(-c2ncc3n2CCCC3)c(C(N)=O)c1N

Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl

CCN(CC)CCOc1ccc(cc1)Nc2ncc3c(n2)N(C(=O)C(=C3)c4c(cccc4Cl)Cl)C

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3cncc3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3ccnc3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3cnnc3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCc3noc(C)c3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3c(cnc3C(C)(C)O)C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3ncc(Cl)c3C2)c2nc(C)c(C)nc21

N#Cc1cnn2c1CN(C(=O)c1c(N)n(-c3c(C)ccc(O)c3C)c3nc(C)c(C)nc13)CC2

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3ncc(C(F)(F)F)c3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nc(C(F)(F)F)cc3C2)c2nc(C)c(C)nc21

Cc1cc2n(n1)CCN(C(=O)c1c(N)n(-c3c(C)ccc(O)c3C)c3nc(C)c(C)nc13)C2

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCc3nccnc3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3c(cccc3=O)C2)c2nc(C)c(C)nc21

CC(=O)N1CCN(C(=O)c2c(N)n(-c3c(C)ccc(O)c3C)c3nc(C)c(C)nc23)CC1

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCS(=O)(=O)CC2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2nc(C3CC3)c(C)nc21

CC#Cc1nc2c(C(=O)N3CCn4ncnc4C3)c(N)n(-c3c(C)ccc(O)c3C)c2nc1C

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2nc(C3=CCOCC3)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2nc(C)c(C3CCN(C)CC3)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2nc(C)c(N3CCC[C@@H](O)C3)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2nc(C3CC3)cnc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2ncc(C(F)(F)F)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(C)c(C)nc12 |(2.54,-2.44,;2.83,-1.24,;4.31,-.81,;4.67,.68,;3.56,1.75,;3.85,2.95,;2.08,1.31,;1.18,2.16,;1.72,-.18,;.21,-.5,;-.42,-1.91,;.2,-2.98,;-1.95,-1.75,;-2.98,-2.9,;-4.18,-2.64,;-2.59,-4.07,;-2.27,-.25,;-3.6,.52,;-3.6,2.07,;-4.67,2.68,;-2.27,2.84,;-2.27,4.07,;-.93,2.07,;-.93,.52,)|

Cc1ncc2c(C(=O)N3CCn4ncnc4C3)c(N)n(-c3c(C)ccc(O)c3C)c2n1

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3ncnc3C2)c2nc(C)c(C)nc21

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nccc3C2)c2cc(Cl)cnc21

Cc1ccc2c(n1)c(C(=O)N1CCn3nc(C(F)(F)F)nc3C1)c(N)n2-c1c(C)ccc(O)c1C

Cc1ccc(O)c(C)c1-n1c(N)c(C(=O)N2CCn3nc(C(F)(F)F)nc3C2)c2nc(C)c(C)nc21

Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl