10653 SMILES Strings for Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform

Compound Name
SMILES String
O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Cc1nc2ccccn2c1-c1ccn(n1)S(=O)(=O)c1ccc(F)cc1
Cc1nc2ccc(Br)cn2c1-c1ccn(n1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CC(=NNS(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1c(C)nc2ccc(Br)cn12 |w:2.2|
CC(=NNS(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnc2ccc(Br)cn12 |w:2.2|
Cc1ccc(cc1S(=O)(=O)NN=Cc1cnc2ccc(Br)cn12)[N+]([O-])=O |w:12.13|
CN(N=C(C)c1c(C)nc2ccc(Br)cn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O |w:2.1|
CN(N=C(C)c1cnc2ccc(Br)cn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O |w:2.1|
Cc1ccc(cc1S(=O)(=O)N(C)/N=C/c2cnc3n2cc(cc3)Br)[N+](=O)[O-]
CN(\N=C\c1cnc2ccc(Cl)cn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnc2ccc(F)cn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnc2ccc(cn12)C(F)(F)F)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnc2ccc(C)cn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnc2ccc(cn12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CCOC(=O)c1ccc2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)n2c1
CN(\N=C\c1cnc2ccc(cn12)C(N)=O)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Oc1cccc(c1)-c1nc(N2CCOCC2)c2sccc2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Cc1nc2ccc(Cl)cn2c1-c1ccn(n1)S(=O)(=O)c1ccc(F)cc1
Cc1nc2ccc(Cl)cn2c1-c1ccn(n1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Cc1nc2ccc(Cl)cn2c1-c1ccn(n1)S(=O)(=O)c1cccc(c1)[N+]([O-])=O
Cc1nc2ccc(Cl)cn2c1-c1ccn(n1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)n1ccc(n1)-c1cnc2ccc(Br)cn12)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)n1ccc(c1)-c1cnc2ccc(Cl)cn12)[N+]([O-])=O
Cc1ccc(cc1Sc1nc(cs1)-c1cnc2ccc(Cl)cn12)[N+]([O-])=O
Cc1ccc(cc1S(=O)c1nc(cs1)-c1cnc2ccc(Cl)cn12)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)c1nc(cs1)-c1cnc2ccc(Cl)cn12)[N+]([O-])=O
OCc1ccc(cc1S(=O)c1nc(cs1)-c1cnc2ccc(Cl)cn12)[N+]([O-])=O
COc1ccc(cc1OC)-c1nn(C2CCC2)c2ncnc(N)c12
COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C([C@@H]2CCC(=O)[C@@]2(C)C[C@H]1OC(C)=O)C3=O |r,t:16|
COC[C@H]1OC(=O)C(=CNCCCCC(NC(C)=O)C(O)=O)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)[C@H]3CCC4=O)OC(C)=O)[C@@]12C |r,w:8.8,t:27|
COC[C@H]1OC(=O)C(=CN2CCCC2C(O)=O)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)[C@H]3CCC4=O)OC(C)=O)[C@@]12C |r,w:8.8,t:23|
COC[C@H]1OC(=O)C(CSCC(NC(C)=O)C(O)=O)=C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)C3CCC4=O)OC(C)=O)[C@@]12C |r,t:18,24|
COC[C@H]1OC(=O)C(=CN(C)CCCCCC(O)=O)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)[C@H]3CCC4=O)OC(C)=O)[C@@]12C |r,w:8.8,t:24|
Cc1ccccc1-n1c(Cn2ncc3c(N)cccc23)nc2cccc(C)c2c1=O |(3.13,1.21,;3.13,2.75,;4.47,3.52,;4.47,5.06,;3.13,5.83,;1.8,5.06,;1.8,3.52,;.47,2.75,;.47,1.21,;1.8,.44,;1.8,-1.1,;.6,-2.07,;1.16,-3.51,;2.69,-3.32,;3.78,-4.41,;3.38,-5.89,;5.27,-4.01,;5.67,-2.52,;4.58,-1.43,;3.09,-1.83,;-.87,.44,;-2.2,1.21,;-3.53,.44,;-4.87,1.21,;-4.87,2.75,;-3.53,3.52,;-3.53,5.06,;-2.2,2.75,;-.87,3.52,;-.87,5.06,)|
Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O |(-2.34,-2.43,;-2.02,-3.93,;-3.16,-4.96,;-2.84,-6.46,;-1.38,-6.94,;-.23,-5.91,;-.55,-4.4,;.59,-3.38,;.27,-1.87,;-1.2,-1.4,;-1.67,.06,;-.77,1.31,;-1.67,2.55,;-1.2,4.01,;-2.23,5.16,;-1.75,6.62,;-.25,6.94,;.78,5.8,;2.28,6.12,;.31,4.33,;-3.14,2.08,;-4.47,2.85,;-4.47,4.38,;-5.8,2.08,;-5.8,.54,;-4.47,-.23,;-3.14,.54,;1.41,-.84,;2.88,-1.32,;4.02,-.29,;5.48,-.76,;5.8,-2.27,;4.66,-3.3,;4.98,-4.8,;3.2,-2.82,;2.05,-3.85,;2.37,-5.35,)|
Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O |(2.8,1.32,;2.8,2.86,;4.14,3.63,;4.14,5.17,;2.8,5.94,;1.47,5.17,;1.47,3.63,;.14,2.86,;.14,1.32,;1.47,.55,;1.47,-.99,;.27,-1.96,;.83,-3.4,;-.01,-4.69,;-1.5,-4.29,;-2.59,-5.38,;-4.13,-5.38,;-2.19,-6.87,;-.7,-7.26,;-.3,-8.75,;.39,-6.18,;2.36,-3.32,;3.45,-4.41,;3.05,-5.89,;4.94,-4.01,;5.34,-2.52,;4.25,-1.43,;2.76,-1.83,;-1.2,.55,;-2.53,1.32,;-3.86,.55,;-5.2,1.32,;-5.2,2.86,;-3.86,3.63,;-3.86,5.17,;-2.53,2.86,;-1.2,3.63,;-1.2,5.17,)|
Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O |(2.8,1.32,;2.8,2.86,;4.14,3.63,;4.14,5.17,;2.8,5.94,;1.47,5.17,;1.47,3.63,;.14,2.86,;.14,1.32,;1.47,.55,;1.47,-.99,;.27,-1.96,;.83,-3.4,;-.01,-4.69,;.39,-6.18,;-.7,-7.26,;-2.19,-6.87,;-3.52,-7.64,;-2.59,-5.38,;-4.13,-5.38,;-1.5,-4.29,;2.36,-3.32,;3.45,-4.41,;3.05,-5.89,;4.94,-4.01,;5.34,-2.52,;4.25,-1.43,;2.76,-1.83,;-1.2,.55,;-2.53,1.32,;-3.86,.55,;-5.2,1.32,;-5.2,2.86,;-3.86,3.63,;-3.86,5.17,;-2.53,2.86,;-1.2,3.63,;-1.2,5.17,)|
Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O |(2.8,1.32,;2.8,2.86,;4.14,3.63,;4.14,5.17,;2.8,5.94,;1.47,5.17,;1.47,3.63,;.14,2.86,;.14,1.32,;1.47,.55,;1.47,-.99,;.27,-1.96,;.83,-3.4,;-.01,-4.69,;.39,-6.18,;-.7,-7.26,;-2.19,-6.87,;-3.28,-7.96,;-2.59,-5.38,;-4.08,-4.98,;-1.5,-4.29,;2.36,-3.32,;3.45,-4.41,;3.05,-5.89,;4.94,-4.01,;5.34,-2.52,;4.25,-1.43,;2.76,-1.83,;-1.2,.55,;-2.53,1.32,;-3.86,.55,;-5.2,1.32,;-5.2,2.86,;-3.86,3.63,;-3.86,5.17,;-2.53,2.86,;-1.2,3.63,;-1.2,5.17,)|
Cc1ccccc1-n1c(Cn2nc(-c3cccc4[nH]ccc34)c3c(N)cccc23)nc2cccc(C)c2c1=O |(2.8,1.32,;2.8,2.86,;4.14,3.63,;4.14,5.17,;2.8,5.94,;1.47,5.17,;1.47,3.63,;.14,2.86,;.14,1.32,;1.47,.55,;1.47,-.99,;.27,-1.96,;.83,-3.4,;-.01,-4.69,;.39,-6.18,;-.7,-7.26,;-2.19,-6.87,;-2.59,-5.38,;-3.96,-4.68,;-3.72,-3.16,;-2.2,-2.92,;-1.5,-4.29,;2.36,-3.32,;3.45,-4.41,;3.05,-5.89,;4.94,-4.01,;5.34,-2.52,;4.25,-1.43,;2.76,-1.83,;-1.2,.55,;-2.53,1.32,;-3.86,.55,;-5.2,1.32,;-5.2,2.86,;-3.86,3.63,;-3.86,5.17,;-2.53,2.86,;-1.2,3.63,;-1.2,5.17,)|
Cc1ccccc1-n1c(Cn2nc(C#CCO)c3c(N)cccc23)nc2cccc(C)c2c1=O |(2.8,1.32,;2.8,2.86,;4.14,3.63,;4.14,5.17,;2.8,5.94,;1.47,5.17,;1.47,3.63,;.14,2.86,;.14,1.32,;1.47,.55,;1.47,-.99,;.27,-1.96,;.83,-3.4,;-.01,-4.69,;-.85,-5.98,;-1.69,-7.27,;-3.23,-7.27,;2.36,-3.32,;3.45,-4.41,;3.05,-5.89,;4.94,-4.01,;5.34,-2.52,;4.25,-1.43,;2.76,-1.83,;-1.2,.55,;-2.53,1.32,;-3.86,.55,;-5.2,1.32,;-5.2,2.86,;-3.86,3.63,;-3.86,5.17,;-2.53,2.86,;-1.2,3.63,;-1.2,5.17,)|
COc1ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc2c1OC |c:22,t:6|
c1cc2c(cc1C=C3C(=O)NC(=O)S3)nccn2
CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)cc3)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1cccc(O)c1
CCNC(=O)Nc1ccc2ncc(Nc3cccc(C)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccccc3C)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(OP(O)(O)=O)c(OC)c1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1cc(Cl)c(O)c(OC)c1
CCNC(=O)Nc1ccc2ncc(Nc3ccc4ccccc4c3)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(O)c(OC)c1
CCCC1=NC=CC1c1cc(ccc1S(C)(=O)=O)-c1cnc(NC(=O)N2CCCC2C(N)=O)s1 |c:5,t:3|
CC(C)(C)c1nccc(n1)-c1cnc(NC(=O)N2CCCC2C(N)=O)s1
CC(C)(C)c1cc(ccn1)-c1cnc(NC(=O)N2CCCC2C(N)=O)s1
CC(C)(C)c1nccc(n1)-c1cnc(NC(=O)N2CC3CC3C2C(N)=O)s1
CC1(CC1)c1cc(ccn1)-c1cnc(NC(=O)N2CCC[C@]2(C)C(N)=O)s1 |r|
COCCN(C)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(C)CC2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(CCO)CC2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCOCC2)c1
CN1CCN(CC1)c1nc(Nc2cccc(Cl)c2)c2cnn(C)c2n1
CC1CN(CC(C)O1)c1nc(Nc2ccccc2)c2cnn(C)c2n1
Cn1ncc2c(nc(nc12)-c1cccc(O)c1)N1CCOCC1
Cn1ncc2c(OCc3ccccc3)nc(nc12)N1CCOCC1
Cn1ncc2c(NCc3ccccc3)nc(nc12)N1CCOCC1
Cn1ncc2c(SCc3ccccc3)nc(nc12)N1CCOCC1
Cn1ncc2c(Oc3ccc(Cl)cc3)nc(nc12)N1CCOCC1
Cn1ncc2c1nc([nH]c2=O)N1CCOCC1
CC(C)Oc1nc(nc2n(C)ncc12)N1CCOCC1
Cn1ncc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1
Cn1ncc2c(nc(nc12)N1CCOCC1)-c1cccc(NS(C)(=O)=O)c1
Cc1cccc(Oc2nc(nc3n(C)ncc23)N2CCOCC2)c1
COC(=O)c1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C)c2n1
COc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C)c2n1
CSc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C)c2n1
CC(=O)Nc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C)c2n1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1F)C#Cc1c(C)ncnc1N1CCOCC1
CCCS(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
COc1cccc(c1)S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1Cl)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1cccc(F)c1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1c(F)cccc1F)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1Br)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1cn(C)cn1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1cccs1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ccccc1S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
COCCS(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1C(F)(F)F)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)C#Cc1c(C)ncnc1N1CCCCC1
CC(C)N(C)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CN(C1CCOCC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CC(=O)N1CCN(CC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CN1CCN(CC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2F)c1
Cc1ncnc(N2CCOCC2)c1C#Cc1cncc(NS(=O)(=O)c2ccccc2)c1
Cc1ncnc(N2CCOCC2)c1C#Cc1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1
Cc1ncnc(N2CCOCC2)c1C#Cc1cncc(NS(=O)(=O)c2cccs2)c1
Cc1ncnc(N2CCOCC2)c1C#Cc1cncc(NS(=O)(=O)c2cccnc2)c1
Cc1ncnc(N2CCOCC2)c1C#Cc1cncc(NS(=O)(=O)c2cnn(C)c2)c1
Cc1ncnc(N2CCOCC2)c1C#Cc1cncc(NS(C)(=O)=O)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)c2ccccc2)c1
CCc1ncnc(N(C)C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1
CCc1ncnc(N2CCN(CC2)C2CC2)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1cc(F)cc(F)c1)C#Cc1c(C)ncnc1N1CCOCC1
CCc1ncnc(N(C)C)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1ncnc(NC)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1nc(N)nc(N2CCC(CC2)OC)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1nc(N)nc(N2CCC(O)CC2)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1nc(N)nc(N2CCCCC2)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
Cc1ncc(cc1NS(C)(=O)=O)C#Cc1c(C)ncnc1N1CCOCC1
CC(C)S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)C1CCCCC1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncnc(N2CCOCC2)c1C#Cc1c[nH]c(=O)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CCc1ncnc(N2CCC(C)(O)CC2)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1nc(N)nc(N2CCC(C)(O)CC2)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1ncnc(N2CCCCC2)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1cnc(C)c(NS(C)(=O)=O)c1
Cc1oncc1S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1cc(c(C)s1)S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccco1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccoc1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1cnn(C)c1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1noc(C)c1S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1cccnc1)C#Cc1c(C)ncnc1N1CCOCC1
Cc1nc(cn1C)S(=O)(=O)Nc1cc(cnc1C)C#Cc1c(C)ncnc1N1CCOCC1
Cc1ncc(cc1NS(=O)(=O)c1ccnn1C)C#Cc1c(C)ncnc1N1CCOCC1
COCCN1CCN(CC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1)C#Cc1c(C)ncnc1N1CCN(CC1)C1CC1
CC(C)Nc1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
CN1CCN(CC1=O)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
CC(=O)N1CCN(CC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
CC(=O)N1CCCN(CC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1)C#Cc1c(C)ncnc1N1CCCCC1
Cc1ncc(cc1NS(=O)(=O)N1CCCC1)C#Cc1c(C)ncnc1N1CCOCC1
CCc1ncnc(N2CCN(C)CC2)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1
CCc1ncnc(N2CCN(CC2)S(C)(=O)=O)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1
CCc1ncnc(N2CCN(CC2)C(C)=O)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2)c1
C[C@@H]1COCCN1c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1 |r|
C[C@H]1COCCN1c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1 |r|
CN(CC1CCOC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
Cc1ncc(cc1NS(=O)(=O)c1ccccc1)C#Cc1c(C)ncnc1N1CCCOCC1
COC1CCN(CC1)c1ncnc(C)c1C#Cc1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(C)(=O)=O)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)CC)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)C2CC2)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)CCOC)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)c2cccs2)c1
CCc1ncnc(N2CCOCC2)c1C#Cc1cnc(OC)c(NS(=O)(=O)c2ccco2)c1
COc1ncc(cc1NS(C)(=O)=O)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccccc1OC(F)(F)F)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccccc1C(F)(F)F)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)cc1)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1cccs1)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccnn1C)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1cnn(C)c1)C#Cc1c(C)ncnc1N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(C)o1)C#Cc1c(C)ncnc1N1CCOCC1
COc1cccc(c1)-c1nc(nc2c(Cl)cc(nc12)C(O)=O)N1CCOCC1
COc1cccc(c1)-c1nc(nc2ccc(nc12)C(O)=O)N1CCOCC1
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)cc1)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)cc1)C(O)=O
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)cc1)C(O)=O
COCCOc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)cc1)C(O)=O
OCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)cc1)C(O)=O
OC(=O)c1ccc2nc(nc(-c3ccc(O)cc3)c2n1)N1CCOCC1
OC(=O)c1cc(Cl)c2nc(nc(-c3cccc(O)c3)c2n1)N1CCOCC1
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
COCCOc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
OCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
COc1ccccc1-c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(O)cc(F)c1)C(O)=O
COCCOc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(O)cc(F)c1)C(O)=O
OCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(O)cc(F)c1)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc2[nH]ccc12)C(O)=O
CNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc2[nH]ccc12)C(O)=O
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc2[nH]ccc12)C(O)=O
CN(CCO)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc2[nH]ccc12)C(O)=O
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc2[nH]ccc2c1)C(O)=O
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(CO)cc1)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(CO)c1)C(O)=O
CN(CCO)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(CO)c1)C(O)=O
COCc1cccc(c1)-c1nc(nc2c(cc(nc12)C(O)=O)N(C)C)N1CCOCC1
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(COC)c1)C(O)=O
COCc1cccc(c1)-c1nc(nc2c(cc(nc12)C(O)=O)N(C)CCO)N1CCOCC1
COCc1cccc(c1)-c1nc(nc2c(NCCO)cc(nc12)C(O)=O)N1CCOCC1
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(F)ccc1O)C(O)=O
CNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(F)ccc1O)C(O)=O
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(F)ccc1O)C(O)=O
CN(C)CCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(F)ccc1O)C(O)=O
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
CNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
CN(CCO)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
OCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
CS(=O)(=O)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(F)c1O)C(O)=O
CNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
OC(=O)c1ccc2nc(nc(-c3cccc(O)c3)c2n1)N1CCOCC1
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccccc1O)C(O)=O
CN(C)CCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccccc1O)C(O)=O
OCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccccc1O)C(O)=O
CS(=O)(=O)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)c(F)c1)C(O)=O
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(CO)cc1)C(O)=O
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(CO)c1)C(O)=O
OCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(CO)c1)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)c(CO)c1)C(O)=O
CN(CCO)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)c(CO)c1)C(O)=O
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)cc1O)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)cc1O)C(O)=O
CNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)cc1O)C(O)=O
COCCNc1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)cc1O)C(O)=O
CS(=O)(=O)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(F)ccc1O)C(O)=O
CS(=O)(=O)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(O)cc(F)c1)C(O)=O
CN(C)CCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc2[nH]ccc12)C(O)=O
CN(CCO)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(O)cc1C)C(O)=O
CN(CCO)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccc(F)cc1O)C(O)=O
CC(=O)N1CCN(CC1)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
CS(=O)(=O)N1CCN(CC1)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
Cc1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(O)c1)C(O)=O
OC(=O)c1cc(-c2cccc3ccccc23)c2nc(nc(-c3cccc(O)c3)c2n1)N1CCOCC1
OC(=O)c1cc(Cl)c2nc(nc(-c3ccccc3)c2n1)N1CCOCC1
COCCN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cc(F)cc(F)c1)C(O)=O
CN(C)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1cccc(c1)C#N)C(O)=O
CS(=O)(=O)N1CCN(CC1)c1cc(nc2c(nc(nc12)N1CCOCC1)-c1ccccc1)C(O)=O
Cc1ncnc(N2CCOC(C)(C)C2)c1C#Cc1ccc(N)nc1
COCCN1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCS(=O)CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC2)C2CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCCOCC2)c1C#Cc1ccc(N)nc1
CC(=O)N1CCCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
C[C@H]1CN(C[C@@H](C)O1)c1ncnc(C)c1C#Cc1ccc(N)nc1 |r|
Cc1ncnc(N2CCNC(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)C(C)(C)O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C2CCCCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
[#6]-[#6]-c1ncnc(-[#7]-2-[#6]-[#6]-[#6](-[#6]-[#6]-2)\[#6]=[#6](\[#6])-[#6])c1C#Cc1ccc(-[#7])nc1
CCc1ncnc(N2CCC(O)(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(Cc3ccccc3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CCO)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCC(C2)NC(C)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)NC(C)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CC2)OCCO3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(C)(O)CC2)c1C#Cc1ccc(N)nc1
CC(=O)NC1CCCN(C1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CC(=O)NC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC3(CC2)OCCO3)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(O)(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(O)(Cc3ccccc3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CCO)CC2)c1C#Cc1ccc(C)nc1
Cc1ncnc(N2CCC(CCO)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(F)(F)F)c1C#Cc1ccc(C)nc1
Cc1ncnc(N2CCC(O)(CC2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC)CC2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(O)(CC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(C)C)c1C#Cc1ccc(C)nc1
CCC1(O)CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OCCOC)c1C#Cc1ccc(N)nc1
COC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(COC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(C)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(F)(F)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CO)CC2)c1C#Cc1ccc(N)nc1
CCOC1CCN(CC1)c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCC(CO)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCOC(C)(C)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCS(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCS(=O)(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCNC(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCOC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(C)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(C)(CC2)OC)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC3(CC2)OCCCO3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CC2)OCCCO3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)C(C)C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(=O)CC2)c1C#Cc1ccc(N)nc1
CC(C)C1(O)CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CC1CN(CCC1O)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1ccc(C)nc1
CCOC1CCN(CC1)c1ncnc(CC)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCCC(CO)C2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(CO)CC2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(C)(O)CC2)c1C#Cc1ccc(C)nc1
Cc1ncnc(N2CCC(O)(CC2)C2CCCCC2)c1C#Cc1ccc(N)nc1
CN1CCC2(CCN(CC2)c2ncnc(C)c2C#Cc2ccc(N)nc2)C1=O
Cc1cnc2CN(CCn12)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(C)C3=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCn3c(C)cnc3C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
CN1CCC2(CC1)CCN(CC2)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CC2)CC(=O)NC(=O)C3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(C)CC3)CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC3(CCNC3=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCNC3=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1ccc(NC)nc1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1ccc(NC)nc1
CN(C)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)CCN(C)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
COCCNC(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCNC(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CC(=O)N3CCOCC3)CC2)c1C#Cc1ccc(N)nc1
CCN(C)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)CCNC(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCCCCC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CNC(=O)CC3CCCC3)CC2)c1C#Cc1ccc(N)nc1
CN(C)CC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
COCCC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CNC(=O)C3CCCCC3)CC2)c1C#Cc1ccc(N)nc1
CC(C)CC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)NC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)c2ccccn2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)CC#N)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)C2CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)OC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)c2ccco2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC2)C(=O)C2CCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC2)C(=O)c2ccno2)c1C#Cc1ccc(N)nc1
Cc1ccc(o1)C(=O)N1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(CC3)C(C)=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(CC3)C(=O)COC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(CC3)C(=O)NC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCCC2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(N2CCc3ncccc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCCCC3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCNC(=O)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(COC3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCn3c(COC)nnc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCN3CCOCC3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2CCN(C)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3ncncc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(C)C(=O)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCNS(C)(=O)=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCCS(C)(=O)=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3ccccc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3cc(OC)c(OC)cc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccccc2C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC(C)O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccccn2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccncc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2cccnc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ncccn2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2COC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3c(C2)ncnc3N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(Cc3nc(C)c(C)o3)CC2)c1C#Cc1ccc(N)nc1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cnc(N)cn1
CNc1nc(C)c2cc(-c3cnc(N)c(OC[C@H](C)N)n3)c(=O)n(C3CCCC3)c2n1 |r|
CNc1nc(C)c2cc(-c3ccc(O)c(OC)c3)c(=O)n(C3CCCC3)c2n1
CNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n(CC=C)c2n1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1ccc(Cl)nc1
CNc1nc(C)c2cc(-c3cnc4[nH]ccc4c3)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(CCC(N)=O)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(CCC(=O)Nc3ncc[nH]3)c(=O)n(C3CCCC3)c2n1
CNc1nc(C)c2cc(-c3cn[nH]c3)c(=O)n(C3CCCC3)c2n1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cccnc1N
COc1ncccc1-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
CNc1nc(C)c2cc(-c3cccnc3OC)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(-c3cccnc3N)c(=O)n(C3CCCC3)c2n1
CNc1nc(C)c2cc(-c3ncccc3F)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(-c3cnc4[nH]ccc4c3)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(-c3ccc(O)c(OC)c3)c(=O)n(C3CCCC3)c2n1
COc1cc(ccc1O)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
CNc1nc(C)c2cc(-c3ccc(Cl)nc3)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n(C3CCCC3)c2n1
CNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n(C3CCCC3)c2n1
CCOC(=O)c1cccc(c1)-c1cc2c(C)nc(NC)nc2n(C2CCCC2)c1=O
CCNc1nc(C)c2cc(-c3cccc(OC)c3)c(=O)n(C3CCCC3)c2n1
CNc1nc(C)c2cc(-c3cccc(OC)c3)c(=O)n(C3CCCC3)c2n1
CCNc1nc(C)c2cc(-c3cccc(O)c3)c(=O)n(C3CCCC3)c2n1
COc1cccc(c1)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
CNc1nc(C)c2cc(-c3cccc(O)c3)c(=O)n(C3CCCC3)c2n1
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:8.7,wD:11.11,(-2.52,4.49,;-2.52,2.95,;-3.85,2.18,;-3.85,.64,;-5.19,-.13,;-2.52,-.13,;-1.18,.64,;.15,-.13,;.15,-1.67,;1.48,-2.44,;1.48,-3.98,;.15,-4.75,;.15,-6.29,;-1.18,-3.98,;-1.18,-2.44,;1.48,.64,;2.82,-.13,;1.48,2.18,;.15,2.95,;-1.18,2.18,;2.82,2.95,;4.28,2.47,;5.19,3.72,;4.28,4.96,;5.05,6.29,;2.82,4.49,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@H](O)C2)c1=O |r|
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:8.7,wD:11.11,(-2.52,4.49,;-2.52,2.95,;-3.85,2.18,;-3.85,.64,;-5.19,-.13,;-2.52,-.13,;-1.18,.64,;.15,-.13,;.15,-1.67,;1.48,-2.44,;1.48,-3.98,;.15,-4.75,;.15,-6.29,;-1.18,-3.98,;-1.18,-2.44,;1.48,.64,;2.82,-.13,;1.48,2.18,;.15,2.95,;-1.18,2.18,;2.82,2.95,;4.28,2.47,;5.19,3.72,;4.28,4.96,;2.82,4.49,)|
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(Br)cc12 |r,wU:8.7,wD:11.11,(-1.33,5.39,;-1.33,3.85,;-2.67,3.08,;-2.67,1.54,;-4,.77,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;2.67,-1.54,;2.67,-3.08,;1.33,-3.85,;1.33,-5.39,;,-3.08,;,-1.54,;2.67,1.54,;4,.77,;2.67,3.08,;4,3.85,;1.33,3.85,;,3.08,)|
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1 |r,wU:8.7,wD:11.11,(-3.85,4.49,;-3.85,2.95,;-5.19,2.18,;-5.19,.64,;-6.52,-.13,;-3.85,-.13,;-2.52,.64,;-1.18,-.13,;-1.18,-1.67,;.15,-2.44,;.15,-3.98,;-1.18,-4.75,;-1.18,-6.29,;-2.52,-3.98,;-2.52,-2.44,;.15,.64,;1.48,-.13,;.15,2.18,;-1.18,2.95,;-2.52,2.18,;1.48,2.95,;1.48,4.49,;2.82,5.26,;4.15,4.49,;5.61,4.96,;6.52,3.72,;5.61,2.47,;4.15,2.95,;2.82,2.18,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](O)C2)c1=O |r|
Cc1nc(N)nc2n([C@@H]3CC[C@H](O)C3)c(=O)c(Br)cc12 |r|
Cc1nc(N)nc2n([C@@H]3CC[C@H](O)C3)c(=O)c(cc12)-c1cnn(C)c1 |r|
Cc1nc(N)nc2n([C@@H]3CC[C@H](O)C3)c(=O)c(cc12)-c1cn[nH]c1 |r|
Cc1nc(N)nc2n([C@@H]3CC[C@H](O)C3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1 |r|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](O)C3)c(=O)c(cc12)-c1cnn(C)c1 |r|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](O)C3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1 |r|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](O)C3)c(=O)c(cc12)-c1cn[nH]c1 |r|
Cc1nc(N)nc2n(CC(C)(C)O)c(=O)c(Br)cc12
Cc1nc(N)nc2n([C@@H]3CC[C@H](O)CC3)c(=O)c(Br)cc12 |r,wU:8.7,11.11,(-1.33,5.39,;-1.33,3.85,;-2.67,3.08,;-2.67,1.54,;-4,.77,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;,-3.08,;1.33,-3.85,;1.33,-5.39,;2.67,-3.08,;2.67,-1.54,;2.67,1.54,;4,.77,;2.67,3.08,;4,3.85,;1.33,3.85,;,3.08,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC(C)(C)O)c1=O
Cc1nc(N)nc2n(CC(C)(C)O)c(=O)c(cc12)-c1ccc(F)cc1
Cc1nc(N)nc2n([C@@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1 |r,wU:8.7,11.11,(-3.85,4.49,;-3.85,2.95,;-5.19,2.18,;-5.19,.64,;-6.52,-.13,;-3.85,-.13,;-2.52,.64,;-1.18,-.13,;-1.18,-1.67,;-2.52,-2.44,;-2.52,-3.98,;-1.18,-4.75,;-1.18,-6.29,;.15,-3.98,;.15,-2.44,;.15,.64,;1.48,-.13,;.15,2.18,;-1.18,2.95,;-2.52,2.18,;1.48,2.95,;1.48,4.49,;2.82,5.26,;4.15,4.49,;5.61,4.96,;6.52,3.72,;5.61,2.47,;4.15,2.95,;2.82,2.18,)|
Cc1nc(N)nc2n(CC(C)(C)O)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
Cc1nc(N)nc2n(CC(C)(C)O)c(=O)c(cc12)-c1cnc2ccccc2c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@H](O)CC2)c1=O |r,wU:19.20,22.24,(6,6.54,;6,5,;4.67,4.23,;4.67,2.69,;3.33,1.93,;2,2.69,;2,4.23,;3.33,5,;.67,1.93,;-.67,2.69,;-2,1.93,;-3.33,2.69,;-3.33,4.23,;-4.67,1.93,;-4.67,.38,;-6,-.38,;-3.33,-.38,;-2,.38,;-.67,-.38,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-.67,-5,;-.67,-6.54,;.67,-4.23,;.67,-2.69,;.67,.38,;2,-.38,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCC(=O)CC2)c1=O
Cc1nc(N)nc2n(C3CCC(=O)CC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@H](O)CC2)c1=O |r,wU:20.21,23.25,(6,6.54,;6,5,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;3.33,1.93,;4.67,2.69,;6,1.93,;.67,1.93,;-.67,2.69,;-2,1.93,;-3.33,2.69,;-3.33,4.23,;-4.67,1.93,;-4.67,.38,;-6,-.38,;-3.33,-.38,;-2,.38,;-.67,-.38,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-.67,-5,;-.67,-6.54,;.67,-4.23,;.67,-2.69,;.67,.38,;2,-.38,)|
CO[C@H]1CC[C@@H](CC1)n1c2nc(N)nc(C)c2cc(Br)c1=O |r,wU:5.8,wD:2.1,(2.67,-5.78,;1.33,-5,;1.33,-3.47,;2.67,-2.69,;2.67,-1.15,;1.33,-.38,;,-1.15,;,-2.69,;1.33,1.15,;,1.93,;-1.33,1.15,;-2.67,1.93,;-4,1.15,;-2.67,3.47,;-1.33,4.23,;-1.33,5.78,;,3.47,;1.33,4.23,;2.67,3.47,;4,4.23,;2.67,1.93,;4,1.15,)|
CO[C@H]1CC[C@@H](CC1)n1c2nc(N)nc(C)c2cc(-c2cnc(OC)c(F)c2)c1=O |r,wU:5.8,wD:2.1,(,-6.16,;-1.33,-5.39,;-1.33,-3.85,;,-3.08,;,-1.54,;-1.33,-.77,;-2.67,-1.54,;-2.67,-3.08,;-1.33,.77,;-2.67,1.54,;-4,.77,;-5.33,1.54,;-6.67,.77,;-5.33,3.08,;-4,3.85,;-4,5.39,;-2.67,3.08,;-1.33,3.85,;,3.08,;1.33,3.85,;1.33,5.39,;2.67,6.16,;4,5.39,;5.33,6.16,;6.67,5.39,;4,3.85,;5.33,3.08,;2.67,3.08,;,1.54,;1.33,.77,)|
CN(C)c1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@H](O)CC2)c1=O |r,wU:20.21,23.25,(6.67,4.24,;5.33,5.01,;5.33,6.55,;4,4.24,;4,2.7,;2.67,1.93,;1.33,2.7,;1.33,4.24,;2.67,5.01,;,1.93,;-1.33,2.7,;-2.67,1.93,;-4,2.7,;-4,4.24,;-5.33,1.93,;-5.33,.39,;-6.67,-.39,;-4,-.39,;-2.67,.39,;-1.33,-.39,;-1.33,-1.93,;-2.67,-2.7,;-2.67,-4.24,;-1.33,-5.01,;-1.33,-6.55,;,-4.24,;,-2.7,;,.39,;1.33,-.39,)|
CO[C@H]1CC[C@@H](CC1)n1c2nc(N)nc(C)c2cc(-c2ccc(nc2)N(C)C)c1=O |r,wU:5.8,wD:2.1,(,-6.93,;-1.33,-6.16,;-1.33,-4.62,;,-3.85,;,-2.31,;-1.33,-1.54,;-2.67,-2.31,;-2.67,-3.85,;-1.33,,;-2.67,.77,;-4,,;-5.33,.77,;-6.67,,;-5.33,2.31,;-4,3.08,;-4,4.62,;-2.67,2.31,;-1.33,3.08,;,2.31,;1.33,3.08,;2.67,2.31,;4,3.08,;4,4.62,;2.67,5.39,;1.33,4.62,;5.33,5.39,;6.67,4.62,;5.33,6.93,;,.77,;1.33,,)|
CO[C@H]1CC[C@@H](CC1)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O |r,wU:5.8,wD:2.1,(1.48,-6.68,;.15,-5.91,;.15,-4.37,;1.48,-3.6,;1.48,-2.06,;.15,-1.29,;-1.18,-2.06,;-1.18,-3.6,;.15,.25,;-1.18,1.02,;-2.52,.25,;-3.85,1.02,;-5.19,.25,;-3.85,2.56,;-2.52,3.33,;-2.52,4.87,;-1.18,2.56,;.15,3.33,;1.48,2.56,;2.82,3.33,;4.28,2.85,;5.19,4.1,;4.28,5.35,;2.82,4.87,;1.48,1.02,;2.82,.25,)|
Cc1nc(N)nc2n(C3CCC(=O)CC3)c(=O)c(Br)cc12
Cc1nc(N)nc2n(C3CCC(C)(O)CC3)c(=O)c(cc12)-c1cn[nH]c1 |(-2.52,4.38,;-2.52,2.84,;-3.85,2.07,;-3.85,.53,;-5.19,-.24,;-2.52,-.24,;-1.18,.53,;.15,-.24,;.15,-1.78,;-1.18,-2.55,;-1.18,-4.09,;.15,-4.86,;-.62,-6.19,;.92,-6.19,;1.48,-4.09,;1.48,-2.55,;1.48,.53,;2.82,-.24,;1.48,2.07,;.15,2.84,;-1.18,2.07,;2.82,2.84,;4.28,2.37,;5.19,3.61,;4.28,4.86,;2.82,4.38,)|
CO[C@H]1CC[C@@H](CC1)n1c2nc(N)nc(C)c2cc(-c2cc[nH]n2)c1=O |r,wU:5.8,wD:2.1,(1.48,-6.68,;.15,-5.91,;.15,-4.37,;1.48,-3.6,;1.48,-2.06,;.15,-1.29,;-1.18,-2.06,;-1.18,-3.6,;.15,.25,;-1.18,1.02,;-2.52,.25,;-3.85,1.02,;-5.19,.25,;-3.85,2.56,;-2.52,3.33,;-2.52,4.87,;-1.18,2.56,;.15,3.33,;1.48,2.56,;2.82,3.33,;4.28,2.85,;5.19,4.1,;4.28,5.35,;2.82,4.87,;1.48,1.02,;2.82,.25,)|
CC(C)Oc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:21.22,wD:24.26,(7.34,5.78,;6,5.01,;6.4,3.52,;4.67,5.78,;3.33,5.01,;3.33,3.47,;2,2.7,;.67,3.47,;.67,5.01,;2,5.78,;-.67,2.7,;-2,3.47,;-3.33,2.7,;-4.67,3.47,;-4.67,5.01,;-6,2.7,;-6,1.16,;-7.34,.39,;-4.67,.39,;-3.33,1.16,;-2,.39,;-2,-1.16,;-.67,-1.93,;-.67,-3.47,;-2,-4.24,;-2,-5.78,;-3.33,-3.47,;-3.33,-1.93,;-.67,1.16,;.67,.39,)|
CCOc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:20.21,wD:23.25,(7.34,5.77,;6,5,;4.67,5.77,;3.33,5,;3.33,3.46,;2,2.69,;.67,3.46,;.67,5,;2,5.77,;-.67,2.69,;-2,3.46,;-3.33,2.69,;-4.67,3.46,;-4.67,5,;-6,2.69,;-6,1.15,;-7.34,.39,;-4.67,.39,;-3.33,1.15,;-2,.39,;-2,-1.15,;-.67,-1.92,;-.67,-3.46,;-2,-4.23,;-2,-5.77,;-3.33,-3.46,;-3.33,-1.92,;-.67,1.15,;.67,.39,)|
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1ccc(nc1)C#N |r,wU:8.7,wD:11.11,(-4,4.62,;-4,3.08,;-5.33,2.31,;-5.33,.77,;-6.67,,;-4,,;-2.67,.77,;-1.33,,;-1.33,-1.54,;,-2.31,;,-3.85,;-1.33,-4.62,;-1.33,-6.16,;-2.67,-3.85,;-2.67,-2.31,;,.77,;1.33,,;,2.31,;-1.33,3.08,;-2.67,2.31,;1.33,3.08,;2.67,2.31,;4,3.08,;4,4.62,;2.67,5.39,;1.33,4.62,;5.33,5.39,;6.67,6.16,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:20.21,wD:23.25,(6.67,5,;5.33,5.77,;4,5,;2.67,5.77,;1.33,5,;1.33,3.46,;2.67,2.69,;4,3.46,;5.33,2.69,;,2.69,;-1.33,3.46,;-2.67,2.69,;-4,3.46,;-4,5,;-5.33,2.69,;-5.33,1.15,;-6.67,.39,;-4,.39,;-2.67,1.15,;-1.33,.39,;-1.33,-1.15,;,-1.92,;,-3.46,;-1.33,-4.23,;-1.33,-5.77,;-2.67,-3.46,;-2.67,-1.92,;,1.15,;1.33,.39,)|
CN(C)c1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:20.21,wD:23.25,(6.67,4.24,;5.33,5.01,;5.33,6.55,;4,4.24,;4,2.7,;2.67,1.93,;1.33,2.7,;1.33,4.24,;2.67,5.01,;,1.93,;-1.33,2.7,;-2.67,1.93,;-4,2.7,;-4,4.24,;-5.33,1.93,;-5.33,.39,;-6.67,-.39,;-4,-.39,;-2.67,.39,;-1.33,-.39,;-1.33,-1.93,;,-2.7,;,-4.24,;-1.33,-5.01,;-1.33,-6.55,;-2.67,-4.24,;-2.67,-2.7,;,.39,;1.33,-.39,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(N2CCCC2)c1=O
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3cc(c(nc3)OC)F)N4CCCC4
Cc1nc(N)nc2n(CC(F)(F)F)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC(F)(F)F)c1=O
Cc1nc(N)nc2n(C3CCOCC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCOCC2)c1=O
Cc1nc(N)nc2n(C3CCOCC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
Cc1nc(N)nc2n(C3CCOC3)c(=O)c(Br)cc12
Cc1nc(N)nc2n(C3CCOC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCOC2)c1=O
Cc1nc(N)nc2n(C3CCC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCC2)c1=O
Cc1nc(N)nc2n(C3CCC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
CC(C)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C(C)C)c1=O
CC(C)n1c2nc(N)nc(C)c2cc(-c2cnc3[nH]ccc3c2)c1=O
Cc1nc(N)nc2n(C3CC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CC2)c1=O
Cc1nc(N)nc2n(C3CC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
CNc1nc(C)c2cc(Br)c(=O)n(CC3CCOC3)c2n1
CNc1nc(C)c2cc(-c3cn[nH]c3)c(=O)n(CC3CCOC3)c2n1
CNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n(CC3CCOC3)c2n1
CNc1nc(C)c2cc(-c3cnc4[nH]ccc4c3)c(=O)n(CC3CCOC3)c2n1
Cc1nc(N)nc2n(CC3CCOC3)c(=O)c(Br)cc12
Cc1nc(N)nc2n(CC3CCOC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC2CCOC2)c1=O
Cc1nc(N)nc2n(CC3CCOC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
Cc1nc(N)nc2n(CC3CCCO3)c(=O)c(Br)cc12
Cc1nc(N)nc2n(CC3CCCO3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC2CCCO2)c1=O
Cc1nc(N)nc2n(CC3CCCO3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
Cc1nc(N)nc2n(C3CN(C3)C(=O)OC(C)(C)C)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CN(C2)C(=O)OC(C)(C)C)c1=O
Cc1nc(N)nc2n(C3CN(C3)C(=O)OC(C)(C)C)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cncc(N)n1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cccc(Cl)n1
CNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n(CCC3CC3)c2n1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CCC2CC2)c1=O
CNc1nc(C)c2cc(-c3cnn(C)c3)c(=O)n(C3CCCC3)c2n1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cnn(C)c1
CNc1nc(C)c2cc(-c3cnn(CC(F)F)c3)c(=O)n(C3CCCC3)c2n1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cnn(CC(F)F)c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CCN)c1=O
CNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n(CCN)c2n1
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1cnn(CC(C)(C)O)c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC(C)C)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC2CCOCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC2(F)CCOCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(CC(C)(C)F)c1=O
CNc1nc(C)c2cc(-c3c[nH]c(C)n3)c(=O)n(C3CCCC3)c2n1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCN(C2)C(=O)OC(C)(C)C)c1=O
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1ccc(nc1)N1CCCC1 |r,wU:8.7,wD:11.11,(-4.52,4,;-4.52,2.46,;-5.85,1.69,;-5.85,.15,;-7.19,-.62,;-4.52,-.62,;-3.19,.15,;-1.85,-.62,;-1.85,-2.16,;-.52,-2.93,;-.52,-4.47,;-1.85,-5.24,;-1.85,-6.78,;-3.19,-4.47,;-3.19,-2.93,;-.52,.15,;.82,-.62,;-.52,1.69,;-1.85,2.46,;-3.19,1.69,;.82,2.46,;2.15,1.69,;3.48,2.46,;3.48,4,;2.15,4.77,;.82,4,;4.82,4.77,;6.28,4.29,;7.19,5.54,;6.28,6.78,;4.82,6.31,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
CCc1cccc(c1)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
CN(C)c1ncc(cc1C)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
Cc1nc(N)nc2n(C3CCCC3)c(=O)c(cc12)-c1ccc(nc1)N1CCCC1
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCOCC2)c1=O
Cc1nc(N)nc2n(C3CCOCC3)c(=O)c(cc12)-c1cccc(CO)c1
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1ccc2OCCOc2c1 |r,wU:8.7,wD:11.11,(-4,5,;-4,3.47,;-5.33,2.69,;-5.33,1.15,;-6.67,.38,;-4,.38,;-2.67,1.15,;-1.33,.38,;-1.33,-1.15,;,-1.93,;,-3.47,;-1.33,-4.23,;-1.33,-5.78,;-2.67,-3.47,;-2.67,-1.93,;,1.15,;1.33,.38,;,2.69,;-1.33,3.47,;-2.67,2.69,;1.33,3.47,;1.33,5,;2.67,5.78,;4,5,;5.33,5.78,;6.67,5,;6.67,3.47,;5.33,2.69,;4,3.47,;2.67,2.69,)|
COc1ccc(cc1F)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n(C2CCOCC2)c1=O
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n(C(C)C)c1=O
CC(C)n1c2nc(N)nc(C)c2cc(-c2cnc(=O)[nH]c2)c1=O
Cc1nc(N)nc2n([C@H]3CC[C@H](O)CC3)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:8.7,wD:11.11,(-4,5,;-4,3.47,;-5.33,2.69,;-5.33,1.15,;-6.67,.38,;-4,.38,;-2.67,1.15,;-1.33,.38,;-1.33,-1.15,;,-1.93,;,-3.47,;-1.33,-4.23,;-1.33,-5.78,;-2.67,-3.47,;-2.67,-1.93,;,1.15,;1.33,.38,;,2.69,;-1.33,3.47,;-2.67,2.69,;1.33,3.47,;1.33,5,;2.67,5.78,;4,5,;5.33,5.78,;6.67,5,;6.67,3.47,;5.33,2.69,;4,3.47,;2.67,2.69,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@H](O)CC2)c1=O |r,wU:19.20,22.24,(6.67,5,;5.33,5.77,;4,5,;2.67,5.77,;1.33,5,;1.33,3.46,;2.67,2.69,;4,3.46,;,2.69,;-1.33,3.46,;-2.67,2.69,;-4,3.46,;-4,5,;-5.33,2.69,;-5.33,1.15,;-6.67,.39,;-4,.39,;-2.67,1.15,;-1.33,.39,;-1.33,-1.15,;-2.67,-1.92,;-2.67,-3.46,;-1.33,-4.23,;-1.33,-5.77,;,-3.46,;,-1.92,;,1.15,;1.33,.39,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:19.20,wD:22.24,(6.67,5,;5.33,5.77,;4,5,;2.67,5.77,;1.33,5,;1.33,3.46,;2.67,2.69,;4,3.46,;,2.69,;-1.33,3.46,;-2.67,2.69,;-4,3.46,;-4,5,;-5.33,2.69,;-5.33,1.15,;-6.67,.39,;-4,.39,;-2.67,1.15,;-1.33,.39,;-1.33,-1.15,;,-1.92,;,-3.46,;-1.33,-4.23,;-1.33,-5.77,;-2.67,-3.46,;-2.67,-1.92,;,1.15,;1.33,.39,)|
CNc1nc(C)c2cc(-c3ccc(OC)nc3)c(=O)n([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:20.20,wD:23.24,(-7.34,1.16,;-6,.39,;-4.67,1.16,;-4.67,2.7,;-3.33,3.47,;-3.33,5.01,;-2,2.7,;-.67,3.47,;.67,2.7,;2,3.47,;2,5.01,;3.33,5.78,;4.67,5.01,;6,5.78,;7.34,5.01,;4.67,3.47,;3.33,2.7,;.67,1.16,;2,.39,;-.67,.39,;-.67,-1.16,;.67,-1.93,;.67,-3.47,;-.67,-4.24,;-.67,-5.78,;-2,-3.47,;-2,-1.93,;-2,1.16,;-3.33,.39,)|
CCNc1nc(C)c2cc(-c3cnc(OC)c(F)c3)c(=O)n([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:22.22,wD:25.26,(-7.96,.31,;-6.47,.7,;-5.38,-.39,;-4.05,.39,;-4.05,1.92,;-2.71,2.69,;-2.71,4.24,;-1.38,1.92,;-.05,2.69,;1.29,1.92,;2.62,2.69,;3.96,1.92,;5.29,2.69,;5.29,4.24,;6.62,5,;7.96,4.24,;3.96,5,;3.96,6.54,;2.62,4.24,;1.29,.39,;2.62,-.39,;-.05,-.39,;-.05,-1.92,;1.29,-2.69,;1.29,-4.24,;-.05,-5,;-.05,-6.54,;-1.38,-4.24,;-1.38,-2.69,;-1.38,.39,;-2.71,-.39,)|
CCNc1nc(C)c2cc(-c3cnc(OC)nc3)c(=O)n([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:21.21,wD:24.25,(-7.96,1.08,;-6.47,1.47,;-5.38,.39,;-4.05,1.15,;-4.05,2.69,;-2.71,3.46,;-2.71,5,;-1.38,2.69,;-.05,3.46,;1.29,2.69,;2.62,3.46,;2.62,5,;3.96,5.77,;5.29,5,;6.62,5.77,;7.96,5,;5.29,3.46,;3.96,2.69,;1.29,1.15,;2.62,.39,;-.05,.39,;-.05,-1.15,;1.29,-1.92,;1.29,-3.46,;-.05,-4.23,;-.05,-5.77,;-1.38,-3.46,;-1.38,-1.92,;-1.38,1.15,;-2.71,.39,)|
CCn1nccc1NC(=O)c1cc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:21.22,wD:24.26,(2.82,6.54,;2.82,5,;4.15,4.23,;5.61,4.71,;6.52,3.47,;5.61,2.22,;4.15,2.69,;2.82,1.93,;1.48,2.69,;1.48,4.23,;.15,1.93,;-1.18,2.69,;-2.52,1.93,;-3.85,2.69,;-3.85,4.23,;-5.19,1.93,;-5.19,.38,;-6.52,-.38,;-3.85,-.38,;-2.52,.38,;-1.18,-.38,;-1.18,-1.93,;.15,-2.69,;.15,-4.23,;-1.18,-5,;-1.18,-6.54,;-2.52,-4.23,;-2.52,-2.69,;.15,.38,;1.48,-.38,)|
CC(C)n1c2nc(N)nc(C)c2cc(C(=O)Nc2ccn[nH]2)c1=O
CCn1nccc1NC(=O)c1cc2c(C)nc(N)nc2n(C(C)C)c1=O
CCn1cc(CNC(=O)c2cc3c(C)nc(NC)nc3n(C3CCCC3)c2=O)cn1
CNc1nc(C)c2cc(C(=O)Nc3ccccn3)c(=O)n(C3CCCC3)c2n1
CNc1nc(C)c2cc(C(=O)Nc3ccon3)c(=O)n(C3CCCC3)c2n1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:19.20,wD:22.27,(7.3,4.56,;5.97,5.33,;4.64,4.56,;3.3,5.33,;1.97,4.56,;1.97,3.02,;3.3,2.25,;4.64,3.02,;.64,2.25,;-.7,3.02,;-2.03,2.25,;-3.37,3.02,;-3.37,4.56,;-4.7,2.25,;-4.7,.71,;-6.03,-.06,;-3.37,-.06,;-2.03,.71,;-.7,-.06,;-.7,-1.6,;.64,-2.37,;.64,-3.91,;-.7,-4.68,;-2.03,-3.91,;-2.03,-2.37,;-.7,-6.22,;.64,-6.99,;.64,-8.53,;1.97,-9.3,;.64,.71,;1.97,-.06,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:19.20,wD:22.27,(6,6.93,;6,5.39,;4.67,4.62,;4.67,3.08,;3.33,2.31,;2,3.08,;2,4.62,;3.33,5.39,;.67,2.31,;-.67,3.08,;-2,2.31,;-3.33,3.08,;-3.33,4.62,;-4.67,2.31,;-4.67,.77,;-6,,;-3.33,,;-2,.77,;-.67,,;-.67,-1.54,;.67,-2.31,;.67,-3.85,;-.67,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-6.16,;.67,-6.93,;2,-6.16,;3.33,-6.93,;.67,.77,;2,,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:20.21,wD:23.28,(6,6.93,;6,5.39,;4.67,4.62,;3.33,5.39,;2,4.62,;2,3.08,;3.33,2.31,;4.67,3.08,;6,2.31,;.67,2.31,;-.67,3.08,;-2,2.31,;-3.33,3.08,;-3.33,4.62,;-4.67,2.31,;-4.67,.77,;-6,,;-3.33,,;-2,.77,;-.67,,;-.67,-1.54,;.67,-2.31,;.67,-3.85,;-.67,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-6.16,;.67,-6.93,;2,-6.16,;3.33,-6.93,;.67,.77,;2,,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:8.7,wD:11.14,(-4,5.39,;-4,3.85,;-5.33,3.08,;-5.33,1.54,;-6.67,.77,;-4,.77,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;,-3.08,;-1.33,-3.85,;-2.67,-3.08,;-2.67,-1.54,;-1.33,-5.39,;,-6.16,;1.33,-5.39,;2.67,-6.16,;,1.54,;1.33,.77,;,3.08,;-1.33,3.85,;-2.67,3.08,;1.33,3.85,;1.33,5.39,;2.67,6.16,;4,5.39,;5.33,6.16,;6.67,5.39,;6.67,3.85,;5.33,3.08,;4,3.85,;2.67,3.08,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCCO)c(=O)c(cc12)-c1c[nH]cn1 |r,wU:8.7,wD:11.14,(-2.52,5.54,;-2.52,4,;-3.85,3.23,;-3.85,1.69,;-5.19,.92,;-2.52,.92,;-1.18,1.69,;.15,.92,;.15,-.62,;1.48,-1.39,;1.48,-2.93,;.15,-3.7,;-1.18,-2.93,;-1.18,-1.39,;.15,-5.24,;1.48,-6.01,;2.82,-5.24,;4.15,-6.01,;1.48,1.69,;2.82,.92,;1.48,3.23,;.15,4,;-1.18,3.23,;2.82,4,;2.82,5.54,;4.28,6.01,;5.19,4.77,;4.28,3.52,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCCO)c(=O)c(Br)cc12 |r,wU:8.7,wD:11.14,(-2,5.78,;-2,4.23,;-3.33,3.47,;-3.33,1.93,;-4.67,1.15,;-2,1.15,;-.67,1.93,;.67,1.15,;.67,-.38,;2,-1.15,;2,-2.69,;.67,-3.47,;-.67,-2.69,;-.67,-1.15,;.67,-5,;2,-5.78,;3.33,-5,;4.67,-5.78,;2,1.93,;3.33,1.15,;2,3.47,;3.33,4.23,;.67,4.23,;-.67,3.47,)|
CN(C)c1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:20.21,wD:23.28,(6.67,4.62,;5.33,5.39,;5.33,6.93,;4,4.62,;4,3.08,;2.67,2.31,;1.33,3.08,;1.33,4.62,;2.67,5.39,;,2.31,;-1.33,3.08,;-2.67,2.31,;-4,3.08,;-4,4.62,;-5.33,2.31,;-5.33,.77,;-6.67,,;-4,,;-2.67,.77,;-1.33,,;-1.33,-1.54,;,-2.31,;,-3.85,;-1.33,-4.62,;-2.67,-3.85,;-2.67,-2.31,;-1.33,-6.16,;,-6.93,;1.33,-6.16,;2.67,-6.93,;,.77,;1.33,,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:19.20,22.27,(6,6.93,;6,5.39,;4.67,4.62,;4.67,3.08,;3.33,2.31,;2,3.08,;2,4.62,;3.33,5.39,;.67,2.31,;-.67,3.08,;-2,2.31,;-3.33,3.08,;-3.33,4.62,;-4.67,2.31,;-4.67,.77,;-6,,;-3.33,,;-2,.77,;-.67,,;-.67,-1.54,;-2,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;-.67,-6.16,;.67,-6.93,;2,-6.16,;3.33,-6.93,;.67,.77,;2,,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:20.21,23.28,(6,6.93,;6,5.39,;4.67,4.62,;3.33,5.39,;2,4.62,;2,3.08,;3.33,2.31,;4.67,3.08,;6,2.31,;.67,2.31,;-.67,3.08,;-2,2.31,;-3.33,3.08,;-3.33,4.62,;-4.67,2.31,;-4.67,.77,;-6,,;-3.33,,;-2,.77,;-.67,,;-.67,-1.54,;-2,-2.31,;-2,-3.85,;-.67,-4.62,;.67,-3.85,;.67,-2.31,;-.67,-6.16,;.67,-6.93,;2,-6.16,;3.33,-6.93,;.67,.77,;2,,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:8.7,11.14,(-4,5.39,;-4,3.85,;-5.33,3.08,;-5.33,1.54,;-6.67,.77,;-4,.77,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-2.67,-3.08,;-1.33,-3.85,;,-3.08,;,-1.54,;-1.33,-5.39,;,-6.16,;1.33,-5.39,;2.67,-6.16,;,1.54,;1.33,.77,;,3.08,;-1.33,3.85,;-2.67,3.08,;1.33,3.85,;1.33,5.39,;2.67,6.16,;4,5.39,;5.33,6.16,;6.67,5.39,;6.67,3.85,;5.33,3.08,;4,3.85,;2.67,3.08,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:8.7,11.14,(-2.52,5.54,;-2.52,4,;-3.85,3.23,;-3.85,1.69,;-5.19,.92,;-2.52,.92,;-1.18,1.69,;.15,.92,;.15,-.62,;-1.18,-1.39,;-1.18,-2.93,;.15,-3.7,;1.48,-2.93,;1.48,-1.39,;.15,-5.24,;1.48,-6.01,;2.82,-5.24,;4.15,-6.01,;1.48,1.69,;2.82,.92,;1.48,3.23,;.15,4,;-1.18,3.23,;2.82,4,;4.28,3.52,;5.19,4.77,;4.28,6.01,;2.82,5.54,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:23.28,wD:20.21,(27.28,-44.28,;25.95,-43.51,;24.61,-44.28,;24.61,-45.82,;23.27,-46.58,;21.94,-45.81,;21.94,-44.27,;23.27,-43.5,;23.27,-41.96,;20.6,-46.56,;19.26,-45.78,;17.92,-46.56,;16.58,-45.8,;16.58,-44.26,;15.25,-46.57,;15.25,-48.11,;13.92,-48.88,;16.58,-48.88,;17.91,-48.12,;19.25,-48.89,;19.24,-50.43,;17.9,-51.19,;17.9,-52.72,;19.22,-53.51,;20.56,-52.74,;20.57,-51.2,;19.21,-55.04,;17.88,-55.81,;16.55,-55.03,;15.21,-55.79,;16.56,-53.49,;20.6,-48.12,;21.93,-48.89,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OC[C@@H](O)CO)c1=O |r,wU:19.20,27.30,wD:22.27,(6,6.93,;6,5.39,;4.67,4.62,;4.67,3.08,;3.33,2.31,;2,3.08,;2,4.62,;3.33,5.39,;.67,2.31,;-.67,3.08,;-2,2.31,;-3.33,3.08,;-3.33,4.62,;-4.67,2.31,;-4.67,.77,;-6,,;-3.33,,;-2,.77,;-.67,,;-.67,-1.54,;.67,-2.31,;.67,-3.85,;-.67,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-6.16,;.67,-6.93,;2,-6.16,;2,-4.62,;3.33,-6.93,;4.67,-6.16,;.67,.77,;2,,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCCO)c(=O)c(cc12)-c1cc[nH]n1 |r,wU:8.7,wD:11.14,(-2.52,5.54,;-2.52,4,;-3.85,3.23,;-3.85,1.69,;-5.19,.92,;-2.52,.92,;-1.18,1.69,;.15,.92,;.15,-.62,;1.48,-1.39,;1.48,-2.93,;.15,-3.7,;-1.18,-2.93,;-1.18,-1.39,;.15,-5.24,;1.48,-6.01,;2.82,-5.24,;4.15,-6.01,;1.48,1.69,;2.82,.92,;1.48,3.23,;.15,4,;-1.18,3.23,;2.82,4,;4.28,3.52,;5.19,4.77,;4.28,6.01,;2.82,5.54,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:8.7,wD:11.14,(-2.52,4.87,;-2.52,3.33,;-3.85,2.56,;-3.85,1.02,;-5.19,.25,;-2.52,.25,;-1.18,1.02,;.15,.25,;.15,-1.29,;1.48,-2.06,;1.48,-3.6,;.15,-4.37,;-1.18,-3.6,;-1.18,-2.06,;.15,-5.91,;1.48,-6.68,;2.82,-5.91,;4.15,-6.68,;1.48,1.02,;2.82,.25,;1.48,2.56,;.15,3.33,;-1.18,2.56,;2.82,3.33,;4.28,2.85,;5.19,4.1,;4.28,5.35,;5.05,6.68,;2.82,4.87,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:19.20,22.27,(14.55,-30.27,;13.22,-29.49,;11.88,-30.26,;10.54,-29.49,;9.21,-30.26,;9.21,-31.79,;10.54,-32.57,;11.88,-31.8,;7.87,-32.55,;6.53,-31.77,;5.19,-32.55,;3.85,-31.78,;3.85,-30.24,;2.52,-32.55,;2.52,-34.1,;1.19,-34.87,;3.86,-34.87,;5.19,-34.1,;6.52,-34.88,;6.51,-36.41,;7.85,-37.18,;7.83,-38.73,;6.5,-39.49,;5.17,-38.71,;5.18,-37.18,;6.49,-41.03,;5.15,-41.79,;3.82,-41.01,;2.48,-41.77,;3.83,-39.47,;7.87,-34.1,;9.2,-34.88,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:20.21,23.28,(27.43,-30.66,;26.1,-29.89,;24.76,-30.66,;24.76,-32.2,;23.42,-32.96,;22.09,-32.19,;22.09,-30.65,;23.42,-29.88,;23.42,-28.34,;20.75,-32.94,;19.4,-32.16,;18.06,-32.94,;16.73,-32.18,;16.73,-30.64,;15.4,-32.95,;15.4,-34.49,;14.07,-35.26,;16.73,-35.26,;18.06,-34.49,;19.4,-35.27,;19.39,-36.81,;20.72,-37.58,;20.71,-39.12,;19.37,-39.88,;18.05,-39.1,;18.05,-37.57,;19.36,-41.42,;18.02,-42.18,;16.7,-41.41,;15.36,-42.17,;16.71,-39.87,;20.75,-34.5,;22.08,-35.27,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:8.7,11.14,(-2.52,5.54,;-2.52,4,;-3.85,3.23,;-3.85,1.69,;-5.19,.92,;-2.52,.92,;-1.18,1.69,;.15,.92,;.15,-.62,;-1.18,-1.39,;-1.18,-2.93,;.15,-3.7,;1.48,-2.93,;1.48,-1.39,;.15,-5.24,;1.48,-6.01,;2.82,-5.24,;4.15,-6.01,;2.82,-3.7,;1.48,1.69,;2.82,.92,;1.48,3.23,;.15,4,;-1.18,3.23,;2.82,4,;4.28,3.52,;5.19,4.77,;4.28,6.01,;2.82,5.54,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnn(C)c1 |r,wD:8.7,11.14,(54.57,-30.85,;54.57,-32.39,;53.24,-33.16,;53.24,-34.71,;51.91,-35.48,;54.58,-35.48,;55.9,-34.71,;57.24,-35.49,;57.24,-37.03,;58.57,-37.79,;58.56,-39.34,;57.22,-40.1,;55.89,-39.32,;55.9,-37.79,;57.21,-41.64,;55.87,-42.4,;54.54,-41.63,;53.2,-42.39,;54.55,-40.09,;58.59,-34.72,;59.92,-35.49,;58.59,-33.16,;57.25,-32.38,;55.91,-33.16,;59.93,-32.4,;61.32,-33.04,;62.36,-31.91,;61.61,-30.57,;62.24,-29.17,;60.1,-30.88,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:19.20,22.27,(40.28,-30.68,;38.94,-29.91,;37.61,-30.68,;37.6,-32.22,;36.27,-32.99,;34.94,-32.21,;34.94,-30.68,;36.27,-29.91,;33.6,-32.97,;32.25,-32.19,;30.91,-32.97,;29.58,-32.2,;29.57,-30.66,;28.25,-32.97,;28.25,-34.52,;26.91,-35.28,;29.58,-35.29,;30.91,-34.52,;32.25,-35.3,;32.24,-36.83,;33.57,-37.6,;33.56,-39.15,;32.22,-39.91,;30.89,-39.13,;30.9,-37.6,;32.21,-41.45,;30.87,-42.21,;29.55,-41.43,;28.21,-42.19,;29.56,-39.89,;33.6,-34.52,;34.93,-35.3,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wD:8.7,11.14,(67.89,-30.91,;67.89,-32.45,;66.56,-33.22,;66.56,-34.76,;65.23,-35.53,;67.9,-35.53,;69.23,-34.77,;70.56,-35.54,;70.56,-37.08,;71.89,-37.85,;71.88,-39.39,;70.54,-40.16,;69.21,-39.38,;69.22,-37.84,;70.53,-41.7,;69.19,-42.46,;67.86,-41.68,;66.52,-42.44,;67.87,-40.14,;71.91,-34.77,;73.24,-35.54,;71.91,-33.21,;70.57,-32.43,;69.23,-33.21,;73.25,-32.46,;74.59,-33.23,;75.92,-32.47,;75.92,-30.93,;77.25,-30.16,;77.25,-28.62,;75.91,-27.85,;74.59,-28.62,;74.58,-30.15,;73.25,-30.92,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:22.27,wD:19.20,(13.86,-44.58,;12.52,-43.81,;11.19,-44.58,;9.85,-43.81,;8.52,-44.58,;8.52,-46.11,;9.85,-46.88,;11.18,-46.12,;7.18,-46.87,;5.83,-46.08,;4.49,-46.86,;3.16,-46.1,;3.16,-44.56,;1.83,-46.87,;1.83,-48.41,;.5,-49.18,;3.16,-49.18,;4.49,-48.42,;5.83,-49.19,;5.82,-50.73,;4.48,-51.49,;4.48,-53.02,;5.8,-53.81,;7.14,-53.04,;7.15,-51.5,;5.79,-55.34,;4.45,-56.11,;3.13,-55.33,;1.79,-56.09,;3.14,-53.79,;7.18,-48.42,;8.51,-49.19,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:11.14,wD:8.7,(66.59,-45.15,;66.6,-46.69,;65.27,-47.46,;65.26,-49,;63.93,-49.77,;66.6,-49.77,;67.93,-49.01,;69.27,-49.78,;69.26,-51.32,;67.92,-52.08,;67.91,-53.62,;69.24,-54.4,;70.58,-53.63,;70.59,-52.09,;69.23,-55.94,;67.89,-56.7,;66.56,-55.92,;65.22,-56.68,;66.57,-54.38,;70.62,-49.01,;71.95,-49.78,;70.62,-47.46,;69.27,-46.67,;67.93,-47.45,;71.96,-46.7,;73.29,-47.47,;74.62,-46.71,;74.62,-45.17,;75.95,-44.41,;75.96,-42.86,;74.62,-42.09,;73.29,-42.86,;73.29,-44.39,;71.96,-45.16,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:22.27,wD:19.20,(40.72,-44.52,;39.39,-43.75,;38.06,-44.52,;38.05,-46.06,;36.72,-46.82,;35.39,-46.05,;35.39,-44.51,;36.72,-43.74,;34.05,-46.8,;32.7,-46.02,;31.36,-46.8,;30.03,-46.04,;30.02,-44.5,;28.7,-46.81,;28.7,-48.35,;27.36,-49.12,;30.03,-49.12,;31.36,-48.35,;32.7,-49.13,;32.69,-50.67,;31.35,-51.43,;31.34,-52.96,;32.67,-53.74,;34.01,-52.98,;34.02,-51.44,;32.66,-55.28,;31.32,-56.04,;29.99,-55.26,;28.66,-56.03,;30,-53.73,;34.05,-48.36,;35.38,-49.13,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:8.7,wD:11.14,(-2.52,5.54,;-2.52,4,;-3.85,3.23,;-3.85,1.69,;-5.19,.92,;-2.52,.92,;-1.18,1.69,;.15,.92,;.15,-.62,;1.48,-1.39,;1.48,-2.93,;.15,-3.7,;-1.18,-2.93,;-1.18,-1.39,;.15,-5.24,;1.48,-6.01,;2.82,-5.24,;4.15,-6.01,;2.82,-3.7,;1.48,1.69,;2.82,.92,;1.48,3.23,;.15,4,;-1.18,3.23,;2.82,4,;4.28,3.52,;5.19,4.77,;4.28,6.01,;2.82,5.54,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:11.14,wD:8.7,(54.35,-45.06,;54.35,-46.6,;53.02,-47.37,;53.02,-48.92,;51.69,-49.69,;54.36,-49.69,;55.69,-48.92,;57.02,-49.7,;57.02,-51.23,;55.68,-52,;55.67,-53.53,;57,-54.31,;58.34,-53.55,;58.35,-52,;56.99,-55.85,;55.65,-56.61,;54.32,-55.83,;52.98,-56.6,;54.33,-54.29,;58.37,-48.93,;59.71,-49.7,;58.38,-47.37,;57.03,-46.59,;55.69,-47.37,;59.71,-46.61,;61.11,-47.25,;62.14,-46.12,;61.39,-44.78,;62.02,-43.38,;59.88,-45.09,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2C[C@@H](C2)OCCO)c1=O |r,wU:19.20,wD:21.25,(6,6.48,;6,4.94,;4.67,4.17,;4.67,2.63,;3.33,1.86,;2,2.63,;2,4.17,;3.33,4.94,;.67,1.86,;-.67,2.63,;-2,1.86,;-3.33,2.63,;-3.33,4.17,;-4.67,1.86,;-4.67,.32,;-6,-.45,;-3.33,-.45,;-2,.32,;-.67,-.45,;-.67,-1.99,;.42,-3.08,;-.67,-4.17,;-1.76,-3.08,;-.67,-5.71,;.67,-6.48,;2,-5.71,;3.33,-6.48,;.67,.32,;2,-.45,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2C[C@@H](C2)OCCO)c1=O |r,wU:20.21,wD:22.26,(6,6.48,;6,4.94,;4.67,4.17,;3.33,4.94,;2,4.17,;2,2.63,;3.33,1.86,;4.67,2.63,;6,1.86,;.67,1.86,;-.67,2.63,;-2,1.86,;-3.33,2.63,;-3.33,4.17,;-4.67,1.86,;-4.67,.32,;-6,-.45,;-3.33,-.45,;-2,.32,;-.67,-.45,;-.67,-1.99,;.42,-3.08,;-.67,-4.17,;-1.76,-3.08,;-.67,-5.71,;.67,-6.48,;2,-5.71,;3.33,-6.48,;.67,.32,;2,-.45,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2C[C@@H](C2)OCCO)c1=O |r,wU:19.20,wD:21.25,(6,6.48,;6,4.94,;4.67,4.17,;4.67,2.63,;3.33,1.86,;2,2.63,;2,4.17,;3.33,4.94,;.67,1.86,;-.67,2.63,;-2,1.86,;-3.33,2.63,;-3.33,4.17,;-4.67,1.86,;-4.67,.32,;-6,-.45,;-3.33,-.45,;-2,.32,;-.67,-.45,;-.67,-1.99,;.42,-3.08,;-.67,-4.17,;-1.76,-3.08,;-.67,-5.71,;.67,-6.48,;2,-5.71,;3.33,-6.48,;.67,.32,;2,-.45,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2C[C@@H](C2)OCC(N)=O)c1=O |r,wU:19.20,wD:21.25,(6,6.48,;6,4.94,;4.67,4.17,;4.67,2.63,;3.33,1.86,;2,2.63,;2,4.17,;3.33,4.94,;.67,1.86,;-.67,2.63,;-2,1.86,;-3.33,2.63,;-3.33,4.17,;-4.67,1.86,;-4.67,.32,;-6,-.45,;-3.33,-.45,;-2,.32,;-.67,-.45,;-.67,-1.99,;.42,-3.08,;-.67,-4.17,;-1.76,-3.08,;-.67,-5.71,;.67,-6.48,;2,-5.71,;3.33,-6.48,;2,-4.17,;.67,.32,;2,-.45,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2C[C@@H](C2)OCC(N)=O)c1=O |r,wU:20.21,wD:22.26,(6,6.48,;6,4.94,;4.67,4.17,;3.33,4.94,;2,4.17,;2,2.63,;3.33,1.86,;4.67,2.63,;6,1.86,;.67,1.86,;-.67,2.63,;-2,1.86,;-3.33,2.63,;-3.33,4.17,;-4.67,1.86,;-4.67,.32,;-6,-.45,;-3.33,-.45,;-2,.32,;-.67,-.45,;-.67,-1.99,;.42,-3.08,;-.67,-4.17,;-1.76,-3.08,;-.67,-5.71,;.67,-6.48,;2,-5.71,;3.33,-6.48,;2,-4.17,;.67,.32,;2,-.45,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2C[C@@H](C2)OCC(N)=O)c1=O |r,wU:19.20,wD:21.25,(6,6.48,;6,4.94,;4.67,4.17,;4.67,2.63,;3.33,1.86,;2,2.63,;2,4.17,;3.33,4.94,;.67,1.86,;-.67,2.63,;-2,1.86,;-3.33,2.63,;-3.33,4.17,;-4.67,1.86,;-4.67,.32,;-6,-.45,;-3.33,-.45,;-2,.32,;-.67,-.45,;-.67,-1.99,;.42,-3.08,;-.67,-4.17,;-1.76,-3.08,;-.67,-5.71,;.67,-6.48,;2,-5.71,;3.33,-6.48,;2,-4.17,;.67,.32,;2,-.45,)|
CCc1ncnc(-c2ccc(cc2)C(C)(C)C#N)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(C)(C)C#N)c1C#Cc1ccc(N)nc1
CCc1cc(ccn1)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(C)nc(C)c2)c1C#Cc1ccc(N)nc1
CNC(=O)c1ccc(cc1Cl)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cc1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccccc2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cc(ccc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cccc(c1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(F)c(c2)C(=O)N(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC)c(Cl)c2)c1C#Cc1ccc(C)nc1
CCc1ncnc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(C)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N(C)C)c1C#Cc1ccc(C)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C)c(F)c2)c1C#Cc1ccc(C)nc1
Cc1cc(ccn1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(nc2)C(F)(F)F)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2cnc3ccccc3c2)c1C#Cc1ccc(N)nc1
COc1ccc(cn1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ccc(cn1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(nc2)N2CCCCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(nc2)C2CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccnc(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cnc3ccccc3c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(OC)nc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C)nc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccnc(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)N(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)C2CC2)c1C#Cc1ccc(N)nc1
CCN(CC)C(=O)c1cccc(c1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2cccc(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cc(Cl)cc(c1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(F)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(Cl)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(F)c(c2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(Cl)c(c2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
CNC(=O)c1cc(ccc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCN(CC)C(=O)c1cccc(c1)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(Cl)c(c2)C(=O)N(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(F)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCN(CC)C(=O)c1cc(ccc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(Cl)c(c2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(Cl)c(c2)C(=O)NC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cccc(c2)C(=O)NC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCOC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCO)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCO)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCOC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(F)(F)F)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCO4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(=O)N(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCOC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCOC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCO)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCOC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccn3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(F)(F)F)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNC(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)(F)F)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCO)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNC(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)C3CCC(C)(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-2.67,6.06,;-4,5.29,;-4,3.75,;-5.33,2.98,;-5.33,1.44,;-4,.67,;-2.67,1.44,;-1.33,.67,;-1.33,-.87,;0,-1.64,;1.33,-.87,;2.67,-1.64,;4,-.87,;2.67,-3.18,;1.33,-3.95,;1.33,-5.49,;2.67,-6.26,;3.44,-7.6,;1.9,-7.6,;4,-5.49,;4,-3.95,;1.33,.67,;2.67,1.44,;0,1.44,;-2.67,2.98,;-1.33,3.75,;0,4.52,;1.33,5.29,;1.33,6.83,;2.67,7.6,;4,6.83,;5.33,7.6,;4,5.29,;2.67,4.52,)|
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(CC3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)(F)F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CC3CCCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CC3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCC3(O)CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CC(C)(C)O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(F)c2)c1C#Cc1ccc(N)nc1C
CCCCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(=O)N(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCO4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccn3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccncc3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCS(=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)OC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCN(C)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(NC#N)=NC)c(F)c2)c1C#Cc1ccc(N)nc1 |w:23.24|
CCc1ncnc(-c2ccc(C(=O)N3CCCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOC(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC3)C(F)(F)F)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC3)c3ccccc3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCC(C)N1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCC(CC)N1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC[C@@H]3CO)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC(C)NC(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3[C@H]4C[C@@H]3N4C)c(F)c2)c1C#Cc1ccc(N)nc1 |r,THB:11:13:17:15|
CCc1ncnc(-c2ccc(C(=O)N3CCC[C@H]3CO)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCS(=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)OC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C)(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccncc3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3(C)COC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
COCCN1CCN(CC1)C(=O)c1ccc(cc1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN3CCCCC3C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CCS(=O)(=O)C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CCO)CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CCCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC(O)CN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-5.61,6.32,;-6.94,5.55,;-6.94,4.01,;-8.28,3.24,;-8.28,1.7,;-6.94,.93,;-5.61,1.7,;-4.28,.93,;-4.28,-.61,;-2.94,-1.38,;-1.61,-.61,;-.28,-1.38,;1.06,-.61,;-.28,-2.92,;1.06,-3.69,;1.46,-5.18,;2.94,-4.78,;2.55,-3.29,;4.28,-5.55,;4.28,-7.09,;5.61,-7.86,;6.94,-7.09,;8.28,-7.86,;6.94,-5.55,;5.61,-4.78,;-1.61,.93,;-.28,1.7,;-2.94,1.7,;-5.61,3.24,;-4.28,4.01,;-2.94,4.78,;-1.61,5.55,;-1.61,7.09,;-.28,7.86,;1.06,7.09,;2.39,7.86,;1.06,5.55,;-.28,4.78,)|
CCc1ncnc(-c2ccc(C(=O)NC3CCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCC[C@@H]1CNC(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)NC3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C)(C)N(C)C(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](O)C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCN(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-5.61,6.32,;-6.94,5.55,;-6.94,4.01,;-8.28,3.24,;-8.28,1.7,;-6.94,.93,;-5.61,1.7,;-4.28,.93,;-4.28,-.61,;-2.94,-1.38,;-1.61,-.61,;-.28,-1.38,;1.06,-.61,;-.28,-2.92,;1.06,-3.69,;1.46,-5.18,;2.94,-4.78,;2.55,-3.29,;4.28,-5.55,;4.28,-7.09,;5.61,-7.86,;6.94,-7.09,;8.28,-7.86,;6.94,-5.55,;5.61,-4.78,;-1.61,.93,;-.28,1.7,;-2.94,1.7,;-5.61,3.24,;-4.28,4.01,;-2.94,4.78,;-1.61,5.55,;-1.61,7.09,;-.28,7.86,;1.06,7.09,;2.39,7.86,;1.06,5.55,;-.28,4.78,)|
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-4.94,6.32,;-6.28,5.55,;-6.28,4.01,;-7.61,3.24,;-7.61,1.7,;-6.28,.93,;-4.94,1.7,;-3.61,.93,;-3.61,-.61,;-2.28,-1.38,;-.94,-.61,;.39,-1.38,;1.72,-.61,;.39,-2.92,;1.72,-3.69,;2.12,-5.18,;3.61,-4.78,;3.21,-3.29,;4.94,-5.55,;4.94,-7.09,;6.28,-7.86,;7.61,-7.09,;7.61,-5.55,;6.28,-4.78,;-.94,.93,;.39,1.7,;-2.28,1.7,;-4.94,3.24,;-3.61,4.01,;-2.28,4.78,;-.94,5.55,;-.94,7.09,;.39,7.86,;1.72,7.09,;3.06,7.86,;1.72,5.55,;.39,4.78,)|
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCC(CC3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-6.8,7.33,;-8.13,6.56,;-8.13,5.02,;-9.46,4.25,;-9.46,2.71,;-8.13,1.94,;-6.8,2.71,;-5.46,1.94,;-5.46,.4,;-4.13,-.37,;-2.79,.4,;-1.46,-.37,;-.13,.4,;-1.46,-1.91,;-.13,-2.68,;.27,-4.17,;1.76,-3.77,;1.36,-2.28,;3.09,-4.54,;3.09,-6.08,;4.43,-6.85,;5.76,-6.08,;5.76,-4.54,;4.43,-3.77,;7.09,-6.85,;7.09,-8.39,;8.56,-8.87,;9.46,-7.62,;8.56,-6.38,;-2.79,1.94,;-1.46,2.71,;-4.13,2.71,;-6.8,4.25,;-5.46,5.02,;-4.13,5.79,;-2.8,6.56,;-2.8,8.1,;-1.46,8.87,;-.13,8.1,;1.21,8.87,;-.13,6.56,;-1.46,5.79,)|
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-4.8,6.17,;-6.13,5.4,;-6.13,3.86,;-7.46,3.09,;-7.46,1.55,;-6.13,.78,;-4.8,1.55,;-3.46,.78,;-3.46,-.76,;-2.13,-1.53,;-.79,-.76,;.54,-1.53,;1.87,-.76,;.54,-3.07,;1.87,-3.84,;2.27,-5.33,;3.76,-4.93,;3.36,-3.44,;5.09,-5.7,;5.09,-7.24,;6.56,-7.71,;7.46,-6.47,;6.56,-5.22,;-.79,.78,;.54,1.55,;-2.13,1.55,;-4.8,3.09,;-3.46,3.86,;-2.13,4.63,;-.79,5.4,;-.79,6.94,;.54,7.71,;1.87,6.94,;3.21,7.71,;1.87,5.4,;.54,4.63,)|
CCc1ncnc(-c2ccc(C(=O)NC3CCN(C3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCCC3=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3(C)COC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N2CCCO2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N2CCCCO2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N2CC(O)CO2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N(C)OC)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(F)c2)c1C#Cc1ccc(N)nc1
CON(C)C(=O)c1ccc(cc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCCO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CON(C)C(=O)c1ccc(cc1Cl)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCN(CC)C1CCN(C1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)C(=O)N2CCN(C)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1c(F)cc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCCN1CCN(CC1)C(=O)c1c(F)cc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC4CC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NCCN3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3C[C@H]4C[C@@H]3CN4C)c(F)c2)c1C#Cc1ccc(N)nc1 |r,THB:20:19:13.14:16,11:13:18.19:16|
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)OCCCO4)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)CC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(C3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)CC4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)C4)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1C)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)CC4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(C)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1C)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)C4)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)OCCCO4)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)OC)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C3CCN(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCS(=O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C)(O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](O)C3)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCN(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccn3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccncc3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3(C)COC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCC[C@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCC[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4ccnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4cnnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4c(C)cnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(COC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4ccnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4cnnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4c(C)cnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(COC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CNC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CNC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4c(COC)nnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(COC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC#C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(F)(F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4c(COC)nnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N(C)CCN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC#C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(F)(F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NCCN3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NCC3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N(C)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(NC)nc1 |r|
CCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN4CCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(C)C(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CC[C@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(CC3)C(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CC(F)F)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(C)(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CC3)C=O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(CO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CCC#N)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN4CCC[C@H]4C3)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
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CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC(F)F)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(C)(O)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C=O)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CO)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCC#N)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(c2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1c(F)cc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN4CCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC(C)(C)O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)C(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCC#N)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4c(C)cnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4cnnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4ccnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CNC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4c(C)cnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4cnnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4ccnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
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CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCN(CC2)C2CCC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCC3(CN(C3)C(=O)OC(C)(C)C)CC2)c(F)c1
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CCc1ncnc(-c2ccc(C(=O)N3CC4(CNC4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2ccc(C(=O)N3CCC(CN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
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CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2ccc(C(=O)N3CC4(CN(C)C4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CC4(CN(C)C4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC(C4)NC(=O)OC(C)(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC(N)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
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CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)CNCCO4)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CN(C4)C(=O)OC(C)(C)C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CNC4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOC4(CCN(CC4)C(=O)OC(C)(C)C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOC4(CCNCC4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(C3)CCN(CC4)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(C3)CCNCC4)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CN(C[C@@H]4C3)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CNC[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CCN([C@@H]4C3)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CCN[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CC4(CN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC4(CN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC4(CN(C)C4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CN(C)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CN(C)C4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CN(C)C4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CN(C)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C[C@H]3C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C[C@@H]3C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ncon4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@H]3C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@@H]3C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOCCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ncon4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@H]3C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@@H]3C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(C)(C)O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(N2CCc3ncnc(O[C@H]4CCN(C4)C(=O)C4CCOCC4)c3C2)c(OC)n1 |r|
COc1ncc(cc1C#N)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc(OC)c(OC)c1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
Nc1ncc(cc1C#N)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COCC(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C#N |r|
COc1ncc(cc1C#N)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCCC3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3oc(C)nc3C)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccoc3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnco3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cncn3C)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3coc(C)n3)c2C1 |r|
COC1CC(C1)C(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc(OC)c(C)c1 |r,wD:11.14,(9,5.87,;8.61,4.38,;7.12,3.98,;6.35,2.65,;5.02,3.42,;5.79,4.75,;3.53,3.02,;2.44,4.11,;3.13,1.53,;4.03,.29,;3.13,-.96,;1.66,-.48,;1.66,1.06,;.33,-1.25,;.33,-2.79,;1.66,-3.56,;1.66,-5.1,;.33,-5.87,;-1,-5.1,;-2.34,-5.87,;-3.67,-5.1,;-3.67,-3.56,;-2.34,-2.79,;-1,-3.56,;-5,-2.79,;-5,-1.25,;-6.34,-.48,;-7.67,-1.25,;-9,-.48,;-9,1.06,;-7.67,-2.79,;-9,-3.56,;-6.34,-3.56,)|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cocn3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCN(CC3)C(C)=O)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ocnc3C)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)[nH]c3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)c2C1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cocn3)c2C1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnco3)c2C1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3coc(C)n3)c2C1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOC(C)(C)C3)c2C1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3oc(C)nc3C)c2C1 |r|
COc1cc(cnc1OC)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCC(F)(F)CC3)c2C1 |r|
COc1ncc(cc1C#N)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)CC3CCOCC3)c2C1 |r|
COc1ncc(cc1C#N)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3oc(C)nc3C)c2C1 |r|
COc1ncc(cc1C#N)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOC(C)(C)C3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ncoc3C)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnoc3C)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3conc3C)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccon3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccno3)c2C1 |r|
COc1ncc(cc1[N+]#[C-])N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cscn3)c2C1 |r|
COc1ncc(cc1[N+]#[C-])N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnn(C)c3)c2C1 |r|
COc1ncc(cc1[N+]#[C-])N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccn(C)n3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOC(C)(C)C3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3oc(C)nc3C)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cncs3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccnn3C)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CNC(=O)C3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cccnc3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnc[nH]3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCC(=O)N3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3ccncc3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cn(C)nc3C)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cn[nH]c3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3nnc(C)o3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnccn3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnn(C)c3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cscn3)c2C1 |r|
COc1ncc(cc1Cl)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
Nc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(OC3CN(C3)C(=O)C3CCOCC3)c2C1
COc1ncc(cn1)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
O=C(C1CCOCC1)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc2ccccc2c1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)CC(C)(C)C)c2C1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C(F)(F)F |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C#N |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)c3ccccn3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)c3ncccn3)c2C1 |r|
CCC(=O)N1CC[C@@H](C1)Nc2c3c(ncn2)CCN(C3)c4cc(c(nc4)OC)C(F)(F)F
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1C#N)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCN(CC3)C(C)=O)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOC(C)(C)C3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)c3cnco3)c2C1 |r|
CO[C@H]1CC[C@H](CC1)C(=O)N1CC[C@@H](C1)Nc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C(F)(F)F |r,wU:5.8,2.1,wD:13.16,(10.58,2.37,;9.81,3.7,;8.27,3.7,;7.5,2.37,;5.96,2.37,;5.19,3.7,;5.96,5.04,;7.5,5.04,;3.65,3.7,;2.88,5.04,;2.88,2.37,;3.79,1.12,;2.88,-.12,;1.42,.35,;1.42,1.89,;.09,-.42,;.09,-1.96,;1.42,-2.73,;1.42,-4.27,;.09,-5.04,;-1.25,-4.27,;-2.58,-5.04,;-3.92,-4.27,;-3.92,-2.73,;-2.58,-1.96,;-1.25,-2.73,;-5.25,-1.96,;-5.25,-.42,;-6.58,.35,;-7.92,-.42,;-9.25,.35,;-9.25,1.89,;-7.92,-1.96,;-6.58,-2.73,;-9.25,-2.73,;-10.58,-1.96,;-9.25,-4.27,;-10.02,-1.39,)|
CO[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@@H](C1)Nc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C(F)(F)F |r,wU:5.8,wD:13.16,2.1,(10.58,2.37,;9.81,3.7,;8.27,3.7,;7.5,5.04,;5.96,5.04,;5.19,3.7,;5.96,2.37,;7.5,2.37,;3.65,3.7,;2.88,5.04,;2.88,2.37,;3.79,1.12,;2.88,-.12,;1.42,.35,;1.42,1.89,;.09,-.42,;.09,-1.96,;1.42,-2.73,;1.42,-4.27,;.09,-5.04,;-1.25,-4.27,;-2.58,-5.04,;-3.92,-4.27,;-3.92,-2.73,;-2.58,-1.96,;-1.25,-2.73,;-5.25,-1.96,;-5.25,-.42,;-6.58,.35,;-7.92,-.42,;-9.25,.35,;-9.25,1.89,;-7.92,-1.96,;-6.58,-2.73,;-9.25,-2.73,;-10.58,-1.96,;-9.25,-4.27,;-10.02,-1.39,)|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)[C@@H]3CC[C@H](O)CC3)c2C1 |r,wU:28.29,31.33,wD:21.21,(-8.87,1.89,;-8.87,.35,;-7.53,-.42,;-6.2,.35,;-4.86,-.42,;-4.86,-1.96,;-6.2,-2.73,;-7.53,-1.96,;-8.87,-2.73,;-10.2,-1.96,;-8.87,-4.27,;-9.64,-1.39,;-3.53,-2.73,;-3.53,-4.27,;-2.2,-5.04,;-.86,-4.27,;.47,-5.04,;1.8,-4.27,;1.8,-2.73,;.47,-1.96,;.47,-.42,;1.8,.35,;3.27,-.12,;4.17,1.12,;3.27,2.37,;1.8,1.89,;4.04,3.7,;3.27,5.04,;5.58,3.7,;6.35,2.37,;7.89,2.37,;8.66,3.7,;10.2,3.7,;7.89,5.04,;6.35,5.04,;-.86,-2.73,;-2.2,-1.96,)|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)[C@H]3CC[C@H](O)CC3)c2C1 |r,wU:28.29,wD:21.21,31.33,(-8.87,1.89,;-8.87,.35,;-7.53,-.42,;-6.2,.35,;-4.86,-.42,;-4.86,-1.96,;-6.2,-2.73,;-7.53,-1.96,;-8.87,-2.73,;-10.2,-1.96,;-8.87,-4.27,;-9.64,-1.39,;-3.53,-2.73,;-3.53,-4.27,;-2.2,-5.04,;-.86,-4.27,;.47,-5.04,;1.8,-4.27,;1.8,-2.73,;.47,-1.96,;.47,-.42,;1.8,.35,;3.27,-.12,;4.17,1.12,;3.27,2.37,;1.8,1.89,;4.04,3.7,;3.27,5.04,;5.58,3.7,;6.35,5.04,;7.89,5.04,;8.66,3.7,;10.2,3.7,;7.89,2.37,;6.35,2.37,;-.86,-2.73,;-2.2,-1.96,)|
COc1ncc(cc1C)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)c3cn(C)cn3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)c3cnco3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)c3cocn3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOC(C)(C)C3)c2C1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2CCN(Cc12)c1cnc(OC)c(C)c1 |r|
COc1ncc(cc1Cl)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1C)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
FC(F)(F)c1cncc(c1)N1CCc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)N3CCN(C)CC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)N3CCOCC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)N3CCC(O)CC3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)N(C)CCO)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)N3CCN(CC3)C(C)=O)c2C1 |r|
COC(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1cnc(OC)c(c1)C#N |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cocn3)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCN(CC3)C(C)=O)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cncn3C)c2C1 |r|
COc1ncc(cc1C(F)(F)F)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)c3cnco3)c2C1 |r|
COc1ccc(cn1)N1CCc2ncnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c2C1 |r|
Cc1nc2ccccn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cncc(c1)-c1cnc2ccccn12
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccccn12
Cc1ccn2c(cnc2c1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Cc1nc2ccc(Br)cn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(Br)cn12
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1ccncc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1cccnc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)N1CCOCC1
COc1cc(cnc1OC)-c1cnc2ccccn12
COc1cc(cnc1OC)-c1cnc2ccc(Br)cn12
COc1cc(cnc1OC)-c1cnc2ccc(cn12)-c1ccncc1
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1CCOC1=O
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1[C@H](Cc2ccccc2)COC1=O |r|
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1[C@@H](Cc2ccccc2)COC1=O |r|
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccn(Cc3ccccc3)c(=O)n12
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1ccncc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1ccnc(c1)C(F)(F)F
CS(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(ccn12)-c1cccnc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(ccn12)-c1ccncc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(ccn12)-c1cccnc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(C)c(cn12)-c1ccncc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ncccn12
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(Cl)nn12
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cccc(F)c2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1cccnc1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1cccc(c1)C#N
Cc1c(nc2c(F)cccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccncc1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1cccnc1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)-c1ccnc(N)n1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)-c1ccnc(N)n1)-c1ccccn1
CC(C)c1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1ncccc1-c1nc2cc(F)ccc2c(N2CC3(CCOCC3)c3ccc(cc23)N2CCOCC2)c1C
Cc1ncccc1-c1nc2cc(F)ccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
COCCN(C)c1cnc2c(c1)N(CC2(C)C)c1c(C)c(nc2cc(F)ccc12)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)-c1cn[nH]c1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)-c1ncnc2nc[nH]c12)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)C(N)=O)-c1ccccn1
Cc1cc(C)cc(c1)-c1nc2cc(F)ccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Cc1cc(nc(N)n1)-c1ccc2c(c1)N(CC2(C)C)c1c(C)c(nc2cc(F)ccc12)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)-c1nc(N)ncc1Cl)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccccc1S(C)(=O)=O
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccc1S(C)(=O)=O
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)-c1ccnc(N)n1)-c1ccccc1S(C)(=O)=O
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1cccc(=O)[nH]1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccc1S(C)(=O)=O
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cccc(=O)[nH]1
COc1cccc(n1)-c1nc2cc(F)ccc2c(N2CC3(CCOCC3)c3ccc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1cccc(c1)S(C)(=O)=O
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cccc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1cc(F)ccc1F
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1c(nc2cccc(F)c2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1c(nc2cccc(Cl)c2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccc1F
Cc1ccc(F)c2c(N3CC(C)(C)c4ncc(cc34)N3CCOCC3)c(C)c(nc12)-c1ccccn1
CC1(C)CN(c2cc(cnc12)N1CCOCC1)c1c(C#N)c(nc2cc(F)ccc12)-c1ccccn1
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)N1CCCCC1
COc1cc2nc(C)c(C)c(N3CC(C)(C)c4ccc(cc34)N3CCOCC3)c2cc1Cl
COc1cc2nc(C)c(C)c(N3CC(C)(C)c4ccc(cc34)N3CCOCC3)c2cc1C
Cc1cc(Cl)c2nc(C)c(C)c(N3CC(C)(C)c4ccc(cc34)N3CCOCC3)c2c1
COc1cc(OC)c2nc(C)c(C)c(N3CC(C)(C)c4ccc(cc34)N3CCOCC3)c2c1
COc1ccccc1-c1cc(N2CC(C)(C)c3ccc(cc23)N2CCOCC2)c2cc(Cl)ccc2n1
Cc1nc2ccc(Cl)cc2c(N2CC(C)(C)c3ccc(cc23)-c2ccncc2)c1C
Cc1nc2ccc(Cl)cc2c(N2CC(C)(C)c3ccc(cc23)-c2cn[nH]c2)c1C
Cc1nc2ccc(Cl)cc2c(N2CC(C)(C)c3ccc(cc23)N2CCOCC2)c1C
Cc1nc2ccc(Cl)cc2c(N2CCOc3ccc(cc23)N2CCOCC2)c1C
COc1cc(cc2n(ccc12)-c1c(C)c(C)nc2ccc(Cl)cc12)-c1ccncc1 |(1.26,6.82,;-.07,6.05,;-.07,4.51,;1.26,3.74,;1.26,2.2,;-.07,1.43,;-1.41,2.2,;-2.87,1.72,;-3.78,2.97,;-2.87,4.21,;-1.41,3.74,;-3.35,.25,;-2.32,-.89,;-.81,-.57,;-2.79,-2.35,;-1.76,-3.5,;-4.3,-2.67,;-5.33,-1.53,;-6.84,-1.85,;-7.87,-.71,;-7.39,.76,;-8.42,1.9,;-5.89,1.08,;-4.86,-.07,;2.59,1.43,;2.59,-.11,;3.93,-.88,;5.26,-.11,;5.26,1.43,;3.93,2.2,)|
COc1cc(cc2n(ccc12)-c1c(C)c(C)nc2ccc(Cl)cc12)-c1cn[nH]c1 |(1.26,6.82,;-.07,6.05,;-.07,4.51,;1.26,3.74,;1.26,2.2,;-.07,1.43,;-1.41,2.2,;-2.87,1.72,;-3.78,2.97,;-2.87,4.21,;-1.41,3.74,;-3.35,.25,;-2.32,-.89,;-.81,-.57,;-2.79,-2.35,;-1.76,-3.5,;-4.3,-2.67,;-5.33,-1.53,;-6.84,-1.85,;-7.87,-.71,;-7.39,.76,;-8.42,1.9,;-5.89,1.08,;-4.86,-.07,;2.59,1.43,;2.75,-.11,;4.26,-.43,;5.03,.91,;4,2.05,)|
Cc1nc2ccc(Cl)cc2c(c1C)-n1ccc2c(O)cc(cc12)-c1cn[nH]c1 |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;-2.67,,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;4.47,5.05,;3.99,6.52,;5.97,4.73,;6.45,3.27,;5.42,2.13,;3.91,2.45,;7.96,2.95,;8.58,1.54,;10.11,1.7,;10.43,3.21,;9.1,3.98,)|
Cc1nc2ccc(Cl)cc2c(c1C)-n1ccc2c(cc(cc12)-c1ccncc1)C#N |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;-2.67,,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;4.47,5.05,;5.97,4.73,;6.45,3.27,;5.42,2.13,;3.91,2.45,;7.96,2.95,;8.43,1.48,;9.94,1.16,;10.97,2.31,;10.49,3.77,;8.99,4.09,;3.99,6.52,;3.52,7.98,)|
Cc1nc2ccc(Cl)cc2c(c1C)-n1ccc2c(cc(cc12)-c1cn[nH]c1)C#N |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;-2.67,,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;4.47,5.05,;5.97,4.73,;6.45,3.27,;5.42,2.13,;3.91,2.45,;7.96,2.95,;8.58,1.54,;10.11,1.7,;10.43,3.21,;9.1,3.98,;3.99,6.52,;3.52,7.98,)|
Cc1c(nc2ccc(Cl)cc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)C(F)(F)F
COc1cc(cc2n(ccc12)-c1c(C)c(C)nc2ccc(Cl)cc12)N1CCOCC1 |(1.26,6.82,;-.07,6.05,;-.07,4.51,;1.26,3.74,;1.26,2.2,;-.07,1.43,;-1.41,2.2,;-2.87,1.72,;-3.78,2.97,;-2.87,4.21,;-1.41,3.74,;-3.35,.25,;-2.32,-.89,;-.81,-.57,;-2.79,-2.35,;-1.76,-3.5,;-4.3,-2.67,;-5.33,-1.53,;-6.84,-1.85,;-7.87,-.71,;-7.39,.76,;-8.42,1.9,;-5.89,1.08,;-4.86,-.07,;2.59,1.43,;3.93,2.2,;5.26,1.43,;5.26,-.11,;3.93,-.88,;2.59,-.11,)|
Cc1nc2ccc(Cl)cc2c(c1C)-n1ccc2c(cc(cc12)N1CCOCC1)C#N |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;-2.67,,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;4.47,5.05,;5.97,4.73,;6.45,3.27,;5.42,2.13,;3.91,2.45,;7.96,2.95,;8.99,4.09,;10.49,3.77,;10.97,2.31,;9.94,1.16,;8.43,1.48,;3.99,6.52,;3.52,7.98,)|
Cc1nc2ccc(Cl)cc2c(N2CC3(CCOCC3)c3ccc(cc23)N2CCOCC2)c1C
Cc1nc2ccccc2c(N2CC3(CCOCC3)c3ccc(cc23)N2CCOCC2)c1C
COc1cc2nc(C)c(C)c(N3CC4(CCOCC4)c4ccc(Br)cc34)c2cc1Cl
COc1cc2nc(C)c(C)c(N3CC4(CCOCC4)c4ccc(cc34)C#N)c2cc1Cl
Cc1nc2c(C)cccc2c(N2CC3(CCOCC3)c3ccc(cc23)N2CCOCC2)c1C
COc1cc2nc(C)c(C)c(N3CC(C)(C)c4ccc(N5CCOCC5)c(C)c34)c2cc1Cl
CC1(C)CN(c2cc(ccc12)N1CCOCC1)c1c2CCCc2nc2ccc(Cl)cc12
CC1(C)CN(c2cc(ccc12)N1CCOCC1)c1c2CCCCc2nc2ccc(Cl)cc12
CC1(C)CN(c2cc(ccc12)N1CCOCC1)c1c2CCC(C)(C)c2nc2ccc(Cl)cc12
Cc1cnc2ccccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)-c1ccncc1)-c1ccccn1
Cc1cc(Cl)cc2c(N3CC(C)(C)c4ccc(cc34)N3CCOCC3)c(C)c(C)nc12
Cc1c(nc2ccccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccc1F
Cc1nc2c(C)cccc2c(N2CC(C)(C)c3ccc(cc23)N2CCOCC2)c1C
Cc1nc2c(Cl)cccc2c(N2CC(C)(C)c3ccc(cc23)N2CCOCC2)c1C
Cc1nc2c(cccc2c(N2CC(C)(C)c3ccc(cc23)N2CCOCC2)c1C)C(F)(F)F
Cc1nc2ccc(Cl)cc2c(c1C)-n1cc(C#N)c2ccc(cc12)-c1cn[nH]c1 |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;-2.67,,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;2.67,1.54,;1.42,2.45,;1.9,3.91,;.99,5.16,;.09,6.4,;3.44,3.91,;4.47,5.05,;5.97,4.73,;6.45,3.27,;5.42,2.13,;3.91,2.45,;7.96,2.95,;8.58,1.54,;10.11,1.7,;10.43,3.21,;9.1,3.98,)|
CCc1c(C)nc2ccc(Cl)cc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1
Cc1nc2ccccc2c(N2CC(C)(C)c3ccc(cc23)N2CCOCC2)c1C
COc1cc2nc(C)c(C)c(N3CCS(=O)(=O)c4ccc(cc34)N3CCOCC3)c2cc1Cl
Cc1c(nc2cccc(F)c2c1N1CCS(=O)(=O)c2ccc(cc12)N1CCOCC1)-c1ccccc1F
Cc1c(nc2ccccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccc1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccccc1F
Cc1c(nc2ccccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccccc1
Cc1c(nc2cc(Cl)ccc2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-c1ccccc1F
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccc1F
Cc1c(Cc2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)C(=C)c1ccccc1
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cccc2ccccc12
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccc2n(C)ccc2c1
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cccc2[nH]ccc12
Cc1c(Cc2cccc(F)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1c(CCc2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1c(Cc2cccc(c2)C#N)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1c(nc2cc(F)ccc2c1N1CCOc2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)C1=CCOCC1)-c1ccccn1 |t:27|
Cc1c(\C=C\c2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1c(Nc2ccccn2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1c(nc2cccc(F)c2c1N1CCS(=O)(=O)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)C1(CC1)c1ccccc1
Cc1ccnc(c1)-c1nc2cc(F)ccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)N1CCCCC1=O
COc1cccc(Cc2nc3cc(F)cc(F)c3c(N3CC(C)(C)c4ncc(cc34)N3CCOCC3)c2C)c1
Cc1c(Cc2cccc(c2)C(F)(F)F)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Cc1ccnc(c1)-c1nc2cc(F)cc(F)c2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(F)c1
Cc1cncc(c1)-c1nc2cc(F)cc(F)c2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(c1)S(C)(=O)=O
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)N1CCCC1=O
Cc1ccnc(c1)-c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCCC1=O
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cccc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(cc12)-c1cn[nH]c1)-c1ccccn1
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccc1S(C)(=O)=O
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-n1ccccc1=O
Cc1nc2c(Cl)cccc2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCC1=O
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCCC1=O
Cc1cc(C)cc(c1)-c1nc2cc(F)ccc2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Cc1ccc(c(c1)-c1nc2cc(F)cc(F)c2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C)S(C)(=O)=O
Cc1ccnc(c1)-c1nc2cc(F)ccc2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
COc1cc(ccn1)-c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCOC(C)(C)C1
Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)N1CCOC(C)(C)C1
Cc1ccc(c(c1)-c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C)S(C)(=O)=O
Cc1c(nc2cc(F)ccc2c1N1CCS(=O)(=O)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1ccnc(c1)-c1nc2cc(F)ccc2c(N2CCS(=O)(=O)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2ncccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCC1=O
Cc1c(nc2ncccc2c1N1CCOc2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cnccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cnccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1cc(F)cc(F)c1
Cc1c(nc2cnccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cc(F)cc(F)c1
Cc1ccnc(c1)-c1nc2ncccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cc(F)cc(F)c1
COC(=O)N1CCN(CC1)c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CC(C)(C)CCC1=O
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCN(CC1)C(=O)OC(C)(C)C
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCNCC1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCS(=O)(=O)CC2)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCN(CC1)S(C)(=O)=O
Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cccc(F)c1
Cc1c(nc2ncccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1cccc(F)c1
Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccc1
Cc1c(nc2ncccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccc1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(Br)c(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(C#N)c(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(N)c(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(C=C)c(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(Cl)c(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2nc(Br)c(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2nc(C#N)c(cc12)N1CCOCC1)-c1ccccn1
Cc1ccnc(c1)-c1nc2ncccc2c(N2CC(C)(C)c3nc(Cl)c(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2nc(Cl)c(cc12)N1CCOCC1)-c1ccccn1
CNC(=O)N1CCN(CC1)c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCC1=O
Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CC(C)(C)CC1=O
Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(F)c1
Cc1ccnc(c1)-c1nc2cnccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Cc1c(nc2cnccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(F)c1
Cc1c(nc2cc(F)ccc2c1N1CC2(CS(=O)(=O)C2)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2cc(F)ccc2c1N1CC(CO)(CO)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)C1CC1
Cc1c(nc2ncccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1cc(F)cc(F)c1
CC(=O)Nc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cn1
Nc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cn1
N(c1cccc2n[nH]cc12)c1ncccc1-c1ncnc2nc[nH]c12
N(c1cccc2[nH]ccc12)c1ncccc1-c1ncnc2[nH]cnc12
COc1ccc(Nc2ncccc2-c2ncnc3nc[nH]c23)cn1
Nc1cc(nc(n1)C(F)(F)F)-c1cccnc1Nc1cccc2[nH]ncc12
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc2[nH]ccc12
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc(O)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc2[nH]ncc12
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)cc(n1)-c1cccnc1Nc1cccc(O)c1
Cc1nc(N)cc(n1)-c1cccnc1Nc1cccc2[nH]ncc12
Cc1nc(N)c(F)c(n1)-c1cccnc1Nc1cccc2[nH]ncc12
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cccc(O)c1
COc1ccc(Nc2ncc(C)cc2-c2nc(C)nc(N)n2)cn1
Cc1cnc(Nc2cccnc2)c(c1)-c1nc(C)nc(N)n1
COc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2ncnc(C)n2)cn1
Cc1nc(nc(n1)N)c2cc(cnc2Nc3ccc(nc3)OC)CN4CCN(CC4)S(=O)(=O)C
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cccc2[nH]ncc12
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(nc1)C(F)(F)F
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cncnc1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ncoc2c1
COc1ncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
COc1ccc(Nc2ncc(CN3CCNCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cn1
Cc1cnc(Nc2cccc3[nH]ccc23)c(c1)-c1nc(C)nc(N)n1
Cc1cnc(Nc2cccc3[nH]ncc23)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(Br)cc2-c2nc(C)nc(N)n2)cn1
CCOc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(N)nc1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(Cl)nc1
Cc1nc(-c2cccnc2Nc2cccc3n[nH]cc23)c2c[nH]nc2n1
Cc1nc(-c2cccnc2Nc2cccc3[nH]ccc23)c2[nH]cnc2n1
Cc1nc(-c2cccnc2Nc2cccc3n[nH]cc23)c2[nH]cnc2n1
COc1ccc(Nc2ncccc2-c2nc(C)nc3nc[nH]c23)cn1
Cc1nc(-c2cc(Cl)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
Cc1nc(-c2cc(Br)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
Cc1nc(-c2cc(cnc2Nc2cccc3[nH]ncc23)C(F)(F)F)c2nc[nH]c2n1
COc1ncc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(COCc2cnc(Nc3cccc4[nH]ccc34)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
Cc1nc(-c2cc(CO)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
COc1ccc(Nc2ncc(C=C)cc2-c2nc(C)nc3[nH]cnc23)cn1
CCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc2[nH]cnc12
COc1ccc(Nc2ncc(CCO)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(NCc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
COc1cccc(NCc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)c1
Cc1nc(Cl)nc(Cl)n1.Clc1nc(Cl)nc(Cl)n1.COc1ccc(CNc2nc(C)nc(Cl)n2)cc1.COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(Cl)n2)cc1
COc1ccc(Nc2ncc(CNc3cccnn3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNc3ccncc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNc3ccccn3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCNCC3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
COC(=O)N1CCN(Cc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)CC1
COc1ccc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(=O)(=O)N(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)C(C)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
COc1ccc(Nc2ncc(NCc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(Nc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COCCNc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc2[nH]cnc12
CCNc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc2[nH]cnc12
COc1ccc(CNc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
COc1cccc(Nc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCOCC2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCC(O)C2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCC[C@H]2CO)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCC[C@@H]2CO)cn1 |r|
CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cc1
COc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(-c2cc(Cc3ccc(cc3)S(C)(=O)=O)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
CC(=O)Nc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(-c2cc(Cc3ccc(cc3)S(C)(=O)=O)cnc2Nc2ccc(N)nc2)c2nc[nH]c2n1
Cc1nc(N)cc(n1)-c1cnccc1Nc1cccc2[nH]ncc12
CC(=O)Nc1cc(nc(C)n1)-c1cnccc1Nc1cccc2[nH]ccc12
Cc1nc(N)cc(n1)-c1cnccc1Nc1cccc2[nH]ccc12
Cc1nc(-c2cnccc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
COc1ccc(Nc2ccncc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(N)cc(n1)-c1nccnc1Nc1cccc2[nH]ncc12
COc1ccc(Nc2nc3ccccc3cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2nccnc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2cnccc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nccnc2-c2cc(N)nc(C)n2)cn1
COc1ccc(Nc2ncncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nc(N)ncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nc(OC)ncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N2CCOCC2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N(C)C)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N2CCCC2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N2CCCCC2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)-c2ccncc2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)-c2ccc(F)cc2)cn1
COc1ccc(Nc2nc(NC3CCCC3)ncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ocnc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCOCC2)cnc1Nc1ccc2scnc2c1
COc1ncc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(O)C(C)(C)C)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](O)C(C)(C)C)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@H](O)C(C)(C)C)cn1 |r|
COc1ccc(Nc2ncc(CNC(C)(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNC(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNCc3ccccn3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNCc3ccncc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNCc3cccnc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(O)c2ccc(cc2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(CC2)S(C)(=O)=O)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cn1 |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)c2ccc(cc2)S(C)(=O)=O)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)c2ccc(cc2)S(C)(=O)=O)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(=O)N2CCOCC2)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(=O)N2CCN(CC2)S(C)(=O)=O)cc1F
COCCNC(=O)c1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCOCC3=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CC3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(Cc3ccccc3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(C)CC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(C[C@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cc1F
CN(C)C(=O)N1CCN(Cc2cnc(Nc3cnc(O)c(F)c3)c(c2)-c2nc(C)nc(N)n2)CC1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cnc(O)c(F)c1
COc1cncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)c1
CNc1nc(C)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(OC)nc1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc(OC(F)F)c1
Cc1nc2cc(Nc3ncccc3-c3nc(C)nc(N)n3)ccc2o1
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1F
COc1cc(Nc2ncccc2-c2nc(C)nc(N)n2)ccc1F
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc2OC(F)(F)Oc2c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccc(OC)nc2)cn1
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1OC
Cc1ccc2cc(Nc3ncccc3-c3nc(C)nc(N)n3)ccc2n1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccccn2)cn1
COc1ncc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1Cl
Cc1cncc(Nc2ncccc2-c2nc(C)nc(N)n2)c1
COc1ncc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2ccncc2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(=O)N2CCC(O)CC2)cc1F
COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2cc(N)nc(C)n2)cn1
COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)cc(n1)-c1nc2ccccc2nc1Nc1cccc2[nH]ncc12
CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cc1Cl
Cc1nc(-c2cccnc2Nc2ccc(NC(=O)C3CC3)cc2)c2nc[nH]c2n1
COc1cncc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)c1
COc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2ncc(F)cc2-c2nc(C)nc(N)n2)cc1F
Cc1nc(N)nc(n1)-c1cc(F)cnc1Nc1cncc(F)c1
COc1ncc(Nc2ncc(C=O)cc2-c2nc(C)nc(N)n2)cc1F
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1NC1CCOCC1
COCCNc1nc(C)nc(n1)-c1cc(Cl)cnc1Nc1cnc(OC)c(F)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(NC(=O)Nc2ccccc2)nc1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(NC(=O)Nc2cccc(F)c2)nc1
CC(C)NC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1
CC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1
COC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1
COCCOc1ccc(NC(=O)Nc2ccc(Nc3ncc(Cl)cc3-c3nc(C)nc(N)n3)cn2)cc1
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2nc(C)ccc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2nc(CN3CCOCC3)ccc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2nc(COCC(F)(F)F)ccc2-c2nc(C)nc(N)n2)cc1F
Cc1ccc(c(Nc2cncc(F)c2)n1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCSCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCS(=O)CC3)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cnc2n(C)cnc2c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CC[C@H](CO)C2)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CC[C@H](O)C2)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CC[C@@H](O)C2)cn1 |r|
COc1ncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(=O)(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCC(O)CC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC[C@@H](CO)C3)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ccc(Nc2ncc(CN3CCOC[C@@H]3C)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ccc(Nc2ncc(CN3CCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCCCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCC(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CNCCO)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN[C@H](C)CO)cc2-c2nc(C)nc(N)n2)cn1 |r|
COCCNCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCC(C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(O)C3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC4(C3)NC(=O)NC4=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(N)C3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(C3)NS(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCn4ncnc4C3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)c2cc(Br)ccc2S(=O)(=O)N(C)C)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)c2ccc(cc2)S(=O)(=O)N(C)C)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N)c2ccc(cc2)S(=O)(=O)N(C)C)cn1
COc1ccc(Nc2nc3ccccc3cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ccccc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2scnc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ncsc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cncc(F)c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cn[nH]c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cc[nH]n1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cc(F)cc2[nH]ncc12
COc1ncc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2cnn(C)c2)cn1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(F)c(F)c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCNCC2)cn1 |t:23|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2cn[nH]c2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccc(C)nc2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccnnc2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2cncc(F)c2)cn1
COc1ccc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2cccnc2)cn1
COc1ncc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2cccnc2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCOCC2)cn1 |t:23|
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cncc(F)c1
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(F)c1)-c1cnn(C)c1
COCCOc1ccc(c(Nc2cnc(OC)c(F)c2)n1)-c1nc(C)nc(N)n1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2[nH]cnc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCNCC2)cnc1Nc1ccc2[nH]cnc2c1
COc1ccc(Nc2ncc(OC(F)F)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cc[nH]c(=O)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(N)c1
CC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cc1F
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](O)C(F)(F)F)cn1.COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](O)C(F)(F)F)cn1 |r|
COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1F
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@H](C)N2CCOCC2)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCOCC2)cc1F |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCN(CC2)S(C)(=O)=O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCOCC2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(CC2)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ncc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cc1F
COc1ncc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)(C)O)cc1F
COc1ccc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)=O)cn1
COc1ccc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
C[C@@H](N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2cc(F)c3cccnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
CC(N1CCOCC1)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCN(CC1)C(=O)N(C)C)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCOCC2)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCOCC2)cc1F |r|
C[C@@H](N1CCN(C[C@@H]1C)S(C)(=O)=O)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)C(=O)N(C)C)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(O)CC2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)NC(C)C)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(N)CC2)cc1F
CCC(N)(CC)c1cnc(Nc2cnc(OC)c(F)c2)c(c1)-c1nc(C)nc(N)n1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1C(C)C |r|
CCS(=O)(=O)c1cnc(Nc2cnc(OC)c(F)c2)c(c1)-c1nc(C)nc(N)n1
Cc1nc(N)cc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
Cc1nc(N)cc(n1)-c1nccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CC(C2)S(C)(=O)=O)cn1
C[C@@H](N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2ccc(Cl)nc2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@@H](N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2ccc3cccnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)CO)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)CO)cc1F
COc1ncc(Nc2ncc(CN3CCN(CC3C(F)(F)F)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)C(F)(F)F)cc1F
COc1ncc(Nc2ncc(CN3CCOC[C@@H]3C)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1ncc(Nc2ncc(CN3CCN(C[C@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1cc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cnc1Cl |r|
C[C@H]1CN(CCN1Cc1cnc(Nc2ccc(Cl)nc2)c(c1)-c1nc(C)nc(N)n1)S(C)(=O)=O |r|
COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(O)C(F)(F)F)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](O)C(F)(F)F)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](O)C(F)(F)F)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N)C(F)(F)F)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ccncc2c1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N)cc1F
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1)C1CCOCC1
COc1ncc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cc1NS(C)(=O)=O
COc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
COc1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1
Cc1nc(N)nc(n1)-c1cc(CN2CCOCC2)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C(F)(F)F)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F.COc1ncc(Nc2ncc(CN3CCN(C[C@H]3C(F)(F)F)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N3CCOCC3)c2)c(c1)-c1nc(C)nc(N)n1
COCCOc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
COCCOc1cnc(Nc2cnc(OC)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
COc1ncc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1NS(C)(=O)=O
Cc1nc(-c2cccnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c2nc[nH]c2n1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc2[nH]cnc12 |w:1.0|
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc2[nH]cnc12 |w:1.0|
COc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cnc1Cl |r|
COc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cnc1Cl
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCOCC2)cc1F |t:23|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2CCOCC2)cc1F
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)C(C)(C)O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)C(O)=O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)C(C)(C)O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1C(F)(F)F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)O)cc1F
COc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cnc1OC
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(OC(=O)c2cccc(Cl)c2)C(C)(C)O)cc1F
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(F)c1)C(C)(C)O
COc1cncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)c1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1C
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(c1)S(C)(=O)=O)C(C)(C)O
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(c1)S(=O)(=O)c1ccccc1)C(C)(C)O
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C(C)C)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)CC(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C3CC3)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cn1 |r|
C[C@@H](N1CCN(C[C@@H]1C)S(C)(=O)=O)c1cnc(Nc2ccc(Cl)nc2)c(c1)-c1nc(C)nc(N)n1 |r|
COc1ncc(Nc2ncc(CN3CCN([C@H](C)C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)C2CC2)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)N2CCOCC2)c1
CC(C)N(C)S(=O)(=O)Nc1cc(Nc2ncccc2-c2nc(C)nc(N)n2)cnc1Cl
COc1cnc(Nc2cnc(Cl)c(N)c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1
C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1 |r|
CN(C)S(=O)(=O)Nc1cc(Nc2ncccc2-c2cc(N)nc(C)n2)cnc1Cl
COCCOc1cnc(Nc2cnc(C)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(C)c(NS(C)(=O)=O)c1
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cnc(C)c(NS(C)(=O)=O)c1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1cc(N)nc(C)n1
Cc1nc(N)cc(n1)-c1cc(C=C)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1cc(N)nc(C)n1 |r|
C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1cc(N)nc(C)n1 |r|
COc1ncc(Nc2ncc(CN3CCN4C(CCS4(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cc1F
CN(C)S(=O)(=O)Nc1cc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cnc1Cl
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cc1F)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cc1F)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
O=C(OCc1ccccc1)C1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)[nH]c1=O |(-1.5,.55,;-.01,.95,;.39,2.44,;-.7,3.53,;-.3,5.02,;1.18,5.41,;1.58,6.9,;.49,7.99,;-.99,7.59,;-1.39,6.1,;1.08,-.14,;2.56,.26,;3.65,-.83,;3.26,-2.32,;1.77,-2.71,;.68,-1.62,;4.34,-3.4,;4.02,-4.91,;5.36,-5.68,;5.36,-7.22,;4.02,-7.99,;2.69,-7.22,;1.36,-7.99,;.02,-7.22,;.02,-5.68,;1.36,-4.91,;2.69,-5.68,;-1.31,-4.91,;-1.31,-3.37,;-2.64,-2.6,;-3.98,-3.37,;-5.31,-2.6,;-6.65,-3.37,;-6.65,-4.91,;-5.31,-5.68,;-3.98,-4.91,;-2.64,-5.68,;6.5,-4.65,;5.88,-3.24,;6.65,-1.91,)|
Cn1c2cnc3ccc(nc3c2n(C2CCC(CC2)C(=O)OCc2ccccc2)c1=O)-c1cnc2ccccc2c1 |(7.32,-5.05,;5.83,-4.65,;4.69,-5.68,;4.69,-7.22,;3.35,-7.99,;2.02,-7.22,;.68,-7.99,;-.65,-7.22,;-.65,-5.68,;.68,-4.91,;2.02,-5.68,;3.35,-4.91,;3.67,-3.4,;2.58,-2.32,;2.98,-.83,;1.89,.26,;.41,-.14,;.01,-1.62,;1.1,-2.71,;-.68,.95,;-2.17,.55,;-.29,2.44,;-1.37,3.53,;-.98,5.02,;.51,5.41,;.91,6.9,;-.18,7.99,;-1.67,7.59,;-2.06,6.1,;5.2,-3.24,;5.97,-1.91,;-1.98,-4.91,;-1.98,-3.37,;-3.32,-2.6,;-4.65,-3.37,;-5.98,-2.6,;-7.32,-3.37,;-7.32,-4.91,;-5.98,-5.68,;-4.65,-4.91,;-3.32,-5.68,)|
O=c1[nH]c2cnc3ccc(nc3c2n1C1CCNCC1)-c1cnc2ccccc2c1
CCN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
COC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CC(C)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CN(C)CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CCOC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CC(C)OC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(Cc4ccccc4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:19.19,wD:22.26,(-6.65,-.2,;-5.31,.57,;-3.98,-.2,;-3.98,-1.74,;-2.64,-2.51,;-1.31,-1.74,;-1.31,-.2,;-2.64,.57,;.02,-2.51,;.02,-4.05,;1.36,-4.82,;2.69,-4.05,;4.02,-4.82,;5.36,-4.05,;5.36,-2.51,;6.5,-1.48,;5.88,-.07,;6.65,1.26,;4.34,-.23,;3.26,.86,;1.77,.46,;.68,1.55,;1.08,3.04,;2.56,3.44,;3.65,2.35,;-.01,4.13,;-1.5,3.73,;-2.59,4.82,;-4.08,4.42,;4.02,-1.74,;2.69,-2.51,;1.36,-1.74,)|
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:19.19,wD:22.23,(-6.65,.15,;-5.31,.92,;-3.98,.15,;-3.98,-1.39,;-2.64,-2.16,;-1.31,-1.39,;-1.31,.15,;-2.64,.92,;.02,-2.16,;.02,-3.7,;1.36,-4.47,;2.69,-3.7,;4.02,-4.47,;5.36,-3.7,;5.36,-2.16,;6.5,-1.13,;5.88,.28,;6.65,1.61,;4.34,.12,;3.26,1.2,;1.77,.81,;.68,1.89,;1.08,3.38,;-.01,4.47,;2.56,3.78,;3.65,2.69,;4.02,-1.39,;2.69,-2.16,;1.36,-1.39,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:20.20,wD:23.27,(17.65,-10.2,;18.98,-9.43,;20.31,-10.2,;20.31,-11.74,;21.64,-12.51,;22.98,-11.74,;22.98,-10.19,;21.64,-9.43,;24.32,-12.51,;24.31,-14.05,;25.64,-14.81,;26.97,-14.04,;28.31,-14.81,;29.65,-14.03,;29.63,-12.48,;30.76,-11.45,;32.27,-11.76,;30.13,-10.05,;30.9,-8.71,;28.61,-10.22,;27.8,-8.92,;26.26,-8.97,;25.44,-7.67,;26.17,-6.31,;27.71,-6.25,;28.52,-7.56,;25.35,-5,;26.07,-3.64,;25.25,-2.34,;25.98,-.97,;28.3,-11.72,;26.97,-12.49,;25.63,-11.73,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:20.20,wD:23.24,(32.03,-7.87,;33.36,-7.1,;34.69,-7.87,;34.69,-9.41,;36.03,-10.18,;37.36,-9.41,;37.36,-7.86,;36.02,-7.1,;38.7,-10.18,;38.69,-11.72,;40.02,-12.49,;41.35,-11.71,;42.69,-12.48,;44.03,-11.7,;44.01,-10.15,;45.14,-9.12,;46.65,-9.43,;44.51,-7.72,;45.28,-6.39,;42.99,-7.89,;42.18,-6.59,;40.64,-6.65,;39.83,-5.35,;40.55,-3.98,;39.73,-2.68,;42.09,-3.93,;42.9,-5.23,;42.68,-9.39,;41.35,-10.17,;40.02,-9.41,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)C)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN(C)C)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(N)=O)CC4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC(F)(F)F)CC2)c1=O)-c1cnc2ccccc2c1
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(OC)nc2)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)C(C)(C)O)c1=O)-c1cnc2ccccc2c1
CN(C)CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)C(C)(C)N)c1=O)-c1cnc2ccccc2c1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnc2ccccc2c1 |r,wU:13.14,wD:16.18,(7.32,-1.53,;5.83,-1.13,;4.69,-2.16,;4.69,-3.7,;3.35,-4.47,;2.02,-3.7,;.68,-4.47,;-.65,-3.7,;-.65,-2.16,;.68,-1.39,;2.02,-2.16,;3.35,-1.39,;3.67,.12,;2.58,1.2,;1.1,.81,;.01,1.89,;.41,3.38,;-.68,4.47,;1.89,3.78,;2.98,2.69,;5.2,.28,;5.97,1.61,;-1.98,-1.39,;-1.98,.15,;-3.32,.92,;-4.65,.15,;-5.98,.92,;-7.32,.15,;-7.32,-1.39,;-5.98,-2.16,;-4.65,-1.39,;-3.32,-2.16,)|
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@@H](CC2)OCCO)c1=O)-c1cnc2ccccc2c1 |r,wU:13.14,wD:16.21,(7.32,-1.87,;5.83,-1.48,;4.69,-2.51,;4.69,-4.05,;3.35,-4.82,;2.02,-4.05,;.68,-4.82,;-.65,-4.05,;-.65,-2.51,;.68,-1.74,;2.02,-2.51,;3.35,-1.74,;3.67,-.23,;2.58,.86,;1.1,.46,;.01,1.55,;.41,3.04,;1.89,3.44,;2.98,2.35,;-.68,4.13,;-2.17,3.73,;-3.26,4.82,;-4.75,4.42,;5.2,-.07,;5.97,1.26,;-1.98,-1.74,;-1.98,-.2,;-3.32,.57,;-4.65,-.2,;-5.98,.57,;-7.32,-.2,;-7.32,-1.74,;-5.98,-2.51,;-4.65,-1.74,;-3.32,-2.51,)|
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:20.20,wD:23.27,(-7.32,-.2,;-5.98,.57,;-4.65,-.2,;-4.65,-1.74,;-3.32,-2.51,;-1.98,-1.74,;-1.98,-.2,;-3.32,.57,;-.65,-2.51,;-.65,-4.05,;.68,-4.82,;2.02,-4.05,;3.35,-4.82,;4.69,-4.05,;4.69,-2.51,;5.83,-1.48,;7.32,-1.87,;5.2,-.07,;5.97,1.26,;3.67,-.23,;2.58,.86,;1.1,.46,;.01,1.55,;.41,3.04,;1.89,3.44,;2.98,2.35,;-.68,4.13,;-2.17,3.73,;-3.26,4.82,;-4.75,4.42,;3.35,-1.74,;2.02,-2.51,;.68,-1.74,)|
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:21.21,wD:24.28,(-7.32,-.2,;-5.98,.57,;-5.98,2.11,;-4.65,-.2,;-4.65,-1.74,;-3.32,-2.51,;-1.98,-1.74,;-1.98,-.2,;-3.32,.57,;-.65,-2.51,;-.65,-4.05,;.68,-4.82,;2.02,-4.05,;3.35,-4.82,;4.69,-4.05,;4.69,-2.51,;5.83,-1.48,;7.32,-1.87,;5.2,-.07,;5.97,1.26,;3.67,-.23,;2.58,.86,;1.1,.46,;.01,1.55,;.41,3.04,;1.89,3.44,;2.98,2.35,;-.68,4.13,;-2.17,3.73,;-3.26,4.82,;-4.75,4.42,;3.35,-1.74,;2.02,-2.51,;.68,-1.74,)|
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(F)(F)F)CC4)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:19.19,wD:22.26,(-6.65,.57,;-5.32,-.2,;-5.32,-1.74,;-3.98,-2.51,;-2.65,-1.74,;-2.65,-.2,;-3.98,.57,;-1.32,-2.51,;-1.32,-4.05,;.02,-4.82,;1.35,-4.05,;2.69,-4.82,;4.02,-4.05,;4.02,-2.51,;5.16,-1.48,;6.65,-1.87,;4.54,-.07,;5.31,1.26,;3.01,-.23,;1.92,.86,;.43,.46,;-.66,1.55,;-.26,3.04,;1.23,3.44,;2.31,2.35,;-1.35,4.13,;-2.84,3.73,;-3.93,4.82,;-5.41,4.42,;2.69,-1.74,;1.35,-2.51,;.02,-1.74,)|
COCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)C(N)=O)c3c2n1 |r,wU:20.20,wD:23.27,(-7.32,-.59,;-5.98,.18,;-4.65,-.59,;-4.65,-2.13,;-3.32,-2.9,;-1.98,-2.13,;-1.98,-.59,;-3.32,.18,;-.65,-2.9,;-.65,-4.44,;.68,-5.21,;2.02,-4.44,;3.35,-5.21,;4.69,-4.44,;4.69,-2.9,;5.83,-1.87,;7.32,-2.27,;5.2,-.47,;5.97,.87,;3.67,-.63,;2.58,.46,;1.1,.06,;.01,1.15,;.41,2.64,;1.89,3.04,;2.98,1.95,;-.68,3.73,;-2.17,3.33,;-.29,5.21,;3.35,-2.13,;2.02,-2.9,;.68,-2.13,)|
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)C(N)=O)c3c2n1 |r,wU:18.18,wD:21.25,(-5.7,1.21,;-4.93,-.12,;-3.47,-.59,;-3.47,-2.13,;-4.93,-2.61,;-5.84,-1.36,;-2.13,-2.9,;-2.13,-4.44,;-.8,-5.21,;.54,-4.44,;1.87,-5.21,;3.2,-4.44,;3.2,-2.9,;4.35,-1.87,;5.84,-2.27,;3.72,-.47,;4.49,.87,;2.19,-.63,;1.1,.46,;-.39,.06,;-1.48,1.15,;-1.08,2.64,;.41,3.04,;1.5,1.95,;-2.17,3.73,;-3.65,3.33,;-1.77,5.21,;1.87,-2.13,;.54,-2.9,;-.8,-2.13,)|
COCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc(OC)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)O)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(=O)N(C)C)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@@H](CC2)C(N)=O)c1=O)-c1cnn(CCO)c1 |r,wU:13.14,wD:16.21,(6.87,-2.27,;5.38,-1.87,;4.24,-2.9,;4.24,-4.44,;2.9,-5.21,;1.57,-4.44,;.24,-5.21,;-1.1,-4.44,;-1.1,-2.9,;.24,-2.13,;1.57,-2.9,;2.9,-2.13,;3.22,-.63,;2.14,.46,;.65,.06,;-.44,1.15,;-.04,2.64,;1.45,3.04,;2.53,1.95,;-1.13,3.73,;-2.62,3.33,;-.73,5.21,;4.76,-.47,;5.53,.87,;-2.43,-2.13,;-3.89,-2.61,;-4.8,-1.36,;-3.89,-.12,;-4.29,1.37,;-5.78,1.77,;-6.87,.68,;-2.43,-.59,)|
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)c4ncccn4)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CCO)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cn[nH]c1 |r,wU:13.14,wD:16.18,(5.84,-1.53,;4.35,-1.13,;3.2,-2.16,;3.2,-3.7,;1.87,-4.47,;.54,-3.7,;-.8,-4.47,;-2.13,-3.7,;-2.13,-2.16,;-.8,-1.39,;.54,-2.16,;1.87,-1.39,;2.19,.12,;1.1,1.2,;-.39,.81,;-1.48,1.89,;-1.08,3.38,;-2.17,4.47,;.41,3.78,;1.5,2.69,;3.72,.28,;4.49,1.61,;-3.47,-1.39,;-4.93,-1.87,;-5.84,-.62,;-4.93,.62,;-3.47,.15,)|
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:20.20,wD:23.24,(-7.32,.15,;-5.98,.92,;-4.65,.15,;-3.32,.92,;-1.98,.15,;-1.98,-1.39,;-3.32,-2.16,;-4.65,-1.39,;-.65,-2.16,;-.65,-3.7,;.68,-4.47,;2.02,-3.7,;3.35,-4.47,;4.69,-3.7,;4.69,-2.16,;5.83,-1.13,;7.32,-1.53,;5.2,.28,;5.97,1.61,;3.67,.12,;2.58,1.2,;1.1,.81,;.01,1.89,;.41,3.38,;-.68,4.47,;1.89,3.78,;2.98,2.69,;3.35,-1.39,;2.02,-2.16,;.68,-1.39,)|
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:18.18,wD:21.22,(-5.7,1.96,;-4.93,.62,;-3.47,.15,;-3.47,-1.39,;-4.93,-1.87,;-5.84,-.62,;-2.13,-2.16,;-2.13,-3.7,;-.8,-4.47,;.54,-3.7,;1.87,-4.47,;3.2,-3.7,;3.2,-2.16,;4.35,-1.13,;5.84,-1.53,;3.72,.28,;4.49,1.61,;2.19,.12,;1.1,1.2,;-.39,.81,;-1.48,1.89,;-1.08,3.38,;-2.17,4.47,;.41,3.78,;1.5,2.69,;1.87,-1.39,;.54,-2.16,;-.8,-1.39,)|
CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cc[nH]n1 |r,wU:13.14,wD:16.18,(5.84,-1.53,;4.35,-1.13,;3.2,-2.16,;3.2,-3.7,;1.87,-4.47,;.54,-3.7,;-.8,-4.47,;-2.13,-3.7,;-2.13,-2.16,;-.8,-1.39,;.54,-2.16,;1.87,-1.39,;2.19,.12,;1.1,1.2,;-.39,.81,;-1.48,1.89,;-1.08,3.38,;-2.17,4.47,;.41,3.78,;1.5,2.69,;3.72,.28,;4.49,1.61,;-3.47,-1.39,;-4.93,-1.87,;-5.84,-.62,;-4.93,.62,;-3.47,.15,)|
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(N)=O)CC4)c3c2n1
CN(C)CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:19.19,wD:22.23,(-6.65,.92,;-5.32,.15,;-5.32,-1.39,;-3.98,-2.16,;-2.65,-1.39,;-2.65,.15,;-3.98,.92,;-1.32,-2.16,;-1.32,-3.7,;.02,-4.47,;1.35,-3.7,;2.69,-4.47,;4.02,-3.7,;4.02,-2.16,;5.16,-1.13,;6.65,-1.53,;4.54,.28,;5.31,1.61,;3.01,.12,;1.92,1.2,;.43,.81,;-.66,1.89,;-.26,3.38,;-1.35,4.47,;1.23,3.78,;2.31,2.69,;2.69,-1.39,;1.35,-2.16,;.02,-1.39,)|
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)NN)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C)CC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN(C)C)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CCO)CC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2n1
N[C@H]1CC[C@@H](CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)[nH]c1=O |r,wU:4.7,wD:1.0,(-.01,4.47,;1.08,3.38,;.68,1.89,;1.77,.81,;3.26,1.2,;3.65,2.69,;2.56,3.78,;4.34,.12,;4.02,-1.39,;5.36,-2.16,;5.36,-3.7,;4.02,-4.47,;2.69,-3.7,;1.36,-4.47,;.02,-3.7,;.02,-2.16,;1.36,-1.39,;2.69,-2.16,;-1.31,-1.39,;-1.31,.15,;-2.64,.92,;-3.98,.15,;-5.31,.92,;-6.65,.15,;-6.65,-1.39,;-5.31,-2.16,;-3.98,-1.39,;-2.64,-2.16,;6.5,-1.13,;5.88,.28,;6.65,1.61,)|
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(N)=O)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CCO)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cn[nH]c1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cc[nH]n1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)C)c3c2n1
COCCN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cnn(CCO)c1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)O)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cnc(N)nc1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(N)=O)CC4)c3c2n1
CC(C)C(=O)CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O
C[C@@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O |r|
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)O)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCNCC2)c1=O)-c1cnn(CCO)c1
Cn1c2cnc3ccc(nc3c2n(C2CCNCC2)c1=O)-c1cnc(N)nc1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnc(N)nc1 |r,wU:13.14,wD:16.18,(6.65,-1.53,;5.16,-1.13,;4.02,-2.16,;4.02,-3.7,;2.69,-4.47,;1.35,-3.7,;.02,-4.47,;-1.32,-3.7,;-1.32,-2.16,;.02,-1.39,;1.35,-2.16,;2.69,-1.39,;3.01,.12,;1.92,1.2,;.43,.81,;-.66,1.89,;-.26,3.38,;-1.35,4.47,;1.23,3.78,;2.31,2.69,;4.54,.28,;5.31,1.61,;-2.65,-1.39,;-2.65,.15,;-3.98,.92,;-5.32,.15,;-6.65,.92,;-5.32,-1.39,;-3.98,-2.16,)|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H](C)CO)c3c2n1 |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cnc(N)nc2)n(C)c1=O |r|
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cccc2[nH]ccc12 |r,wU:13.14,wD:16.18,(6.56,-1.53,;5.07,-1.13,;3.92,-2.16,;3.92,-3.7,;2.59,-4.47,;1.26,-3.7,;-.08,-4.47,;-1.41,-3.7,;-1.41,-2.16,;-.08,-1.39,;1.26,-2.16,;2.59,-1.39,;2.91,.12,;1.82,1.2,;.33,.81,;-.75,1.89,;-.36,3.38,;-1.45,4.47,;1.13,3.78,;2.22,2.69,;4.44,.28,;5.21,1.61,;-2.74,-1.39,;-2.74,.15,;-4.08,.92,;-5.41,.15,;-5.41,-1.39,;-6.56,-2.42,;-5.93,-3.83,;-4.4,-3.67,;-4.08,-2.16,)|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cccc3[nH]ccc23)n(C)c1=O |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2c[nH]c3nncc3c2)n(C)c1=O |r|
C[C@@H](CO)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H](C)CO)c3c2n1 |r|
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(N)nc2)n(C)c1=O
CNC(=O)Nc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
CNC(=O)Nc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(cc2)S(C)(=O)=O)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cccc(c2)-n2cccn2)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccnc3ncccc23)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccnc3[nH]ncc23)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)CO)c1=O)-c1ccnc2[nH]ncc12
C[C@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccnc3[nH]ncc23)n(C)c1=O |r|
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cccc3[nH]ncc23)n(C)c1=O
C[C@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cccc3[nH]ncc23)n(C)c1=O |r|
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)CO)c1=O)-c1cccc2[nH]ncc12
C[C@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O |r|
C[C@@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O |r|
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O
COCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)C(C)(C)O)c1=O)-c1cnc2[nH]ncc2c1
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)CO)c1=O)-c1cnc2[nH]ncc2c1
CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O
CCNC(=O)Nc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)OC(C)(C)C)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(CCN4CCNCC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1ccc2[nH]ncc2c1 |r,wU:13.14,wD:16.18,(7.27,-2.02,;5.78,-1.62,;4.64,-2.65,;4.64,-4.19,;3.31,-4.96,;1.97,-4.19,;.64,-4.96,;-.69,-4.19,;-.69,-2.65,;.64,-1.88,;1.97,-2.65,;3.31,-1.88,;3.63,-.37,;2.86,.96,;1.32,.96,;.55,2.29,;1.32,3.63,;.55,4.96,;2.86,3.63,;3.63,2.29,;5.16,-.21,;5.93,1.12,;-2.23,-2.65,;-2.23,-4.19,;-3.57,-4.96,;-4.9,-4.19,;-6.37,-4.67,;-7.27,-3.42,;-6.37,-2.17,;-4.9,-2.65,;-3.57,-1.88,)|
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnc2[nH]ncc2c1 |r,wU:13.14,wD:16.18,(7.27,-2.02,;5.78,-1.62,;4.64,-2.65,;4.64,-4.19,;3.31,-4.96,;1.97,-4.19,;.64,-4.96,;-.69,-4.19,;-.69,-2.65,;.64,-1.88,;1.97,-2.65,;3.31,-1.88,;3.63,-.37,;2.86,.96,;1.32,.96,;.55,2.29,;1.32,3.63,;.55,4.96,;2.86,3.63,;3.63,2.29,;5.16,-.21,;5.93,1.12,;-2.23,-2.65,;-2.23,-4.19,;-3.57,-4.96,;-4.9,-4.19,;-6.37,-4.67,;-7.27,-3.42,;-6.37,-2.17,;-4.9,-2.65,;-3.57,-1.88,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(CCN4CCOCC4)c3c2n1
COCCn1c2c(cnc3ccc(nc23)-c2ccc(OC)nc2)n(C)c1=O
COc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
COc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
COc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1cccc(c1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
COc1cccc(c1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
COc1cccc(c1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1ccccc1-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
COc1ccc(cn1)-c1c(C)nc2sc(nn12)-c1ccc(OC)c(OC)c1
COc1cc(ccc1OC1CCNCC1)-c1nn2c(cnc2s1)-c1cnc(N)nc1
COc1ccc(cc1OC)-c1nn2c(cnc2s1)-c1ccc(nc1)C#N
COc1ccc(cc1OC)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C#N
COc1ccc(cc1OC)-c1nn2c(cnc2s1)-c1cnc(N2CCN(C)CC2)c(c1)C(F)(F)F
COc1ccc(cc1)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C(F)(F)F
CS(=O)(=O)Nc1cccc(c1)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C(F)(F)F
CCn1cc(cn1)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C(F)(F)F
Nc1ncc(cc1C(F)(F)F)-c1cnc2sc(nn12)-c1ccc2[nH]ccc2c1
CS(=O)(=O)c1cccc(c1)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C(F)(F)F
Cc1ccc(cn1)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C(F)(F)F
Nc1ncc(cc1C(F)(F)F)-c1cnc2sc(nn12)-c1cccc(c1)S(=O)(=O)N1CCOCC1
COc1cncc(c1)-c1nn2c(cnc2s1)-c1cnc(N)c(c1)C(F)(F)F
COC(=O)c1ccc(cc1OC)-c1cnc2sc(nn12)-c1cnc(N)c(c1)C(F)(F)F
Oc1ccccc1-n1cc(nn1)-c1cccc2c1[nH]c(cc2=O)N1CCOCC1
O=c1cc([nH]c2c(cccc12)-c1cn(nn1)-c1ccccc1)N1CCOCC1
O=c1cc([nH]c2c(cccc12)-c1cn(Cc2ccccc2)nn1)N1CCOCC1
O=c1cc([nH]c2c(cccc12)-c1cn(nn1)-c1ccc(CC#N)cc1)N1CCOCC1
OC(=O)c1cccc(Cn2cc(nn2)-c2cccc3c2[nH]c(cc3=O)N2CCOCC2)c1
OC(=O)c1ccc(cc1)-n1cc(nn1)-c1cccc2c1[nH]c(cc2=O)N1CCOCC1
OC(=O)CCCn1cc(nn1)-c1cccc2c1[nH]c(cc2=O)N1CCOCC1
OC(=O)c1cccc(c1)-n1cc(nn1)-c1cccc2c1[nH]c(cc2=O)N1CCOCC1
OC(=O)CCCCn1cc(nn1)-c1cccc2c1[nH]c(cc2=O)N1CCOCC1
O=C(NCc1ccccc1)c1cccc(Cn2cc(nn2)-c2cccc3c2[nH]c(cc3=O)N2CCOCC2)c1
Oc1ccc(cc1)-c1cnc2ccc(NC(=O)NCC=C)nc2n1
Oc1ccc(cc1)-c1cnc2ccc(NC(=S)NCC=C)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(O)cc1
CNC(=S)Nc1ccc2ncc(nc2n1)-c1ccc(N)cc1
CCN(C(C)=O)C(=O)Nc1ccc2ncc(nc2n1)-c1ccccc1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(N)cc1
OCCCCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccccc1
OCCCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccccc1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(OCCCN2CCOCC2)cc1
CCNC(=S)Nc1ccc2ncc(nc2n1)-c1ccc(O)cc1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1cccc(c1)C(O)=O
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(OC)c(OC)c1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(N)c(OC)c1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1cccc(c1)C(N)=O
CCNC(=O)Nc1ccc2ncc(Nc3ccc(OC)cc3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(Cl)cc3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cccnc3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(CC)cc3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(OC)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(O)cc3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)cn3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccn(C)n3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(F)cc3)nc2n1
COc1cc(ccc1O)-c1cnc2ccc(NC(=O)NCCCCO)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(O)cc1Cl
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(Cl)cc1OC
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1c(C)n[nH]c1C
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1cnn(C)c1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(s1)C#N
CCNC(=O)Nc1ccc2ncc(Nc3ccc(OC)c(Cl)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cnc4ccccc4c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cc(OC)cc(OC)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cnccn3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cccc(OC(C)C)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1ccc(OS(=O)(=O)c2ccc(C)cc2)c(OC)c1
CCNC(=O)Nc1ccc2ncc(Nc3ccnc(Cl)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cc(Cl)c(O)c(Cl)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(nc2n1)-c1cc(Cl)c(O)c(Cl)c1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(OC)c(OC)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(C)c(O)c3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3cc(cc(c3)C(F)(F)F)C(O)=O)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(OC)nc3)nc2n1
CCNC(=O)Nc1ccc2ncc(Nc3ccc(cc3)C#N)nc2n1
CC1(CC1)c1cc(ccn1)-c1cnc(NC(=O)N2CCC[C@@]2(C)C(N)=O)s1 |r|
COc1ccc(cc1)C(C)(C)c1cc(ccn1)-c1cnc(NC(=O)N2CCC[C@@]2(C)C(N)=O)s1 |r|
CN(C)C[C@]1(CCCN1C(=O)Nc1nc(C)c(s1)-c1ccnc(n1)C(C)(C)C)C(N)=O |r|
CCN(CC)c1nccc(n1)-c1sc(NC(=O)N2CC[C@@H]3C[C@]23C(N)=O)nc1C |r|
CCN(CC)c1cc(ccn1)-c1cnc(NC(=O)N2CCC[C@@]2(C)C(N)=O)s1 |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(c1)C1(CC1)C(F)(F)F |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(n1)-n1ccnc1C |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(c1)C1(CCC1)C(F)(F)F |r|
CC(C)(c1cc(ccn1)-c1cnc(NC(=O)N2CCC[C@@]2(C)C(N)=O)s1)C(F)(F)F |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(c1)C1(CC1)C#N |r|
Cc1nc(NC(=O)N2C[C@H](O)C[C@@]2(C)C(N)=O)sc1-c1ccnc(n1)C(C)(C)C |r|
CN(C)CCN(C)c1nccc(n1)-c1sc(NC(=O)N2CCC[C@@]2(C)C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(CC2CC2)n1 |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C(F)F)C(N)=O)sc1-c1ccnc(n1)C(C)(C)C |r|
CSc1nccc(n1)-c1sc(NC(=O)N2CCC[C@@]2(C)C(N)=O)nc1C |r|
COc1ccc(cc1)C1(CC1)c1cc(ccn1)-c1sc(NC(=O)N2CCC[C@@]2(C)C(N)=O)nc1C |r|
CCN(Cc1ccccc1)c1nccc(n1)-c1sc(NC(=O)N2CCC[C@@]2(C)C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1ccnc(n1)C(C)(C)C |r|
COC[C@]1(CCCN1C(=O)Nc1nc(C)c(s1)-c1ccnc(n1)C(C)(C)C)C(N)=O |r|
CC1(CC1)c1cc(ccn1)-c1sc(NC(=O)N2CCC[C@@]2(C)C(N)=O)nc1Cl |r|
CCN(CCOC)c1nccc(n1)-c1sc(NC(=O)N2CCC[C@@]2(C)C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2C[C@@H](F)C[C@H]2C(N)=O)sc1-c1ccnc(n1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CC(F)(F)C[C@H]2C(N)=O)sc1-c1ccnc(c1)C1(C)CC1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc(O)c1 |r|
Oc1cccc(c1)-c1cc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccnc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccc(F)c(CO)c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccnc2[nH]ccc12)N1CCC(F)(F)CC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccc2[nH]c(=O)[nH]c2c1 |r|
COc1ccc(cc1CO)-c1nc2c(nc(nc2[nH]1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C1CC2CN(CC1O2)c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCOCC1
COc1ccc(cc1C(O)=O)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cc(CO)ccc1Cl)N1CCOCC1 |r|
NCc1cc(ccn1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
CC(O)c1cc(ccn1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cnc2cc[nH]c2c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccc2cc[nH]c2c1 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCC(O)CC1 |r|
COc1cc(CO)cc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc(CO)ccc1F |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccc2cc[nH]c2c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccc2cc[nH]c2c1)N1CCOCC1 |r|
COC1CCN(CC1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc2[nH]ccc12
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc2[nH]ccc12
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc2[nH]ncc12
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1ccc2cc[nH]c2c1
Nc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
CC(=O)Nc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
Cc1cc2c(cccc2[nH]1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc(N)c1 |r|
CS(=O)(=O)Nc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1ccccc1CO |r|
OCc1ccccc1-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
Oc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
OCc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
Oc1ccccc1-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)[C@@H](O)CO
CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)[C@H](O)CO
CC1(C)CCCC2(C)C1CCc1oc3c(B(O)O)c(O)c(O)cc3c21
CC[C@H](Nc1ncnc2[nH]ccc12)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(F)c2c(=O)n1-c1cccc(CC(F)(F)F)c1 |r|
CC[C@H](Nc1ncnc2[nH]ccc12)c1nc2cccc(F)c2c(=O)n1-c1cccc(CC(F)(F)F)c1 |r|
CC[C@H](Nc1ncnc2[nH]ccc12)c1nc2cccc(F)c2c(=O)n1-c1cccc(OCC(F)(F)F)c1 |r|
C[C@H](Nc1ncnc2[nH]ccc12)c1nc2cccc(F)c2c(=O)n1-c1ccc(OCC(F)(F)F)cc1 |r|
C[C@H](Nc1ncnc2[nH]cc(F)c12)c1nc2cccc(F)c2c(=O)n1-c1cccc(OCC(F)(F)F)c1 |r|
C[C@H](Nc1ncnc2[nH]ccc12)c1nc2cccc(F)c2c(=O)n1-c1cccc(OCC(F)(F)C(F)(F)F)c1 |r|
C[C@H](Nc1ncnc2[nH]ccc12)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(OCC(F)(F)F)c1 |r|
COCCOCCOCC#Cc1cccc2nc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc34)n(Cc3ccccc3C(F)(F)F)c(=O)c12
COCCN(CCOC)C(=O)CCCC#Cc1cccc2nc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc34)n(Cc3ccccc3Cl)c(=O)c12
COCCOCCOCC#Cc1cccc2nc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc34)n(Cc3ccccc3F)c(=O)c12
Nc1ncnc2n(Cc3nc4cccc(C#CCOCCOCCO)c4c(=O)n3Cc3ccccc3C(F)(F)F)nc(-c3cc(O)cc(F)c3)c12
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)ccc(F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)cccc2c(=O)n1-c1cc(F)cc(F)c1 |r|
COC(=O)c1ccc(nc1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)ccc(F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(Cl)cccc2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)ccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
COc1ccc(nc1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2c(Cl)ccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(Cl)ccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COc1ccc(nc1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2c(F)cccc2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)cccc2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccnn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(N)n1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnc(N)cc1C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnc(N)cc1C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
CC(O)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
CC(O)C#Cc1c(N)ncnc1N[C@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
CC(O)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
CC(O)C#Cc1c(N)ncnc1N[C@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#CC1CC1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#CC1CC1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#Cc1ccccc1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(OC(F)(F)F)cc1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(OC(F)(F)F)cc1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#CC(C)(C)O)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#CC(C)(C)O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccn1)c1nc2cccc(C)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(N)n1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnc(N)nc1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnc(N)nc1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(N)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(N)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
Nc1ncnc(N2CCCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#Cc1ccccn1
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#Cc1ccccn1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)C(N)=O |r|
CCNS(=O)(=O)c1cccc(c1)-n1c(nc2cccc(Cl)c2c1=O)[C@H](C)Nc1ncnc(N)c1C#Cc1ccccn1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)S(N)(=O)=O |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cncnc1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cncnc1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccnc1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccnc1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc2nc(N)sc2c1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COc1cc(F)cc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@@H](C1=Nc2cccc(c2C(=O)N1c3ccccc3)Cl)Nc4c(c(ncn4)N)C#Cc5c[nH]nc5
C[C@H](Nc1ncnc(N)c1C#Cc1ccccn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccc1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(O)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(C)ccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(C)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C#N)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(C)cccc2c(=O)n1-c1ccccc1 |r|
CCCCc1cccc(c1)-n1c(nc2cccc(Cl)c2c1=O)[C@H](C)Nc1ncnc(N)c1C#Cc1ccc(F)cn1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)S(C)(=O)=O |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)C(C)(C)C |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)-c1ccccc1 |r|
CCc1cccc(c1)-n1c(nc2cccc(Cl)c2c1=O)[C@H](C)Nc1ncnc(N)c1C#Cc1ccc(F)cn1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)ccc(C)c2c(=O)n1-c1ccccc1 |r|
COc1cc(F)cc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2c(F)ccc(F)c2c(=O)n1-c1ccccc1 |r|
COc1cc(F)cc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2c(F)cccc2c(=O)n1-c1ccccc1 |r|
COc1cc(F)cc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(C)ccc(F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)ccc(C)c2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2c(F)ccc(C)c2c(=O)n1-c1cccc(c1)C#N |r|
CC[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2c(F)ccc(C)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(C(F)F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccc1F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COc1cccnc1C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COc1cccc(c1C)-n1c(nc2cccc(Cl)c2c1=O)[C@H](C)Nc1ncnc(N)c1C#Cc1ncccc1F |r,wD:21.24,(1.33,8.09,;2.67,7.31,;2.67,5.77,;4,5,;4,3.46,;2.67,2.69,;1.33,3.46,;1.33,5,;,5.78,;,2.69,;,1.15,;-1.33,.38,;-2.67,1.15,;-4,.38,;-5.33,1.15,;-5.33,2.69,;-4,3.46,;-4,5,;-2.67,2.69,;-1.33,3.46,;-1.33,5,;1.33,.38,;2.67,1.15,;1.33,-1.16,;2.67,-1.93,;4,-1.16,;5.33,-1.93,;5.33,-3.46,;4,-4.23,;4,-5.77,;2.67,-3.46,;1.33,-4.24,;,-5.01,;-1.33,-5.78,;-1.33,-7.31,;-2.67,-8.09,;-4,-7.31,;-4,-5.78,;-2.67,-5,;-2.67,-3.46,)|
C[C@H](Nc1ncnc(N)c1C#Cc1ncc(F)cc1F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2c(F)ccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(Cl)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2ccc(F)cc2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2ccc(F)cc2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2ccc(F)cc2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2ccc(F)cc2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2ccc(F)cc2c(=O)n1-c1cccc(Cl)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2ccc(F)cc2c(=O)n1-c1cccc(Cl)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(F)c2c(=O)n1-c1cccc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2c(F)cccc2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(F)c2c(=O)n1-c1cccc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccn1)c1nc2cccc(C)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccn1)c1nc2cccc(C)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C)c2c(=O)n1-c1cccc(F)c1 |r|
CC[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
CC[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccn1)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccc1)c1nc2cccc(F)c2c(=O)n1-c1cccc(c1)C#N |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccc1)c1nc2cccc(F)c2c(=O)n1-c1cccc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccc1)c1nc2cccc(c2c(=O)n1-c1ccccc1)S(C)(=O)=O |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(c2c(=O)n1-c1ccccc1)S(C)(=O)=O |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccc1)c1nc2cccc(C#N)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(F)c2c(=O)n1-c1cccnc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccccc1)c1nc2cccc(F)c2c(=O)n1-c1cccnc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccnc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccnc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C)c2c(=O)n1-c1cccnc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(C)c2c(=O)n1-c1cncc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1N1CCOCC1 |r|
COc1cc(F)cc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1N1CCOCC1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(CNS(C)(=O)=O)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1C1C[C@@H]2CC[C@H](C1)N2C |r,THB:38:37:30.31.36:34.33|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1C1C[C@@H]2CC[C@H](C1)N2C |r,THB:38:37:30.36.31:33.34|
C[C@H](Nc1ncnc(N)c1C#Cc1cnccn1)c1nc2cccc(Cl)c2c(=O)n1N1CCCCCC1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1N1CCNCC1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(C)c2c(=O)n1-c1cccc(CN(C)S(C)(=O)=O)c1 |r|
C[C@H](N(C)c1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(CN(C)S(C)(=O)=O)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(CNS(C)(=O)=O)c1 |r|
CC(C)CS(=O)(=O)NCc1cccc(c1)-n1c(nc2cccc(Cl)c2c1=O)[C@H](C)Nc1ncnc(N)c1C#Cc1ccc(F)cn1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(cn1)C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(C)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(cn1)C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(cn1)C(N)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(cn1)C(N)=O)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
CC(C)OC(=O)c1ccc(nc1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(cn1)C(O)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
Nc1ncnc(N[C@H](CO)c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#Cc1ccc(F)cn1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(F)c(C)n1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(C)n1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccc1C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccc1C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#CC1CCCC1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#CC1CCCCC1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COC[C@@H](Nc1ncnc(N)c1C#Cc1ccc(F)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cc(C)ccn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cc(ccn1)C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cc(ccn1)C(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
CCc1ccnc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(n1)C(F)(F)F)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccc1C(C)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(n1)C(C)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cc(CO)ccn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(CO)n1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cc(ccn1)C(N)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
CC(O)c1cccc(n1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COC(=O)c1ccnc(c1)C#Cc1c(N)ncnc1N[C@@H](C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(CN)n1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cc(ccn1)C(O)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(c1)C(C)=O)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1cccc(CO)c1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ncccc1CO)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#Cc1ccc(C)cn1)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2c1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(NC(C)=O)nc1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1cnc(N)nc1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(N)nc1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(nc1)[N+]#[C-]
CSc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(nc1)-n1cccn1
CN1CCN(CC1)c1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1ccc(cc1)C(C)(C)C#N)-c1cnc2ccccc2c1
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(C4CCN(CC4)C(=O)[C@@H](C)O)c3c2n1 |r|
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(C4CCNCC4)c3c2n1
C[C@H](Nc1ncnc2[nH]cnc12)c1nc2ccc(F)cc2c(=O)n1-c1ccccc1 |r|
CC(=O)c1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Nc1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Cn1c(=O)n(-c2cccc(c2)C(F)(F)F)c2c3nc(ccc3ncc2c1=O)-c1ccc(N)nc1
COc1ncc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Nc1ncc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
FC(F)(F)c1cccc(c1)-n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ccc3c2)c(=O)[nH]c1=O
COc1ccc(CN2CCC(CC2)c2ccc3[nH]c(nc3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1cnc(CN2CCC(CC2)c2ccc3[nH]c(nc3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1cnc(CN2CCC(CC2)c2ccc3nc([nH]c3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1ccc(CN2CCC(CC2)c2ccc3nc(C(=O)N4CCN(Cc5ccc(cc5)C(F)(F)F)CC4)n(C)c3c2)cn1
COc1ccc(CN2CCC(CC2)c2ccc3nc([nH]c3c2)C(=O)N2CCN(Cc3ccc(cc3)C#N)CC2)cn1
COc1ccc(CN2CCC(CC2)c2ccc3nc(cn3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1ccc(CN2CCC(CC2)c2ccn3cc(nc3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1ccc(CN2CCC(CC2)c2ccc3nc([nH]c3c2)C(=O)N2CCN(Cc3ccc4OC(F)(F)Oc4c3)CC2)cn1
COc1ccc(CN2CCC(CC2)c2ccc3nc([nH]c3c2)C(=O)N2CCN(Cc3ccc(cc3F)C(F)(F)F)CC2)cn1
COc1ccc(CN2CCC(CC2)c2cc3cc(C(=O)N4CCN(Cc5ccc(cc5)C(F)(F)F)CC4)n(C)c3cn2)cn1
COc1ccc(CN2CCC(CC2)c2ccn3nc(cc3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1ccc(CN2CCC(CC2)n2cc3cc(ccc3n2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
CCOc1cnc(CN2CCC(CC2)c2ccc3n(C)c(cc3c2)C(=O)N2CCN(Cc3ccc(cc3)C#N)CC2)cn1
CCOc1cnc(CN2CCC(CC2)c2ccc3cc(C(=O)N4CCN(Cc5ccc(cc5)C#N)CC4)n(C)c3c2)cn1
COc1cnc(CN2CCC(CC2)c2ccc3n(C)c(cc3c2)C(=O)N2CCN(Cc3ccc(cc3)C#N)CC2)cn1
COc1ccc(CN2CCC(CC2)c2ccc3nc([nH]c3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cc1
COc1ccc(CN2CCC(CC2)c2ccc3n(C)c(nc3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
COc1cnc(CN2CCC(CC2)c2ccn3nc(cc3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
CCOc1cnc(CN2CCC(CC2)n2cc3cc(ccc3n2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.99,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;8.5,-1.56,;9.99,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(c(=O)n(C)c3cnc2cc1F)C1(C)CCOCC1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4COC4)c3c2c1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4C[C@H](O)C4)c3c2c1 |r,wD:25.25,27.28,(-9.98,.47,;-8.65,1.24,;-8.65,2.78,;-7.32,.47,;-5.98,1.24,;-4.65,.47,;-3.32,1.24,;-1.98,.47,;-.65,1.24,;.68,.47,;.68,-1.07,;-.65,-1.84,;-1.98,-1.07,;2.02,-1.84,;2.02,-3.38,;3.35,-4.15,;4.69,-3.38,;6.02,-4.15,;7.35,-3.38,;7.35,-1.84,;8.5,-.81,;9.98,-1.21,;7.87,.6,;8.64,1.93,;6.34,.43,;5.25,1.52,;3.71,1.52,;3.71,3.06,;2.62,4.15,;5.25,3.06,;6.02,-1.07,;4.69,-1.84,;3.35,-1.07,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;.68,-4.9,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(c3c2c1)C1(C)CCOCC1
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(C4CCOCC4)c(=O)n(C)c3cnc2cc1F
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(C4COC4)c(=O)n(C)c3cnc2cc1F
CN(C)CCCOc1ccc(cn1)-c1cc2c3n([C@@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CN(C)CCCOc1ccc(cn1)-c1cc2c3n([C@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)[nH]c1=O |r,wD:4.6,2.1,(3.69,4.9,;3.29,3.41,;4.38,2.32,;4.38,.78,;5.92,.78,;5.92,2.32,;7.01,-.31,;6.69,-1.82,;8.02,-2.59,;8.02,-4.13,;6.69,-4.9,;5.36,-4.13,;4.02,-4.9,;2.69,-4.13,;2.69,-2.59,;4.02,-1.82,;5.36,-2.59,;1.36,-1.82,;1.36,-.28,;.02,.49,;-1.31,-.28,;-2.64,.49,;-3.98,-.28,;-5.31,.49,;-6.65,-.28,;-7.98,.49,;-9.31,-.28,;-7.98,2.03,;-1.31,-1.82,;.02,-2.59,;9.17,-1.56,;8.54,-.15,;9.31,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(C4CCOCC4)c3c2c1
Cn1c2cnc3ccc(cc3c2n([C@@H]2C[C@H](O)C2)c1=O)-c1ccc(OCCCN2CCC2)nc1 |r,wD:13.14,15.17,(10.26,-1.21,;8.77,-.81,;7.63,-1.84,;7.63,-3.38,;6.3,-4.15,;4.96,-3.38,;3.63,-4.15,;2.29,-3.38,;2.29,-1.84,;3.63,-1.07,;4.96,-1.84,;6.3,-1.07,;6.62,.43,;5.53,1.52,;3.99,1.52,;3.99,3.06,;2.9,4.15,;5.53,3.06,;8.15,.6,;8.92,1.93,;.96,-1.07,;.96,.47,;-.37,1.24,;-1.71,.47,;-3.04,1.24,;-4.37,.47,;-5.71,1.24,;-7.04,.47,;-8.37,1.24,;-8.77,2.73,;-10.26,2.33,;-9.86,.84,;-1.71,-1.07,;-.37,-1.84,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2C[C@H](O)C2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r,wD:13.14,15.17,(10.5,-1.21,;9.02,-.81,;7.87,-1.84,;7.87,-3.38,;6.54,-4.15,;5.2,-3.38,;3.87,-4.15,;2.54,-3.38,;2.54,-1.84,;3.87,-1.07,;5.2,-1.84,;6.54,-1.07,;6.86,.43,;5.77,1.52,;4.23,1.52,;4.23,3.06,;3.14,4.15,;5.77,3.06,;8.39,.6,;9.16,1.93,;1.2,-1.07,;1.2,.47,;-.13,1.24,;-1.46,.47,;-2.8,1.24,;-4.13,.47,;-5.47,1.24,;-6.8,.47,;-8.13,1.24,;-8.13,2.78,;-9.6,3.25,;-10.5,2.01,;-9.6,.76,;-1.46,-1.07,;-.13,-1.84,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;-.65,-4.13,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;.68,-4.9,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;-.65,-4.13,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(4.18,4.94,;3.41,3.61,;4.18,2.27,;4.18,.73,;5.72,.73,;5.72,2.27,;6.81,-.35,;6.49,-1.86,;7.82,-2.63,;7.82,-4.17,;6.49,-4.94,;5.15,-4.17,;3.82,-4.94,;2.49,-4.17,;1.15,-4.94,;2.49,-2.63,;3.82,-1.86,;5.15,-2.63,;1.15,-1.86,;1.15,-.32,;-.18,.45,;-1.51,-.32,;-2.85,.45,;-4.18,-.32,;-5.52,.45,;-6.85,-.32,;-8.18,.45,;-8.18,1.99,;-9.65,2.46,;-10.55,1.22,;-9.65,-.03,;-1.51,-1.86,;-.18,-2.63,;8.97,-1.6,;10.55,-2.03,;8.34,-.19,;9.11,1.14,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.62,4.9,;3.22,3.41,;4.31,2.32,;4.31,.78,;5.85,.78,;5.85,2.32,;6.93,-.31,;6.61,-1.82,;7.95,-2.59,;7.95,-4.13,;6.61,-4.9,;5.28,-4.13,;3.95,-4.9,;2.61,-4.13,;2.61,-2.59,;3.95,-1.82,;5.28,-2.59,;1.28,-1.82,;1.28,-.28,;-.05,.49,;-1.39,-.28,;-2.72,.49,;-4.06,-.28,;-5.39,.49,;-6.72,-.28,;-8.06,.49,;-8.06,2.03,;-9.52,2.51,;-10.43,1.26,;-9.52,.02,;-1.39,-1.82,;-.05,-2.59,;9.09,-1.56,;10.43,-2.33,;8.47,-.15,;9.24,1.19,)|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.76,4.9,;3.37,3.41,;4.45,2.32,;4.45,.78,;5.99,.78,;5.99,2.32,;7.08,-.31,;6.76,-1.82,;8.1,-2.59,;8.1,-4.13,;6.76,-4.9,;5.43,-4.13,;4.1,-4.9,;2.76,-4.13,;2.76,-2.59,;4.1,-1.82,;5.43,-2.59,;1.43,-1.82,;1.43,-.28,;.09,.49,;-1.24,-.28,;-2.57,.49,;-3.91,-.28,;-5.24,.49,;-6.57,-.28,;-7.91,.49,;-7.91,2.03,;-9.24,2.8,;-10.57,2.03,;-10.57,.49,;-9.24,-.28,;-1.24,-1.82,;.09,-2.59,;9.24,-1.56,;10.57,-2.33,;8.61,-.15,;9.38,1.19,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCC2)nc1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)[nH]c1=O |r,wD:4.6,2.1,(4.21,4.9,;3.81,3.41,;4.9,2.32,;4.9,.78,;6.44,.78,;6.44,2.32,;7.53,-.31,;7.21,-1.82,;8.54,-2.59,;8.54,-4.13,;7.21,-4.9,;5.88,-4.13,;4.54,-4.9,;3.21,-4.13,;3.21,-2.59,;4.54,-1.82,;5.88,-2.59,;1.87,-1.82,;1.87,-.28,;.54,.49,;-.79,-.28,;-2.13,.49,;-3.46,-.28,;-4.79,.49,;-6.13,-.28,;-7.46,.49,;-7.46,2.03,;-8.93,2.51,;-9.83,1.26,;-8.93,.02,;-.79,-1.82,;.54,-2.59,;9.69,-1.56,;9.06,-.15,;9.83,1.19,)|
O=c1[nH]c2cnc3ccc(cc3c2n1C1CCOCC1)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.37,4.9,;2.97,3.41,;4.06,2.32,;4.06,.78,;5.6,.78,;5.6,2.32,;6.69,-.31,;6.37,-1.82,;7.71,-2.59,;7.71,-4.13,;6.37,-4.9,;5.04,-4.13,;3.7,-4.9,;2.37,-4.13,;2.37,-2.59,;3.7,-1.82,;5.04,-2.59,;1.04,-1.82,;1.04,-.28,;-.3,.49,;-1.63,-.28,;-2.96,.49,;-4.3,-.28,;-5.63,.49,;-6.96,-.28,;-8.3,.49,;-8.7,1.98,;-10.18,1.58,;-9.79,.1,;-1.63,-1.82,;-.3,-2.59,;8.85,-1.56,;10.18,-2.33,;8.22,-.15,;8.99,1.19,)|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCC2)nc1
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4C[C@@H](C4)OC)c3c2c1 |r,wD:24.24,26.29,(-9.91,.47,;-8.57,1.24,;-7.24,.47,;-5.91,1.24,;-4.57,.47,;-3.24,1.24,;-1.91,.47,;-.57,1.24,;.76,.47,;.76,-1.07,;-.57,-1.84,;-1.91,-1.07,;2.1,-1.84,;2.1,-3.38,;3.43,-4.15,;4.76,-3.38,;6.1,-4.15,;7.43,-3.38,;7.43,-1.84,;8.57,-.81,;9.91,-1.58,;7.95,.6,;8.72,1.93,;6.42,.43,;5.33,1.52,;3.79,1.52,;3.79,3.06,;5.33,3.06,;2.7,4.15,;1.21,3.75,;6.1,-1.07,;4.76,-1.84,;3.43,-1.07,)|
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCC4)c3c2c1
Cn1c2cnc3cc(F)c(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1cc2c3n([C@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4CCC4)c3c2c1
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4COC4)c3c2c1
Cn1c2cnc3cc(F)c(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n(C2COC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1F |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(NCCCN3CCCCC3)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(NCCCN3CCCCC3)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r|
CO[C@H]1CC[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2c1
COC(=O)N1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(OC)nc2)n(C)c1=O
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2c1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cnn(CCCO)c1
Cn1c2cnc3ccc(cc3c2n(C2CNC2)c1=O)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(C2CC2)c1=O)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(C2CC2)c1=O)-c1cnc(N)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cnc(N)nc1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1ccc2ncc3n(C)c(=O)n(C4CC4)c3c2c1
CS(=O)(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cccc3[nH]ncc23)CC1
Cc1nc(N)ncc1-c1nc(nc2c(CN3CCN(CC3)S(C)(=O)=O)csc12)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2ccc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cccc(O)c2)CC1
CS(=O)(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cncnc2)CC1
CC(C)(O)C1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1
C[C@H](O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1 |r|
C[C@@H](O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1 |r|
CC(C)(O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1
C[C@@H](O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2C)CC1 |r|
C[C@H](O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2C)CC1 |r|
C[C@@H](O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cccc3[nH]ncc23)CC1 |r|
C[C@H](O)C(=O)N1CCN(Cc2c(C)sc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1 |r|
C[C@@H](O)C(=O)N1CCN(Cc2c(C)sc3c(nc(nc23)N2CCOCC2)-c2cnc(N)nc2)CC1 |r|
OCC(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cccc3[nH]ncc23)CC1
C[C@H](O)C(=O)N1CCN(Cc2csc3c(nc(nc23)N2CCOCC2)-c2cccc3[nH]ncc23)CC1 |r|
Nc1ncc(cn1)-c1nc(nc2c(CN3CCN(CC3)C(=O)CO)csc12)N1CCOCC1
Cc1sc2c(nc(nc2c1CN1CCN(CC1)C(=O)CO)N1CCOCC1)-c1cnc(N)nc1
Cc1sc2c(nc(nc2c1CN1CCN(CC1)S(C)(=O)=O)N1CCOCC1)-c1cccc2[nH]ncc12
Nc1ncc(cn1)-c1nc(nc2ccoc12)N1CCOCC1
CN(CO)Cc1csc2c(nc(nc12)N1CCOCC1)-c1cnc(N)nc1
Cc1sc2c(nc(nc2c1CN1CCN(CCO)CC1)N1CCOCC1)-c1cnc(N)nc1
Cc1nnc2[C@@H](N=C(c3c(C)c(C)sc3-n12)c1ccc(Cl)cc1)C(=O)OC(C)(C)C |c:6|
O=c1cc(oc2c(csc12)-c1ccc2OCCOc2c1)N1CCOCC1
COC(=O)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
ONC(=O)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=C(Nc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1)c1ccncc1
CCOC(=O)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
Fc1ccc(C(=O)Nc2ccc(cc2)-c2csc3c2oc(cc3=O)N2CCOCC2)c(Nc2ccc(I)cc2F)c1F
OC(=O)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
CC(C)(C)c1cc(NC(=O)Nc2cccc(c2)-c2csc3c2oc(cc3=O)N2CCOCC2)no1
FC(F)(F)c1cc(NC(=O)Nc2cccc(c2)-c2csc3c2oc(cc3=O)N2CCOCC2)ccc1Cl
O=c1cc(oc2c(csc12)-c1ccc2OCCOc2c1)N1CCSCC1
CCOC(=O)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCSCC1
Brc1csc2c1oc(cc2=O)N1CCOCC1
Brc1csc2c1oc(cc2=O)N1CCSCC1
O=c1cc(oc2ccsc12)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccccc1)N1CCOCC1
Nc1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CN(C)S(=O)(=O)c1cncc(c1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
O=C(C1CCOCC1)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(=O)(=O)N3CCOCC3)c2c1 |r|
Cc1ncc(cc1[N+]([O-])=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
FC(F)(F)c1cncc(c1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
O=C(C1CCOCC1)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)C#N)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(nc3)S(C)(=O)=O)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C#N)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C(F)(F)F)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(F)c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(Cl)c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(C)c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(N)c(OC)c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)S(=O)(=O)N(C)C)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)S(C)(=O)=O)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(N)c(c3)C(F)(F)F)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(c3)S(=O)(=O)N3CCN(C)CC3)c2c1 |r|
Cc1cc(ccn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COCc1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
FC(F)(F)c1cc(ccn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1cc(ccn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Nc1ncc(cc1C(F)(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(C)c(c3)S(=O)(=O)N3CCCCC3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)S(=O)(=O)N3CCOCC3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(=O)(=O)N3CCOCC3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)S(=O)(=O)N3CCN(C)CC3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(=O)(=O)N3CCN(C)CC3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)S(=O)(=O)N(C)OC)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(=O)(=O)N(C)OC)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)S(=O)(=O)NOC)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)C#N)c2c1 |r|
COc1cncc(c1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Clc1cncc(c1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(OC)c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc4ccccc4c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(C)(=O)=O)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)C(F)(F)F)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(=O)(=O)N(C)C)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(C)c(c3)C#N)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)c(c3)C(F)(F)F)c2c1 |r|
FC(F)(F)c1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CS(=O)(=O)c1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCOc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccnc(c3)C#N)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(OC)c3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cncc(c3)S(=O)(=O)C(C)C)c2c1 |r|
CC(C)S(=O)(=O)c1cncc(c1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCS(=O)c1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCC(F)(F)CC3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r|
COc1ncc(cc1C(F)(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r,w:23.26|
CCOc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnn(C)c3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccn(C)n3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccncc3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cncnc3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cocn3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnco3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC(C)(C)C3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r,w:23.26|
CC(C)S(=O)(=O)c1cncc(c1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r|
COCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
CC(C)C(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccccc3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r|
COCCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCCOC3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCCOC3)cc12 |r|
COCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(OC)c3)c2c1 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)COS(C)(=O)=O)cc12 |r|
COCCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(OC)c3)c2c1 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCCCC3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CC[C@H](O)CC3)cc12 |r,wU:27.28,wD:20.20,30.32,(-4.06,3.13,;-5.4,2.36,;-5.4,.82,;-6.73,.05,;-8.07,.82,;-8.07,2.36,;-6.73,3.13,;-6.73,4.67,;-6.73,6.21,;-8.27,4.67,;-5.19,4.67,;-6.73,-1.49,;-8.07,-2.26,;-8.07,-3.8,;-6.73,-4.57,;-5.4,-3.8,;-4.06,-4.57,;-2.73,-3.8,;-2.73,-2.26,;-1.4,-1.49,;-.06,-2.26,;.41,-3.72,;1.95,-3.72,;2.43,-2.26,;1.18,-1.35,;3.92,-1.86,;4.31,-.37,;5,-2.95,;6.49,-2.55,;7.58,-3.64,;7.18,-5.12,;8.27,-6.21,;5.7,-5.52,;4.61,-4.43,;-4.06,-1.49,;-5.4,-2.26,)|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CC[C@H](O)CC3)cc12 |r,wU:27.28,30.32,wD:20.20,(-4.06,3.13,;-5.4,2.36,;-5.4,.82,;-6.73,.05,;-8.07,.82,;-8.07,2.36,;-6.73,3.13,;-6.73,4.67,;-6.73,6.21,;-8.27,4.67,;-5.19,4.67,;-6.73,-1.49,;-8.07,-2.26,;-8.07,-3.8,;-6.73,-4.57,;-5.4,-3.8,;-4.06,-4.57,;-2.73,-3.8,;-2.73,-2.26,;-1.4,-1.49,;-.06,-2.26,;.41,-3.72,;1.95,-3.72,;2.43,-2.26,;1.18,-1.35,;3.92,-1.86,;4.31,-.37,;5,-2.95,;4.61,-4.43,;5.7,-5.52,;7.18,-5.12,;8.27,-6.21,;7.58,-3.64,;6.49,-2.55,;-4.06,-1.49,;-5.4,-2.26,)|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r,w:25.28|
COc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(Cl)c(OC)c3)c2c1 |r|
COc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCO)cc12 |r|
Cc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(Cl)c(C)c3)c2c1 |r|
Cc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
Cc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCO)cc12 |r|
COc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)[nH]c3)cc12 |r|
Cc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
Cc1cc(cnc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)[nH]c3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CC[C@H](O)CC3)cc12 |r,wU:26.27,wD:19.19,29.31,(-1.8,1.93,;-3.13,2.69,;-4.47,1.93,;-4.47,.38,;-5.8,-.38,;-7.13,.38,;-7.13,1.93,;-5.8,2.69,;-5.8,4.23,;-7.13,5,;-5.8,-1.93,;-7.13,-2.69,;-7.13,-4.23,;-5.8,-5,;-4.47,-4.23,;-3.13,-5,;-1.8,-4.23,;-1.8,-2.69,;-.46,-1.93,;.87,-2.69,;1.34,-4.16,;2.88,-4.16,;3.36,-2.69,;2.11,-1.79,;4.85,-2.3,;5.94,-3.39,;5.25,-.81,;4.16,.28,;4.56,1.77,;6.04,2.17,;6.44,3.65,;7.13,1.08,;6.73,-.41,;-3.13,-1.93,;-4.47,-2.69,)|
Cc1cnccc1C(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)Cc3ccncc3)cc12 |r|
CS(=O)(=O)c1ncc(cc1C(F)(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CS(=O)(=O)c1ncc(cc1C(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CS(=O)(=O)c1ncc(cc1CF)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1OC(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1OC(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
Cn1cnc(c1)C(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(c3)C(F)F)S(C)(=O)=O)c2c1 |r|
CS(=O)(=O)c1ncc(cc1C(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CCOC3)cc12 |r|
CS(=O)(=O)c1ncc(cc1C(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CCOC3)cc12 |r|
CNc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CN(C)c1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CS(=O)(=O)c1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CC3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)S(=O)(=O)C3CCOCC3)cc12 |r|
CC(C)S(=O)(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)S(=O)(=O)C3CC3)cc12 |r|
CCS(=O)(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
CS(=O)(=O)c1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCS(=O)(=O)c1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cncn3C)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCN(CC3)C(C)=O)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cc[nH]c(=O)c3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)[nH]c3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)n(C)c3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(nc3)S(=O)(=O)CC)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(c(C)c3)S(C)(=O)=O)c2c1 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r|
COCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(F)c3)c2c1 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cocn3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnco3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cncnc3)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCS(C)(=O)=O)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCO)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnco3)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CC#N)cc12 |r|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CS(C)(=O)=O)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CS(C)(=O)=O)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCS(C)(=O)=O)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCO)cc12 |r|
COCCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(F)c3)c2c1 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CC#N)cc12 |r|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CC[C@H](O)CC3)cc12 |r,wU:25.26,wD:18.18,28.30,(-5.5,5.83,;-6.83,5.06,;-6.83,3.52,;-8.17,2.75,;-8.17,1.21,;-6.83,.44,;-5.5,1.21,;-5.5,2.75,;-4.17,3.52,;-6.83,-1.1,;-8.17,-1.87,;-8.17,-3.41,;-6.83,-4.18,;-5.5,-3.41,;-4.17,-4.18,;-2.83,-3.41,;-2.83,-1.87,;-1.5,-1.1,;-.17,-1.87,;.31,-3.34,;1.85,-3.34,;2.33,-1.87,;1.08,-.97,;3.81,-1.47,;4.21,.01,;4.9,-2.56,;6.39,-2.16,;7.48,-3.25,;7.08,-4.74,;8.17,-5.83,;5.59,-5.14,;4.5,-4.05,;-4.17,-1.1,;-5.5,-1.87,)|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CC[C@H](O)CC3)cc12 |r,wU:25.26,28.30,wD:18.18,(-5.5,5.83,;-6.83,5.06,;-6.83,3.52,;-8.17,2.75,;-8.17,1.21,;-6.83,.44,;-5.5,1.21,;-5.5,2.75,;-4.17,3.52,;-6.83,-1.1,;-8.17,-1.87,;-8.17,-3.41,;-6.83,-4.18,;-5.5,-3.41,;-4.17,-4.18,;-2.83,-3.41,;-2.83,-1.87,;-1.5,-1.1,;-.17,-1.87,;.31,-3.34,;1.85,-3.34,;2.33,-1.87,;1.08,-.97,;3.81,-1.47,;4.21,.01,;4.9,-2.56,;4.5,-4.05,;5.59,-5.14,;7.08,-4.74,;8.17,-5.83,;7.48,-3.25,;6.39,-2.16,;-4.17,-1.1,;-5.5,-1.87,)|
COc1ncc(cc1C(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(nc3)S(=O)CC)c2c1 |r|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CCN(C3)C(C)=O)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1CC[C@H](C1)Oc1ccc2OCCN(c3ccc(OC)nc3)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3ccc(OC)nc3)c2c1 |r|
COc1ncc(cc1C#N)N1C(C)COc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r,w:11.12|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnon3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccnn3C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccno3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn[nH]c3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CS(C)(=O)=O)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3nnc(C)o3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cncnc3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cncs3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnccn3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cccnc3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccncc3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)nc3C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CNC(=O)C3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3oc(C)nc3C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3=CC(=O)CC(C)(C)O3)cc12 |r,t:28|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnn4cccnc34)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCC(=O)N3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r,w:24.27|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCCOC3)cc12 |r|
COc1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CN3CCOCC3)cc12 |r|
COc1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CN(C)C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCN(CC3)C(C)=O)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CN(C)C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CN3CCOCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C(C)C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CC(C)(C)C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CC(C)C)cc12 |r|
COC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C#N)c2c1 |r|
COCC(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C#N)c2c1 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCCCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCN(C)CC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C(C)(C)O)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)n(C)c3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cocn3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccn(C)c(=O)c3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ccc(=O)[nH]c3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cc[nH]c(=O)c3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CON(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1C[C@H](CO1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C#N)c2c1 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@@H]3CON(C3)C(=O)C3CCOCC3)cc12 |r|
CCC(=O)N1C[C@@H](CO1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C#N)c2c1 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CON(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnn(C)c3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOC3)cc12 |r|
COc1ccc(cn1)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cncn3C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cnco3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3ocnc3C)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)N3CCOCC3)cc12 |r|
COC1CCC(CC1)C(=O)N1CC[C@@H](C1)Oc1ccc2OCCN(c3cnc(OC)c(c3)C#N)c2c1 |r,wD:13.16,(8.9,-5.23,;8.51,-3.74,;7.02,-3.35,;5.93,-4.43,;4.44,-4.04,;4.04,-2.55,;5.13,-1.46,;6.62,-1.86,;2.56,-2.15,;2.16,-.66,;1.47,-3.24,;.56,-4.48,;-.9,-4.01,;-.9,-2.47,;.56,-1.99,;-2.24,-1.7,;-3.57,-2.47,;-3.57,-4.01,;-4.9,-4.78,;-6.24,-4.01,;-7.57,-4.78,;-8.9,-4.01,;-8.9,-2.47,;-7.57,-1.7,;-7.57,-.16,;-8.9,.61,;-8.9,2.15,;-7.57,2.92,;-7.57,4.46,;-6.24,5.23,;-6.24,2.15,;-6.24,.61,;-4.9,2.92,;-3.57,3.69,;-6.24,-2.47,;-4.9,-1.7,)|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)Cc3cn(C)cn3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCNCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CCNC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CCNC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1C)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1OC(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C(F)(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C(F)(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
Cc1cc(cnc1OC(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
Cc1cc(cnc1OC(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
Cc1cc(cnc1OC(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COCC(=O)N1CC[C@@H](C1)Oc1cc2N(CCOc2cn1)c1cnc(OC)c(c1)C(F)F |r|
COc1ncc(cc1C(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COCC(=O)N1CC[C@@H](C1)Oc1cc2N(CCOc2cn1)c1cnc(c(c1)C(F)F)S(C)(=O)=O |r|
COc1ncc(cc1C)N1CCOc2cnc(OC3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12
COc1ncc(cc1C#N)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C(F)(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3cn4ccsc4n3)cc12 |r|
COc1ncc(cc1C)N1CCOc2cnc(O[C@@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)cc12 |r|
COc1ncc(cc1C(F)(F)F)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)c3ncn(C)c3N)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r,w:25.28|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r,w:25.28|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r,w:24.27|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCCO3)cc12 |r,w:24.27|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r,w:24.27|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r,w:23.26|
COc1ncc(cc1Cl)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)C3)cc12 |r,w:23.26|
COc1ncc(cc1F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3COCCO3)cc12 |r,w:23.26|
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)c(F)c12 |r|
COc1ncc(cc1C(F)F)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)c(F)c12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)c(F)c12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CCN(C3)C(C)=O)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CCN(C3)C(C)=O)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@@H]3CCN(C)C3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)c3ccccn3)cc12 |r|
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)c3ncccn3)cc12 |r|
COc1ncc(cc1C#N)N1CC(C)Oc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r,w:12.13|
COc1ncc(cc1C#N)N1C[C@H](C)Oc2ccc(O[C@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(CC4CCN(C)CC4)C3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(OC3CCN(C3)C(=O)C3CCOCC3)cc12
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CC[C@H](O)CC3)cc12 |r,wU:29.31,wD:19.19,26.27,(-4.4,5,;-5.74,4.23,;-5.74,2.69,;-7.07,1.93,;-7.07,.38,;-5.74,-.38,;-4.4,.38,;-4.4,1.93,;-3.07,2.7,;-1.74,1.93,;-5.74,-1.93,;-7.07,-2.69,;-7.07,-4.23,;-5.74,-5,;-4.4,-4.23,;-3.07,-5,;-1.74,-4.23,;-1.74,-2.69,;-.4,-1.93,;.93,-2.69,;.93,-4.23,;2.39,-4.71,;3.3,-3.47,;2.39,-2.22,;4.79,-3.07,;5.88,-4.16,;5.19,-1.58,;6.67,-1.18,;7.07,.31,;5.98,1.4,;6.38,2.88,;4.5,1,;4.1,-.49,;-3.07,-1.93,;-4.4,-2.69,)|
COc1ncc(cc1C#N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)Cc3ccncc3)cc12 |r|
COc1ncc(cc1N)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1NS(C)(=O)=O)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)c3cn(C)cn3)cc12 |r|
COc1ncc(cc1C)N1CCOc2ccc(OC3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)c(C)c12
Cc1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(OC3CCN(C3)C(=O)C3CCOCC3)c(C)c12
COc1ncc(cc1C(F)F)N1CCOc2ccc(OC3CCN(C3)C(=O)C3CCS(=O)(=O)CC3)c(C)c12
Nc1cc(c(cn1)-c1nc2N3CCOC[C@H]3Cc2c(n1)N1CCOCC1)C(F)(F)F |r|
Nc1ncc(cn1)-c1nc2N3CCOC[C@H]3Cc2c(n1)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc2N3CCOC[C@@H]3Cc2c(n1)N1CCOCC1)C(F)(F)F |r|
Nc1ncc(cn1)-c1nc2N3CCOC[C@@H]3Cc2c(n1)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc2N3CCOC[C@H]3Cc12)N1CCOCC1)C(F)(F)F |r|
Nc1ncc(cn1)-c1nc(nc2N3CCOC[C@H]3Cc12)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc2N3CCOC[C@@H]3Cc12)N1CCOCC1)C(F)(F)F |r|
Nc1ncc(cn1)-c1nc(nc2N3CCOC[C@@H]3Cc12)N1CCOCC1 |r|
Nc1nc2cc(ccc2o1)-c1nc2cc(Br)cc3OCCCn1c23
Cc1nc2nc(ccc2o1)-c1nc2cc(Br)cc3OCCCn1c23
Cc1nc2cc(ccc2o1)-c1nc2cc(cc3OCCCn1c23)N1CCCC1C(N)=O
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccccc1)C(N)=O |r|
C[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cccnc1)C(N)=O |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccncn1)C(N)=O |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(cn1)C#N)C(N)=O |r|
COc1ccc(cn1)-c1nc2cc(N[C@@H](C)C(N)=O)cc3OCCCn1c23 |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccccn1)C(N)=O |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2OC(F)(F)Oc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2OCOc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2CNC(=O)c2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2cncnc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nccnc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cccc(c1)C#N)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2ncncc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(N)ncc2c1)C1CC1 |r|
COc1nc(C)cc(n1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
Cc1ccncc1-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
Cc1cc(nc(CO)n1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
CC(C)(C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccnnc1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCC(CO)CC1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCCCC1)C1CC1 |r|
COc1ncc(cn1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
Cn1nc(ccc1=O)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
COc1ncc(cc1Cl)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2OCC(=O)Nc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccn2ncnc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2[nH]ncc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cncnc1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cncs1)C1CC1 |r|
CS(=O)(=O)c1ccc(cc1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2OCCOc2c1)C1CC1 |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCC[C@@H](CO)C1)C(N)=O |r|
C[C@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCC(CO)CC1)C(N)=O |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCOCC1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ncco1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cccc(OC(F)F)c1)C1CC1 |r|
COc1ccc(-c2nc3cc(N[C@@H](C4CC4)C(N)=O)cc4OCCCn2c34)c(F)c1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(F)cc1F)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cccc(c1)C(N)=O)C1CC1 |r|
Cn1cc(ccc1=O)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cnc2OCCOc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1Cc2cnc(N)nc2C1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(OC(F)F)cc1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccnc(c1)C(N)=O)C1CC1 |r|
Nc1nc2cc(ccc2o1)-c1nc2cc(cc3OCCCn1c23)-c1cnn(CCO)c1
Cn1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1
CNC(=O)C(C)(C)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2[nH]c(=O)oc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccn2ncnc2n1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(F)c(c1)C(N)=O)C1CC1 |r|
COC(=O)c1cc(ccc1OC)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
CS(=O)(=O)c1cc(ccn1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
Cc1nn(C)cc1-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCn2ncnc2C1)C1CC1 |r|
C[C@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
COc1ccc(cc1OC(F)F)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
COc1ccc(cc1C(N)=O)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccncc1)C1CC1 |r|
Cn1cc(cn1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2OCCOc2n1)C1CC1 |r|
OCc1nc2cc(ccc2o1)-c1nc2cc(Br)cc3OCCCn1c23
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccnc2[nH]ncc12)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C1CC1 |r|
COc1cnc2cc(ccc2n1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)C(Nc1cc2OCCCn3c(nc(c1)c23)N1CCCC(C1)C#N)C1CC1
CS(=O)(=O)c1cncc(c1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccnc2[nH]cnc12)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccnc2sccc12)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2ncsc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCc2nccnc2C1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCCOCC1)C1CC1 |r|
CC(C)(C(N)=O)n1cc(cn1)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)N1CCCC(O)C1)C1CC1 |r|
Cn1ncnc1-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2sc(N)nc2c1)C1CC1 |r|
CNc1nc2cc(ccc2o1)-c1nc2cc(N[C@@H](C)C(N)=O)cc3OCCCn1c23 |r|
CNc1nc2cc(ccc2o1)-c1nc2cc(cc3OCCCn1c23)N1CCC[C@H]1C(N)=O |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(N)cnc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(C(N)=O)c(F)c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2ncc(O)cc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1nc[nH]n1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc(nc1)C(N)=O)C1CC1 |r|
Nc1nc2cc(ccc2o1)-c1nc2cc(NC3CC(F)(F)C3)cc3OCCCn1c23
Nc1nc2cc(ccc2o1)-c1nc2c(F)c(Br)cc3OCCCn1c23
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1F)c23)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccnc2OCOc12)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(=O)[nH]c2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(Cl)nn2c1)C1CC1 |r|
OCc1cnc2cc(ccc2n1)-c1nc2cc(Br)cc3OCCCn1c23
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc2[nH]cnc2c1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc2[nH]nnc2c1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(N)nn2c1)C1CC1 |r|
Nc1nc2cc(ccc2o1)-c1nc2cc(N[C@H]3C[C@H](F)C3)cc3OCCCn1c23 |r,wU:18.20,wD:16.17,(7.58,-5.11,;6.24,-4.34,;6.08,-2.81,;4.58,-2.49,;3.81,-1.16,;2.27,-1.16,;1.5,-2.49,;2.27,-3.83,;3.81,-3.83,;4.84,-4.97,;1.5,.18,;-.04,.34,;-.36,1.84,;-1.69,2.61,;-1.69,4.15,;-3.02,4.92,;-4.36,4.15,;-5.84,4.55,;-6.24,3.06,;-7.58,2.29,;-4.76,2.67,;-.36,4.92,;.98,4.15,;2.18,5.11,;3.68,4.77,;4.35,3.38,;3.68,2,;2.18,1.65,;.98,2.61,)|
Nc1nc2cc(ccc2o1)-c1nc2cc(N[C@@H]3C[C@H](F)C3)cc3OCCCn1c23 |r,wU:16.17,18.20,(7.58,-5.11,;6.24,-4.34,;6.08,-2.81,;4.58,-2.49,;3.81,-1.16,;2.27,-1.16,;1.5,-2.49,;2.27,-3.83,;3.81,-3.83,;4.84,-4.97,;1.5,.18,;-.04,.34,;-.36,1.84,;-1.69,2.61,;-1.69,4.15,;-3.02,4.92,;-4.36,4.15,;-5.84,4.55,;-6.24,3.06,;-7.58,2.29,;-4.76,2.67,;-.36,4.92,;.98,4.15,;2.18,5.11,;3.68,4.77,;4.35,3.38,;3.68,2,;2.18,1.65,;.98,2.61,)|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
Cc1cc(cc2nc(N)oc12)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccnc2[nH]nnc12 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(N)oc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cc(Cl)c2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cnn(c1)C1COC1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cnn(CCO)c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cn[nH]c1)C1CC1 |r|
COc1ccc(cn1)-n1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCc1c23 |r|
NC(=O)[C@@H](Nc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C1CC1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cc(F)c2nccnc2c1)C1CC1 |r|
CC[C@H](C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
CC[C@@H](C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
C[C@H](C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
C[C@@H](C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc2OC3=NC(=O)CCN3c2c1 |r,t:30|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1nc[nH]n1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(-c2nc[nH]n2)c(Cl)c1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(nc1)-c1cn[nH]c1 |r|
CCc1cc(cc2nc(N)oc12)-c1nc2cc(cc3OCCCn1c23)N1CCC[C@H]1C(N)=O |r|
CCc1cc(cc2nc(N)oc12)-c1nc2cc(N[C@@H](C3CC3)C(N)=O)cc3OCCCn1c23 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(cn1)-c1nc[nH]n1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1ncsn1 |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1ccn2nccc2n1)C1CC1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1cc[nH]n1 |r|
NC(=O)[C@H](C1CC1)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@@H](C1CC1)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
COC[C@](C)(C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
COC[C@@](C)(C(N)=O)n1cc(cn1)-c1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc(cc1)N1CCNC1=O |r|
NC(=O)[C@@H](Nc1cc2OCCCn3c(nc(c1)c23)-c1cc(c2oc(N)nc2c1)C(F)(F)F)C1CC1 |r|
COc1ccc(CNC(=O)[C@@H]2CCCN2c2cc3OCCCn4c(nc(c2)c34)-c2ccc3oc(N)nc3c2)cc1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCn3c(nc(c1)c23)-c1ccc2c(c1)o[nH]c2=O |r|
C[C@@H]1Cn2c(nc3cc(N[C@@H](C4CC4)C(N)=O)cc(O1)c23)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1 |r|
C[C@H](Oc1cc2OCCCn3c(nc(c1F)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1F)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2nc(N)sc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1nc[nH]n1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)cnc2c1)C(N)=O |r|
C[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
NC(=O)[C@@H](Nc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2sc(N)nc2c1)C1CC1 |r|
Nc1nc2cc(ccc2o1)-c1nc2c(F)c(cc3OCCCCn1c23)N1CCC[C@H]1C(F)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C(N)=O |r|
NC(=O)[C@@H]1CCCN1c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
C[C@@H](Oc1cc2O[C@H](C)Cn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2O[C@H](C)Cn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
Nc1nc2cc(ccc2o1)-n1nc2cc(Br)cc3OCCCc1c23
C[C@H](N(C)c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
C[C@H](N(C)c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C(N)=O |r|
CC[C@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
CC[C@@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C(N)=O |r|
NC(=O)[C@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C1CC1 |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1F)C(N)=O |r|
NC(=O)[C@@H]1COCCN1c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1 |r|
C[C@@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C(N)=O |r|
C[C@H](N(C)c1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2n1)C(N)=O |r|
C[C@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2n1)C(N)=O |r|
CC[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1nc[nH]n1)C(N)=O |r|
CC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(cc1)-c1nc[nH]n1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(-c2nc[nH]n2)c(F)c1)C(N)=O |r|
C[C@H](N(C)c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1F)C(N)=O |r|
CC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(N)=O |r|
CC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C(N)=O |r|
CC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2nc(N)sc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C(N)=O |r|
C[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2sc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2sc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc2sc(N)nc2cc1F)C(N)=O |r|
C[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc2sc(N)nc2cc1F)C(N)=O |r|
NC(=O)[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2nc(N)sc2c1)C1CC1 |r|
NC(=O)[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2nc(N)sc2c1)C1CC1 |r|
NC(=O)[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C1CC1 |r|
NC(=O)[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C1CC1 |r|
NC(=O)[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C1CC1 |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2sc(N)nc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1F)C(N)=O |r|
C[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1F)C(N)=O |r|
NC(=O)[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c2oc(N)nc2c1)C1CC1 |r|
NC(=O)[C@@H](Oc1cc2OCCn3c(nc(c1)c23)-c1cc(F)c2nc(N)sc2c1)C1CC1 |r|
NC(=O)[C@H](Oc1cc2OCCn3c(nc(c1)c23)-c1cc(F)c2nc(N)sc2c1)C1CC1 |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)nnc2c1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(cc1F)-c1ncn[nH]1)C(N)=O |r|
NC(=O)[C@@H]1[C@@H](F)CCN1c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
CC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cc(F)c(cc1F)-c1ncn[nH]1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(cn1)-c1ncn[nH]1)C(N)=O |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(O)=O |r|
CC[C@@H](C(N)=O)n1cc(cn1)-c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2n1 |r|
CC[C@H](C(N)=O)n1cc(cn1)-c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2n1 |r|
CO[C@@H]1CCN([C@@H]1C(N)=O)c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1 |r|
CC[C@@H](C(N)=O)n1cc(cn1)-c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2n1 |r|
CC[C@H](C(N)=O)n1cc(cn1)-c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2n1 |r|
COC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C(N)=O |r|
COC[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2c1)C(N)=O |r|
NC(=O)[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(-c2ncn[nH]2)c(F)c1)C1CC1 |r|
NC(=O)[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc(-c2ncn[nH]2)c(F)c1)C1CC1 |r|
C[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1cnc(-c2ncn[nH]2)c(F)c1)C(N)=O |r|
C[C@H]1CCN([C@@H]1C(N)=O)c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
CO[C@@H]1CCN([C@@H]1C(N)=O)c1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1 |r|
CC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2oc(N)nc2c1)C(O)=O |r|
COC[C@@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2n1)C(N)=O |r|
COC[C@H](Oc1cc2OCCCCn3c(nc(c1)c23)-c1ccc2nc(N)sc2n1)C(N)=O |r|
C1CN(CCO1)c1nc(nc2c3cccnc3sc12)-c1cccc2[nH]ccc12
C1CN(CCO1)c1nc(nc2c3cccnc3oc12)-c1cccc2[nH]ccc12
C1CN(CCO1)c1nc(nc2c3cccnc3oc12)-c1ccnc2[nH]ccc12
C1CN(CCO1)c1nc(nc2c3cc(cnc3oc12)-c1cccc2[nH]ccc12)-c1cccc2[nH]ccc12
CN1CCN(CC1)C(=O)\C=C\c1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
CN(C)C(=O)\C=C\c1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
CN(C)Cc1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
C(N1CCCCC1)c1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
CN1CCN(Cc2cnc3oc4c(nc(nc4c3c2)-c2cccc3[nH]ccc23)N2CCOCC2)CC1
C(N1CCOCC1)c1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
COCCN(C)Cc1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
C1CN(CCO1)c1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
N#CCCN1CCN(Cc2cnc3oc4c(nc(nc4c3c2)-c2cccc3[nH]ccc23)N2CCOCC2)CC1
COc1ncc(cc1C)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)[C@H]3CCS(=O)(=O)C3)cc12 |r|
COc1cc(cnc1OC)N1CCOc2ccc(O[C@H]3CCN(C3)C(=O)CCS(C)(=O)=O)cc12 |r|
CN(C)c1cc(cnc1S(C)(=O)=O)N1CCOc2ccc(O[C@@H]3CCN(C3)C(=O)C3CCOCC3)cc12 |r|
COc1ncc(cc1C)N1CCOc2cnc(O[C@H]3CCN(C3)C(=O)OC(C)(C)C)cc12 |r|
COc1ncc(cc1C(F)(F)F)N1CCOc2cnc(OC3CCN(C3)C(=O)OC(C)(C)C)cc12
COc1ncc(cc1C#N)N1CCOc2ccc(NC3CCN(C3)C(=O)C3CCOCC3)cc12
CC#Cc1cccc2nc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
CC(C)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC(C)(C)C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@@H](C1=Cc2cccc(c2C(=O)N1c3ccccc3)C#Cc4cnn(c4)C)NC(=O)c5c(nn6c5nccc6)N
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccccc3)c2c(=O)n1-c1ccccc1 |r|
COc1ccc(cn1)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cncn3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC(C)(C)N)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN3CCOCC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC(C)(C)O)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COCC#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCO)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN3CCCC3=O)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@@H](O)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](O)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cccnc3)c2c(=O)n1-c1ccccc1 |r|
COc1ncc(cn1)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cn(C)nc3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccc(=O)n(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COC(C)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,w:2.1,$;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cncn3C)c2c(=O)n1C1CC1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CC3)c2c(=O)n1C1CC1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1C1CC1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccncc3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCOCC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COc1cc(ccn1)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,$;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1nccnc1N)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccn(C)n3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cc[nH]c(=O)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccccn3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccc(=O)[nH]c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CCOC(OCC)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3C)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC=O)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3c(C)nn(C)c3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnc(C)n3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1cnn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3csc(C)n3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cncs3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1cncc2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnc[nH]3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)[nH]1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)c(F)c1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1nccnc1N)c1nc2cccc(C#C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;;;;;N;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1C |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1nccnc1N)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)cc1 |r,$;;;;;;;;;;;N;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)cc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CC#Cc1cccc2cc(C(C)NC(=O)c3c(N)nn4cccnc34)c(nc12)-c1ccccc1 |w:10.11,$;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C\c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C/c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cscn3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1C |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN3CCN(C)CC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CCN(C)C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC(F)(F)F)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3nccs3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3nc(C)cs3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnccc3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3(O)CN4CCC3CC4)c2c(=O)n1-c1ccccc1 |r,wD:1.0,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,THB:25:24:28.29:32.31,(3.41,-1.35,;2.07,-2.12,;2.07,-3.66,;3.41,-4.43,;4.74,-3.66,;3.41,-5.97,;4.65,-6.87,;5.99,-6.1,;4.18,-8.34,;2.64,-8.34,;1.61,-9.48,;.1,-9.16,;-.38,-7.7,;.65,-6.55,;2.16,-6.87,;.74,-1.35,;-.59,-2.12,;-1.93,-1.35,;-3.26,-2.12,;-4.6,-1.35,;-4.6,.19,;-3.26,.96,;-3.26,2.5,;-3.26,4.04,;-3.26,5.58,;-1.72,5.58,;-4.19,6.73,;-4.36,8.51,;-5.99,9.05,;-5.17,7.87,;-3.27,7.23,;-2.28,8.31,;-3.28,9.48,;-1.93,.19,;-.59,.96,;-.59,2.5,;.74,.19,;2.07,.96,;3.41,.19,;4.74,.96,;4.74,2.5,;3.41,3.27,;2.07,2.5,)|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3csc(C)n3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCCC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCCCC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cocn3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cccnc3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1ncc(C)nc1N)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3C(F)(F)F)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C\C=C\c1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r|
COc1cnc(C(=O)N[C@@H](C)c2cc3cccc(C#Cc4cnn(C)c4)c3c(=O)n2-c2ccccc2)c(N)n1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCNCC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccnn3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CNC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3scnc3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnc(C)s3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccc(C)nc3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ncsc3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3sc(C)nc3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cn[nH]c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cn(C)cn3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCN(CC3)C(C)=O)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCN(CC3)S(C)(=O)=O)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCOC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCN(C)CC3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3nnc(C)s3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C\c3ccccc3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3cnn(C)c3C)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2ccc3ccccc3c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(NC(=O)c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(CC(=O)c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(CC(=O)c3cn[nH]c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1cccc(F)c1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1C |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1cccc(C)c1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccc(F)cc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccc(F)c(F)c1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccc(C)cc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1C1CCCCC1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CNS(=O)(=O)CCn1c(cc2cccc(C#Cc3cnn(C)c3)c2c1=O)[C@H](C)NC(=O)c1c(N)nn2cccnc12 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1C |r,wD:1.0,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,(-3.79,1.15,;-2.29,1.47,;-1.81,2.94,;-.3,3.26,;.73,2.11,;.17,4.72,;-.73,5.97,;-2.27,5.97,;.17,7.21,;1.64,6.74,;2.97,7.51,;4.3,6.74,;4.3,5.2,;2.97,4.43,;1.64,5.2,;-1.26,.33,;.25,.65,;1.28,-.5,;2.79,-.17,;3.82,-1.32,;3.34,-2.78,;1.84,-3.1,;1.36,-4.57,;.88,-6.03,;.41,-7.5,;-1.06,-7.97,;-1.06,-9.51,;.41,-9.99,;.88,-11.45,;1.31,-8.74,;.81,-1.96,;-.7,-2.28,;-1.18,-3.74,;-1.73,-1.14,;-3.24,-1.46,;-4.27,-.31,;-5.77,-.63,;-6.25,-2.1,;-5.22,-3.24,;-3.71,-2.92,;-2.68,-4.06,)|
C[C@H](NC(=O)c1cnn2c(C)ccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;O;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CC(C)n1c(cc2cccc(C#Cc3cnn(C)c3)c2c1=O)[C@H](C)NC(=O)c1c(N)nn2cccnc12 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1CCS(=O)(=O)N(C)C |r|
CC[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2ccc(C)nc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cn1cc(cn1)C#Cc1cccc2cc(CNC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |$;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2c(C)cc(C)nc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(N)c2c(=O)n1-c1ccccc1 |r,$;;;;;;;N;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1nccs1 |r|
CC[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1ccc(OC)cc1 |r|
COc1ccc(cc1)[C@@H]1OC(=O)N([C@H]1CO)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F |r|
CC[C@H]1[C@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1ccccc1 |r|
C[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1ccccc1 |r|
CC[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1cccc(OC)c1 |r|
CC[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1nccs1 |r|
CCC1C(OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1cccnc1
CC1C(OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1cccnc1
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2[C@@H](CO)[C@@H](OC2=O)c2ccccc2)c(n1)C(F)(F)F |r|
C[C@H]1[C@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1nccs1 |r|
COCCOc1ccc(cc1)[C@@H]1OC(=O)N([C@H]1CO)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2[C@@H](CO)[C@@H](OC2=O)c2ccc(OCCO)cc2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2[C@@H](CO)[C@@H](OC2=O)c2ccc(OCCCO)cc2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCCCC2=O)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCN(C2=O)c2ccccc2)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCC(=O)CC2)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOC(C2)c2ccccc2)c(n1)C(F)(F)F
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(F)ccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(ccc3[nH]2)C#N)c2c(N)ncnc12
COc1ccc2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3ccccc3n2C)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccccc3[nH]2)c2c(N)ncnc12
COc1ccc2cc([nH]c2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3c(Cl)cccc3[nH]2)c2c(N)ncnc12
COc1cccc2cc([nH]c12)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3cccc(O)c3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCCC1
COc1cc(Cl)c2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
COc1cc(F)c2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3cc(O)cc(Cl)c3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(O)cc(F)c3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(Cl)ccc3[nH]2)c2c(N)ncnc12
COc1ccc2[nH]c(cc2n1)-c1nn(C(C)C)c2ncnc(N)c12
COc1cnc2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3cnccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccc(O)cc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3c(Cl)c(O)ccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(ccc3[nH]2)C(N)=O)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccc(cc3[nH]2)C#N)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccc(cc3[nH]2)C(N)=O)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCCCC1
CCOC(=O)Cn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CC(=O)N1CCC(CC1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCN(CC1)C(=O)C1CC1
CC(C)n1nc(-c2cc3cc(O)c(Cl)cc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(CCN3CCOCC3)nc(-c3cc4cc(O)ccc4[nH]3)c12
Nc1ncnc2n(CC(=O)N3CCOCC3)nc(-c3cc4cc(O)ccc4[nH]3)c12
CNC(=O)Cn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cccc(O)c4[nH]3)c12)C1CCCC1
CC(C)n1nc(-c2cc3c(O)cccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(Cc3cccnc3)nc(-c3cc4cc(O)ccc4[nH]3)c12
CC(C)n1nc(-c2cc3c(Cl)ccc(O)c3[nH]2)c2c(N)ncnc12
COCCn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cccc(O)c4[nH]3)c12)C1CCN(CC1)C(=O)C1CC1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCOCC1
CNC(=O)CCn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Cc1nccn1CCn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4c(Cl)cccc4[nH]3)c12)C1CCOCC1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CC(C1)N1CCOCC1 |(-2.36,3.11,;-2.36,1.57,;-3.69,.8,;-3.69,-.74,;-2.36,-1.51,;-1.02,-.74,;.44,-1.22,;1.35,.03,;.44,1.27,;.84,2.76,;-.06,4,;.84,5.25,;.52,6.76,;1.67,7.79,;1.27,9.27,;3.13,7.31,;3.45,5.8,;2.31,4.77,;2.31,3.23,;-1.02,.8,;.84,-2.71,;.07,-4.04,;1.4,-4.81,;2.17,-3.48,;1.8,-6.3,;.71,-7.39,;1.11,-8.88,;2.6,-9.27,;3.69,-8.19,;3.29,-6.7,)|
CC(C)n1nc(-c2cc3cccc(Cl)c3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cccc(Cl)c4[nH]3)c12)C1CCOCC1
CN1CCN(CC1)C1CC(C1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12 |(3.02,-10.82,;2.62,-9.33,;1.06,-8.91,;.71,-7.39,;1.8,-6.3,;3.29,-6.7,;3.76,-8.19,;1.4,-4.81,;.07,-4.04,;.84,-2.71,;2.17,-3.48,;.44,-1.22,;1.35,.03,;.44,1.27,;.84,2.76,;-.06,4,;.84,5.25,;.52,6.76,;1.67,7.79,;1.27,9.27,;3.13,7.31,;3.45,5.8,;2.31,4.77,;2.31,3.23,;-1.02,.8,;-2.36,1.57,;-2.36,3.11,;-3.69,.8,;-3.69,-.74,;-2.36,-1.51,;-1.02,-.74,)|
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CC(=O)C1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CC(O)C1 |(-2.24,1.62,;-2.24,.08,;-3.57,-.69,;-3.57,-2.23,;-2.24,-3,;-.9,-2.23,;.56,-2.71,;1.47,-1.46,;.56,-.22,;.96,1.27,;.06,2.52,;.96,3.76,;.64,5.27,;1.79,6.3,;1.39,7.79,;3.25,5.82,;3.57,4.32,;2.43,3.29,;2.43,1.75,;-.9,-.69,;.96,-4.2,;.19,-5.53,;1.52,-6.3,;1.92,-7.79,;2.29,-4.97,)|
CC(C)N1CCC(CC1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CC(C)N1CCC(CC1)n1nc(-c2cc3cc(O)cc(Cl)c3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCC(CC1)N1CCOCC1 |w:23.30,(-2.24,3.7,;-2.24,2.16,;-3.57,1.39,;-3.57,-.15,;-2.24,-.92,;-.9,-.15,;.56,-.63,;1.47,.62,;.56,1.86,;.96,3.35,;.06,4.6,;.96,5.84,;.64,7.35,;1.79,8.38,;1.39,9.87,;3.25,7.9,;3.57,6.4,;2.43,5.37,;2.43,3.83,;-.9,1.39,;.56,-2.17,;-.77,-2.94,;-.77,-4.48,;.56,-5.25,;1.9,-4.48,;1.9,-2.94,;.56,-6.79,;-.77,-7.56,;-.77,-9.1,;.56,-9.87,;1.9,-9.1,;1.9,-7.56,)|
CN1CCN(CC1)C1CCC(CC1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12 |w:7.7,(.56,-10.64,;.56,-9.1,;-.77,-8.33,;-.77,-6.79,;.56,-6.02,;1.9,-6.79,;1.9,-8.33,;.56,-4.48,;-.77,-3.71,;-.77,-2.17,;.56,-1.4,;1.9,-2.17,;1.9,-3.71,;.56,.14,;1.47,1.39,;.56,2.63,;.96,4.12,;.06,5.37,;.96,6.61,;.64,8.12,;1.79,9.15,;1.39,10.64,;3.25,8.67,;3.57,7.17,;2.43,6.14,;2.43,4.6,;-.9,2.16,;-2.24,2.93,;-2.24,4.47,;-3.57,2.16,;-3.57,.62,;-2.24,-.15,;-.9,.62,)|
COc1ccc2cc([nH]c2c1)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cc4ccc(O)cc4[nH]3)c12)C1CCOCC1
COc1ccc(Cl)c2cc([nH]c12)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cc4cccc(O)c4[nH]3)c12)C1CCOCC1
COc1cccc2cc([nH]c12)-c1nn(C2CCOCC2)c2ncnc(N)c12
CC(C)N1CCC(CC1)n1nc(-c2cc3cccc(O)c3[nH]2)c2c(N)ncnc12
CC(=O)N1CCC(CC1)n1nc(-c2cc3ccc(O)cc3[nH]2)c2c(N)ncnc12
COc1cccc2cc([nH]c12)-c1nn(C2CCN(CC2)C(=O)C2CC2)c2ncnc(N)c12
COc1cc(Cl)c2[nH]c(cc2c1)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cc4cc(O)cc(Cl)c4[nH]3)c12)C1CCOCC1
CC(=O)N1CCC(CC1)n1nc(-c2cc3c(Cl)ccc(O)c3[nH]2)c2c(N)ncnc12
CC(=O)N1CCC(CC1)n1nc(-c2cc3cc(O)cc(Cl)c3[nH]2)c2c(N)ncnc12
CC(C)N1CCC(CC1)n1nc(-c2cc3c(Cl)ccc(O)c3[nH]2)c2c(N)ncnc12
Cc1nc(N)nc(N2C[C@@H](O)C[C@H]2c2nc3ccc(F)c(-c4cnn(C)c4)c3c(=O)n2-c2ccccc2)c1C#N
Cn1cc(cn1)-c1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
COc1ncc(cn1)-c1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
COc1ncc(cn1)-c1cccc2nc([C@@H]3CCCN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cn1cc(cn1)-c1c(F)ccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1nc(N)nc(N2CCC[C@H]2c2nc3ccc(F)c(-c4cnn(C)c4)c3c(=O)n2-c2ccccc2)c1C#N |r|
COc1ncc(cn1)-c1c(F)ccc2nc([C@@H]3C[C@H](O)CN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cn1cc(cn1)-c1c(F)ccc2nc([C@@H]3C[C@H](O)CN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
COc1ncc(s1)-c1c(F)ccc2nc([C@@H]3C[C@H](O)CN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
CO[C@H]1C[C@H](N(C1)c1nc(N)nc(C)c1C#N)c1nc2cccc(-c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|
CO[C@H]1C[C@H](N(C1)c1nc(N)nc2[nH]cnc12)c1nc2cccc(-c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|
CO[C@H]1C[C@H](N(C1)c1nc(N)nc(C)c1C#N)c1nc2cccc(-c3cnc(OC)nc3)c2c(=O)n1-c1ccccc1 |r|
Cc1nc(N)nc(N2CCC[C@H]2c2nc3cccc(-c4cnn(C)c4)c3c(=O)n2-c2ccccc2)c1C#N |r|
Cc1ccccc1-n1c(nc2cccc(-c3cnn(C)c3)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:24.27,(.62,4.67,;1.95,3.9,;3.28,4.67,;4.62,3.9,;4.62,2.36,;3.28,1.59,;1.95,2.36,;.62,1.59,;.62,.05,;-.72,-.72,;-2.05,.05,;-3.38,-.72,;-4.72,.05,;-4.72,1.59,;-3.38,2.36,;-3.38,3.9,;-2.14,4.8,;-2.61,6.27,;-4.15,6.27,;-4.92,7.6,;-4.63,4.8,;-2.05,1.59,;-.72,2.36,;-.72,3.9,;1.95,-.72,;3.41,-.25,;4.32,-1.49,;3.41,-2.74,;1.95,-2.26,;1.18,-3.6,;-.36,-3.6,;-1.13,-4.93,;-.36,-6.27,;1.18,-6.27,;1.95,-7.6,;1.95,-4.93,;3.44,-5.33,;4.92,-5.73,)|
Cc1ccccc1-n1c(nc2cccc(-c3cn(C)cn3)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:24.27,(.62,4.67,;1.95,3.9,;3.28,4.67,;4.62,3.9,;4.62,2.36,;3.28,1.59,;1.95,2.36,;.62,1.59,;.62,.05,;-.72,-.72,;-2.05,.05,;-3.38,-.72,;-4.72,.05,;-4.72,1.59,;-3.38,2.36,;-3.38,3.9,;-4.63,4.8,;-4.15,6.27,;-4.92,7.6,;-2.61,6.27,;-2.14,4.8,;-2.05,1.59,;-.72,2.36,;-.72,3.9,;1.95,-.72,;3.41,-.25,;4.32,-1.49,;3.41,-2.74,;1.95,-2.26,;1.18,-3.6,;-.36,-3.6,;-1.13,-4.93,;-.36,-6.27,;1.18,-6.27,;1.95,-7.6,;1.95,-4.93,;3.44,-5.33,;4.92,-5.73,)|
Cc1nc(N)nc(N2C[C@@H](O)C[C@H]2c2nc3cccc(-c4cnn(C)c4)c3c(=O)n2-c2ccccc2)c1C#N |r|
Cc1nc(N)nc(N2CCC[C@H]2c2nc3cccc(-c4cncnc4)c3c(=O)n2-c2ccccc2)c1C#N |r|
COc1cncc(c1)-c1cccc2nc([C@@H]3CCCN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1ncc(cn1)-c1cccc2nc([C@@H]3CCCN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1nc(N)nc(N2CCC[C@H]2c2nc3cccc(-c4cccnc4)c3c(=O)n2-c2ccccc2)c1C#N |r|
COc1ccc(cn1)-c1cccc2nc([C@@H]3CCCN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
COc1ncc(cn1)-c1cccc2nc([C@@H]3C[C@H](O)CN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1nc(N)nc(N2C[C@@H](O)C[C@H]2c2nc3cccc(-c4cccnc4)c3c(=O)n2-c2ccccc2)c1C#N |r|
COc1cncc(c1)-c1cccc2nc([C@@H]3C[C@H](O)CN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1nc(N)nc(N2C[C@@H](O)C[C@H]2c2nc3cccc(-c4cncnc4)c3c(=O)n2-c2ccccc2)c1C#N |r|
COc1ccc(cn1)-c1cccc2nc([C@@H]3C[C@H](O)CN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1nc(N)nc(N2C[C@@H](O)C[C@H]2c2nc3cccc(-c4cnn(CCO)c4)c3c(=O)n2-c2ccccc2)c1C#N |r|
CCOc1ncc(cn1)-c1c(F)ccc2nc([C@@H]3C[C@H](O)CN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Cc1nc(N)nc(N2C[C@@H](F)C[C@H]2c2nc3cccc(-c4cnn(C)c4)c3c(=O)n2-c2ccccc2)c1C#N |r|
Cc1nc(N)nc(N2C[C@@H](O)C[C@H]2c2nc3ccc(F)c(-c4cn(C)cn4)c3c(=O)n2-c2ccccc2)c1C#N |r|
CCOc1ncc(cn1)-c1cccc2nc([C@@H]3CCCN3c3nc(N)nc(C)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(C#CCO)c3c(=O)n2-c2ccccc2)c1C#N |r|
Cc1ncc(s1)-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCCO
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1
Cc1ncc(s1)-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(6.06,1.92,;4.52,1.92,;3.61,.68,;2.15,1.15,;2.15,2.69,;3.61,3.17,;.82,3.46,;.82,5,;-.52,5.78,;-1.85,5,;-1.85,3.46,;-.52,2.69,;-3.19,2.69,;-3.19,1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.46,;-4.52,5,;-4.52,-1.16,;-2.98,-1.16,;-6.06,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5.01,;.82,-5.78,;-1.85,-5.78,;-3.19,-5.01,)|
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(4.78,4.98,;4.38,3.49,;5.29,2.24,;4.38,1,;4.78,-.49,;2.92,1.47,;2.92,3.01,;1.59,3.78,;1.59,5.32,;.25,6.09,;-1.08,5.32,;-1.08,3.78,;.25,3.01,;-2.42,3.01,;-2.42,1.47,;-3.75,.7,;-5.08,1.47,;-5.08,3.01,;-3.75,3.78,;-3.75,5.32,;-3.75,-.84,;-2.21,-.84,;-5.29,-.84,;-3.75,-2.38,;-2.42,-3.15,;-2.02,-4.63,;-.53,-4.23,;-.13,-5.72,;1.36,-5.32,;2.69,-6.09,;.96,-3.84,;-.93,-2.75,)|
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1C[C@H](O)C1 |r,wU:25.27,27.30,(3.96,6.23,;3.96,4.69,;5.2,3.78,;4.73,2.32,;5.5,.99,;3.19,2.32,;2.71,3.78,;1.38,4.55,;1.38,6.09,;.04,6.86,;-1.29,6.09,;-1.29,4.55,;.04,3.78,;-2.62,3.78,;-2.62,2.24,;-3.96,1.47,;-5.29,2.24,;-5.29,3.78,;-3.96,4.55,;-3.96,6.09,;-3.96,-.07,;-2.42,-.07,;-5.5,-.07,;-3.96,-1.61,;-3.96,-3.15,;-2.87,-4.24,;-2.87,-5.78,;-1.33,-5.78,;-.24,-6.86,;-1.33,-4.24,)|
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO
Cc1ccc(cc1-c1cncc(n1)-c1cnn(CCN2CCOCC2)c1)S(=O)(=O)NCCC(C)(C)O
Cc1nn(CCN2CCOCC2)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1ccc(cc1-c1cncc(n1)-c1cccnc1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(-2,5,;-2,3.47,;-3.33,2.69,;-3.33,1.15,;-2,.38,;-.67,1.15,;-.67,2.69,;.67,3.47,;.67,5,;2,5.78,;3.33,5,;3.33,3.47,;2,2.69,;4.67,2.69,;4.67,1.15,;6,.38,;7.34,1.15,;7.34,2.69,;6,3.47,;-2,-1.15,;-3.54,-1.15,;-.46,-1.15,;-2,-2.69,;-3.33,-3.47,;-3.33,-5,;-4.67,-5.78,;-6,-5,;-7.34,-5.78,;-6,-3.47,;-4.67,-2.69,)|
Cc1ccc(cc1-c1cncc(n1)-c1csc(CN2CCOCC2)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:29.32,wD:32.36,(-4.16,5,;-4.16,3.47,;-5.5,2.69,;-5.5,1.15,;-4.16,.38,;-2.83,1.15,;-2.83,2.69,;-1.49,3.47,;-1.49,5,;-.16,5.78,;1.17,5,;1.17,3.47,;-.16,2.69,;2.51,2.69,;2.51,1.15,;3.97,.68,;4.88,1.93,;6.42,1.93,;7.19,.59,;6.42,-.74,;7.19,-2.08,;8.73,-2.08,;9.5,-.74,;8.73,.59,;3.97,3.17,;-4.16,-1.15,;-5.7,-1.15,;-2.62,-1.15,;-4.16,-2.69,;-5.5,-3.47,;-5.5,-5,;-6.83,-5.78,;-8.16,-5,;-9.5,-5.78,;-8.16,-3.47,;-6.83,-2.69,)|
Cc1cc(-c2cncc(n2)-c2cc(ccc2C)S(=O)(=O)NC[C@@H]2C[C@H](O)C2)n(C)n1 |r,wU:22.23,24.26,(6.1,4.85,;4.77,4.08,;3.52,4.98,;2.27,4.08,;.94,4.85,;.94,6.39,;-.39,7.16,;-1.73,6.39,;-1.73,4.85,;-.39,4.08,;-3.06,4.08,;-3.06,2.54,;-4.39,1.77,;-5.73,2.54,;-5.73,4.08,;-4.39,4.85,;-4.39,6.39,;-4.39,.23,;-5.93,.23,;-2.85,.23,;-4.39,-1.31,;-5.73,-2.08,;-5.33,-3.57,;-6.1,-4.9,;-4.77,-5.67,;-4.37,-7.16,;-4,-4.34,;2.75,2.61,;1.98,1.28,;4.29,2.61,)|
CN1CCN(CC1)C(=O)C\C=C/c1cnc2oc3c(nc(nc3c2c1)-c1cccc2[nH]ccc12)N1CCOCC1
CC(Nc1nc(N)nc2[nH]cnc12)c1nc2scc(C)n2c(=O)c1-c1ccccc1
CC(Nc1ncnc2[nH]cnc12)c1nc2scc(C)n2c(=O)c1-c1cccc(F)c1
CC(Nc1nc(N)nc2[nH]cnc12)c1nc2scc(C)n2c(=O)c1-c1cccc(F)c1
CC(Nc1nc(N)nc2[nH]cnc12)c1nc2scc(C)n2c(=O)c1-c1cc(F)cc(F)c1
C[C@H](Nc1ncnc2[nH]cnc12)c1nc2scc(C)n2c(=O)c1-c1cccc(F)c1 |r|
CC(Nc1ncnc2[nH]cnc12)c1nc2scc(C)n2c(=O)c1-c1cc(F)cc(F)c1
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccn[nH]3)c2c(=O)n1-c1ccccc1 |r|
CC#Cc1cccc2cc(C(C)NC(=O)c3c(N)nn4cccnc34)c(nc12)-c1ccccc1 |w:12.11|
CC(C)NCCOC1=NCC(C2=CC3C4=C(C=NC3CC2F)N(C)C(=O)C42CCC2)C=C1NS(=O)(=O)C(C)C
CC(C)NCCOc1ncc(-c2cc3c4c(cnc3cc2F)N(C)C(=O)C42CCC2)cc1NS(C)(=O)=O
CCS(=O)(=O)NC1=CC(C2=CC3C4=C(C=NC3CC2F)N(C)C(=O)C42CCC2)CN=C1OCCNC(C)C
CN1C(=O)C2(CCC2)c2c1cnc1ccc(-c3cnc(N4CC(N(C)C)C4)c(NS(C)(=O)=O)c3)cc21
COC(C)C#Cc1cccc2cc([C@H](C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12 |r,w:1.1|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;4.44,4.02,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(F)cncc4F)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;4.47,.62,;5.55,-.47,;4.86,2.11,;3.77,3.2,;2.29,2.8,;1.89,1.31,;.4,.91,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)nc4C)c3c2cc1-c1cn[nH]c1 |(-5.66,.57,;-4.33,1.34,;-3,.57,;-3,-.97,;-1.66,-1.74,;-1.66,-3.28,;-.33,-4.05,;1,-3.28,;2.47,-3.76,;2.87,-5.25,;3.37,-2.51,;4.91,-2.51,;2.47,-1.27,;2.87,.22,;4.33,.7,;4.33,2.24,;5.66,3.01,;2.87,2.71,;1.96,1.47,;.42,1.47,;1,-1.74,;-.33,-.97,;-.33,.57,;-1.66,1.34,;-1.66,2.88,;-.42,3.78,;-.89,5.25,;-2.43,5.25,;-2.91,3.78,)|
COc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cn(C)nc2C)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-3.54,3.12,;-3.07,4.58,;-3.84,5.91,;-1.53,4.58,;-1.05,3.12,;.44,2.72,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)nc4C)c3c2cc1-c1cnn(C)c1 |(-5.66,-.1,;-4.33,.67,;-3,-.1,;-3,-1.64,;-1.66,-2.41,;-1.66,-3.95,;-.33,-4.72,;1,-3.95,;2.47,-4.43,;2.87,-5.91,;3.37,-3.18,;4.91,-3.18,;2.47,-1.93,;2.87,-.45,;4.33,.03,;4.33,1.57,;5.66,2.34,;2.87,2.05,;1.96,.8,;.42,.8,;1,-2.41,;-.33,-1.64,;-.33,-.1,;-1.66,.67,;-1.66,2.21,;-.42,3.12,;-.89,4.58,;-2.43,4.58,;-3.2,5.91,;-2.91,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cc4F)c3c2cc1-c1cn[nH]c1 |(-5.29,.57,;-3.96,1.34,;-2.62,.57,;-2.62,-.97,;-1.29,-1.74,;-1.29,-3.28,;.05,-4.05,;1.38,-3.28,;2.84,-3.76,;3.24,-5.25,;3.75,-2.51,;5.29,-2.51,;2.84,-1.27,;3.24,.22,;4.73,.62,;5.13,2.11,;4.04,3.2,;4.44,4.68,;2.55,2.8,;2.15,1.31,;.67,.91,;1.38,-1.74,;.05,-.97,;.05,.57,;-1.29,1.34,;-1.29,2.88,;-.04,3.78,;-.52,5.25,;-2.06,5.25,;-2.53,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cn[nH]c1 |(-5.29,.57,;-3.96,1.34,;-2.62,.57,;-2.62,-.97,;-1.29,-1.74,;-1.29,-3.28,;.05,-4.05,;1.38,-3.28,;2.84,-3.76,;3.24,-5.25,;3.75,-2.51,;5.29,-2.51,;2.84,-1.27,;3.24,.22,;4.73,.62,;5.13,2.11,;4.04,3.2,;2.55,2.8,;2.15,1.31,;.67,.91,;1.38,-1.74,;.05,-.97,;.05,.57,;-1.29,1.34,;-1.29,2.88,;-.04,3.78,;-.52,5.25,;-2.06,5.25,;-2.53,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(C)cncc4F)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;4.47,.62,;5.55,-.47,;4.86,2.11,;3.77,3.2,;2.29,2.8,;1.89,1.31,;.4,.91,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4F)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;1.89,1.31,;2.29,2.8,;3.77,3.2,;4.86,2.11,;4.47,.62,;5.55,-.47,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)nc4C)c3c2cc1-c1cn(C)nc1C |(-5.66,-.1,;-4.33,.67,;-3,-.1,;-3,-1.64,;-1.66,-2.41,;-1.66,-3.95,;-.33,-4.72,;1,-3.95,;2.47,-4.43,;2.87,-5.91,;3.37,-3.18,;4.91,-3.18,;2.47,-1.93,;2.87,-.45,;1.96,.8,;2.87,2.05,;2.47,3.53,;4.33,1.57,;4.33,.03,;5.66,-.74,;1,-2.41,;-.33,-1.64,;-.33,-.1,;-1.66,.67,;-1.66,2.21,;-2.91,3.12,;-2.43,4.58,;-3.2,5.91,;-.89,4.58,;-.42,3.12,;1.07,2.72,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cc4F)c3c2cc1-c1cn(C)nc1C |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;4.44,4.02,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-2.53,3.12,;-2.06,4.58,;-2.83,5.91,;-.52,4.58,;-.04,3.12,;1.29,2.35,)|
CCc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
CCn1cc(cn1)-c1cc2c3n(-c4c(F)cncc4OC)c(=O)n(C)c3cnc2cc1OC |(-3.07,6.58,;-3.84,5.25,;-3.07,3.91,;-3.54,2.45,;-2.3,1.54,;-1.05,2.45,;-1.53,3.91,;-2.3,0,;-.96,-.77,;-.96,-2.31,;.37,-3.08,;1.84,-2.6,;2.23,-1.11,;1.14,-.02,;-.34,-.42,;1.54,1.46,;3.03,1.86,;4.12,.77,;3.72,-.71,;4.81,-1.8,;6.3,-1.41,;2.74,-3.85,;4.28,-3.85,;1.84,-5.09,;2.23,-6.58,;.37,-4.62,;-.96,-5.39,;-2.3,-4.62,;-2.3,-3.08,;-3.63,-2.31,;-3.63,-.77,;-4.96,0,;-6.3,-.77,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cn(C)nc1C |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-2.8,3.12,;-2.32,4.58,;-3.09,5.91,;-.78,4.58,;-.31,3.12,;1.18,2.72,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(C)c4)c3c2cc1-c1cn[nH]c1
COc1cc2ncc3n(C)c(=O)n(-c4c(C)cncc4F)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;1.89,1.31,;2.29,2.8,;3.77,3.2,;4.86,2.11,;4.47,.62,;5.55,-.47,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(C)cc4F)c3c2cc1-c1cn[nH]c1 |(-5.29,.57,;-3.96,1.34,;-2.62,.57,;-2.62,-.97,;-1.29,-1.74,;-1.29,-3.28,;.05,-4.05,;1.38,-3.28,;2.84,-3.76,;3.24,-5.25,;3.75,-2.51,;5.29,-2.51,;2.84,-1.27,;3.24,.22,;4.73,.62,;5.13,2.11,;4.04,3.2,;4.44,4.68,;2.55,2.8,;2.15,1.31,;.67,.91,;1.38,-1.74,;.05,-.97,;.05,.57,;-1.29,1.34,;-1.29,2.88,;-.04,3.78,;-.52,5.25,;-2.06,5.25,;-2.53,3.78,)|
CCn1cc(cn1)-c1cc2c3n(-c4cn(C)nc4C)c(=O)n(C)c3cnc2cc1OC |(-2.43,6.58,;-3.2,5.25,;-2.43,3.91,;-2.91,2.45,;-1.66,1.54,;-.42,2.45,;-.89,3.91,;-1.66,0,;-.33,-.77,;-.33,-2.31,;1,-3.08,;2.47,-2.6,;2.87,-1.11,;4.33,-.64,;4.33,.9,;5.66,1.67,;2.87,1.38,;1.96,.13,;.42,.13,;3.37,-3.85,;4.91,-3.85,;2.47,-5.09,;2.87,-6.58,;1,-4.62,;-.33,-5.39,;-1.66,-4.62,;-1.66,-3.08,;-3,-2.31,;-3,-.77,;-4.33,0,;-5.66,-.77,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(F)cncc4F)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(C)c4)c3c2cc1-c1cnn(C)c1
CCn1cc(cn1)-c1cc2c3n(-c4ncccc4F)c(=O)n(C)c3cnc2cc1OC |(-4.37,5.91,;-2.83,5.91,;-2.06,4.58,;-2.53,3.12,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-1.29,.67,;.05,-.1,;.05,-1.64,;1.38,-2.41,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;3.75,-3.18,;5.29,-3.18,;2.84,-4.43,;3.24,-5.91,;1.38,-3.95,;.05,-4.72,;-1.29,-3.95,;-1.29,-2.41,;-2.62,-1.64,;-2.62,-.1,;-3.96,.67,;-5.29,-.1,)|
CCc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(CC)c2)n(C)c1=O |(6.3,-1.41,;4.81,-1.8,;3.72,-.71,;4.12,.77,;3.03,1.86,;1.54,1.46,;1.14,-.02,;-.34,-.42,;2.23,-1.11,;1.84,-2.6,;.37,-3.08,;.37,-4.62,;-.96,-5.39,;-2.3,-4.62,;-2.3,-3.08,;-3.63,-2.31,;-3.63,-.77,;-4.96,0,;-6.3,-.77,;-2.3,0,;-.96,-.77,;-.96,-2.31,;-2.3,1.54,;-1.05,2.45,;-1.53,3.91,;-3.07,3.91,;-3.84,5.25,;-3.07,6.58,;-3.54,2.45,;1.84,-5.09,;2.23,-6.58,;2.74,-3.85,;4.28,-3.85,)|
CCn1cc(cn1)-c1cc2c3n(-c4c(F)cncc4F)c(=O)n(C)c3cnc2cc1OC |(-2.32,6.58,;-3.09,5.25,;-2.32,3.91,;-2.8,2.45,;-1.55,1.54,;-.31,2.45,;-.78,3.91,;-1.55,0,;-.22,-.77,;-.22,-2.31,;1.11,-3.08,;2.58,-2.6,;2.98,-1.11,;4.47,-.71,;5.55,-1.8,;4.86,.77,;3.77,1.86,;2.29,1.46,;1.89,-.02,;.4,-.42,;3.48,-3.85,;5.02,-3.85,;2.58,-5.09,;2.98,-6.58,;1.11,-4.62,;-.22,-5.39,;-1.55,-4.62,;-1.55,-3.08,;-2.89,-2.31,;-2.89,-.77,;-4.22,0,;-5.55,-.77,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(C)cc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;4.44,4.02,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cnccc1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cc(C)[nH]n1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;.25,5.91,;-2.06,4.58,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4csc(C)n4)c3c2cc1-c1cn[nH]c1
COc1cc2ncc3n(C)c(=O)n(-c4ncncc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cnccc1-n1c2c(cnc3cc(OC)c(cc23)-c2cn[nH]c2)n(C)c1=O |(6.3,-.07,;4.81,-.47,;3.72,.62,;4.12,2.11,;3.03,3.2,;1.54,2.8,;1.14,1.31,;2.23,.22,;1.84,-1.27,;.37,-1.74,;.37,-3.28,;-.96,-4.05,;-2.3,-3.28,;-2.3,-1.74,;-3.63,-.97,;-3.63,.57,;-4.96,1.34,;-6.3,.57,;-2.3,1.34,;-.96,.57,;-.96,-.97,;-2.3,2.88,;-1.05,3.78,;-1.53,5.25,;-3.07,5.25,;-3.54,3.78,;1.84,-3.76,;2.23,-5.25,;2.74,-2.51,;4.28,-2.51,)|
CCn1cc(cn1)-c1cc2c3n(-c4ccncc4F)c(=O)n(C)c3cnc2cc1OC |(-2.32,6.58,;-3.09,5.25,;-2.32,3.91,;-2.8,2.45,;-1.55,1.54,;-.31,2.45,;-.78,3.91,;-1.55,0,;-.22,-.77,;-.22,-2.31,;1.11,-3.08,;2.58,-2.6,;2.98,-1.11,;1.89,-.02,;2.29,1.46,;3.77,1.86,;4.86,.77,;4.47,-.71,;5.55,-1.8,;3.48,-3.85,;5.02,-3.85,;2.58,-5.09,;2.98,-6.58,;1.11,-4.62,;-.22,-5.39,;-1.55,-4.62,;-1.55,-3.08,;-2.89,-2.31,;-2.89,-.77,;-4.22,0,;-5.55,-.77,)|
CCn1cc(cn1)-c1cc2c3n(-c4ccncc4C)c(=O)n(C)c3cnc2cc1OC |(-4.63,5.91,;-3.09,5.91,;-2.32,4.58,;-2.8,3.12,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-1.55,.67,;-.22,-.1,;-.22,-1.64,;1.11,-2.41,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;3.48,-3.18,;5.02,-3.18,;2.58,-4.43,;2.98,-5.91,;1.11,-3.95,;-.22,-4.72,;-1.55,-3.95,;-1.55,-2.41,;-2.89,-1.64,;-2.89,-.1,;-4.22,.67,;-5.55,-.1,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4F)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cn4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4cnn(c4)C4CCOCC4)c3c2cc1-c1cn[nH]c1
CCn1cc(cn1)-c1cc2c3n(-c4c(C)cncc4F)c(=O)n(C)c3cnc2cc1OC |(-4.63,5.91,;-3.09,5.91,;-2.32,4.58,;-2.8,3.12,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-1.55,.67,;-.22,-.1,;-.22,-1.64,;1.11,-2.41,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;3.48,-3.18,;5.02,-3.18,;2.58,-4.43,;2.98,-5.91,;1.11,-3.95,;-.22,-4.72,;-1.55,-3.95,;-1.55,-2.41,;-2.89,-1.64,;-2.89,-.1,;-4.22,.67,;-5.55,-.1,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(C)cncc4F)c3c2cc1-c1cn(C)nc1C |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-2.8,3.12,;-2.32,4.58,;-3.09,5.91,;-.78,4.58,;-.31,3.12,;1.18,2.72,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccnn4C)c3c2cc1-c1cn[nH]c1 |(-5.66,.57,;-4.33,1.34,;-3,.57,;-3,-.97,;-1.66,-1.74,;-1.66,-3.28,;-.33,-4.05,;1,-3.28,;2.47,-3.76,;2.87,-5.25,;3.37,-2.51,;4.91,-2.51,;2.47,-1.27,;2.87,.22,;1.96,1.47,;2.87,2.71,;4.33,2.24,;4.33,.7,;5.66,-.07,;1,-1.74,;-.33,-.97,;-.33,.57,;-1.66,1.34,;-1.66,2.88,;-.42,3.78,;-.89,5.25,;-2.43,5.25,;-2.91,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4c[nH]nc4C)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.71,.03,;4.71,1.57,;3.24,2.05,;2.34,.8,;.8,.8,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(F)cncc4C#N)c3c2cc1-c1cnn(C)c1 |(-6.1,-.1,;-4.76,.67,;-3.43,-.1,;-3.43,-1.64,;-2.1,-2.41,;-2.1,-3.95,;-.76,-4.72,;.57,-3.95,;2.03,-4.43,;2.43,-5.91,;2.94,-3.18,;4.48,-3.18,;2.03,-1.93,;2.43,-.45,;1.34,.64,;-.14,.24,;1.74,2.13,;3.23,2.53,;4.32,1.44,;3.92,-.05,;5.01,-1.14,;6.1,-2.23,;.57,-2.41,;-.76,-1.64,;-.76,-.1,;-2.1,.67,;-2.1,2.21,;-.85,3.12,;-1.33,4.58,;-2.87,4.58,;-3.64,5.91,;-3.34,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccnc(c4)C#N)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C#N)c3c2cc1-c1cnn(C)c1 |(-6.1,-.1,;-4.76,.67,;-3.43,-.1,;-3.43,-1.64,;-2.1,-2.41,;-2.1,-3.95,;-.76,-4.72,;.57,-3.95,;2.03,-4.43,;2.43,-5.91,;2.94,-3.18,;4.48,-3.18,;2.03,-1.93,;2.43,-.45,;1.34,.64,;1.74,2.13,;3.23,2.53,;4.32,1.44,;3.92,-.05,;5.01,-1.14,;6.1,-2.23,;.57,-2.41,;-.76,-1.64,;-.76,-.1,;-2.1,.67,;-2.1,2.21,;-.85,3.12,;-1.33,4.58,;-2.87,4.58,;-3.64,5.91,;-3.34,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4nccs4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccnn4C)c3c2cc1-c1cnn(C)c1 |(-5.66,-.1,;-4.33,.67,;-3,-.1,;-3,-1.64,;-1.66,-2.41,;-1.66,-3.95,;-.33,-4.72,;1,-3.95,;2.47,-4.43,;2.87,-5.91,;3.37,-3.18,;4.91,-3.18,;2.47,-1.93,;2.87,-.45,;1.96,.8,;2.87,2.05,;4.33,1.57,;4.33,.03,;5.66,-.74,;1,-2.41,;-.33,-1.64,;-.33,-.1,;-1.66,.67,;-1.66,2.21,;-.42,3.12,;-.89,4.58,;-2.43,4.58,;-3.2,5.91,;-2.91,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cn(C)nn1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;.25,5.91,;-2.06,4.58,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn[nH]c4)c3c2cc1-c1cnn(C)c1
CCc1cncc(C)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(c4)C4CCOCC4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4cncnc4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)cn4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4Cl)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
CCc1cncc(C)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(CC)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-5.38,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
CCn1cc(cn1)-c1cc2c3n(-c4ccncc4)c(=O)n(C)c3cnc2cc1OC
CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(c1)C(C)(C)C(N)=O
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
C[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)F)C(N)=O |r|
C[C@@H]1COC(=O)N1c1cn2CCOc3cc(N[C@@H](C4CCC4)C(N)=O)ccc3-c2n1 |r|
NC(=O)[C@@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)F)C1CC1 |r|
C[C@@H]1COC(=O)N1c1cn2CCOc3cc(N[C@@H](C4CC4)C(N)=O)ccc3-c2n1 |r|
NC(=O)[C@@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@H](CF)COC1=O)C1CC1 |r|
C[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@H](CF)COC1=O)C(N)=O |r|
CC[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)F)C(N)=O |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(O[C@@H](C)C(N)=O)ccc3-c2n1 |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1CC(F)(F)F |r|
C[C@H](Oc1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1CC(F)(F)F)C(N)=O |r|
CC(C)C(Oc1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1CC(F)(F)F)C(N)=O |w:3.2|
C[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1CC(F)(F)F)C(N)=O |r|
C[C@H](Oc1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1C)C(N)=O |r|
CCn1ncnc1-c1cn2CCOc3cc(O[C@@H](C)C(N)=O)ccc3-c2n1 |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(O[C@H](C4CC4)C(N)=O)ccc3-c2n1 |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(O[C@@H](C4CC4)C(N)=O)ccc3-c2n1 |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)N(C)[C@@H](C)C(N)=O |r|
CC(C)(O)Cn1cc(cn1)-c1ccc2-c3nc(sc3CCOc2c1)N1C(=O)OCC1(C)C
CC(NC(=O)c1c(N)nn2cccnc12)c1oc2cccc(C#Cc3cnn(C)c3)c2c(=O)c1-c1ccccc1
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1oc2cccc(C#Cc3cnn(C)c3)c2c(=O)c1-c1ccccc1 |r|
C[C@@H](NC(=O)c1c(N)nn2cccnc12)c1oc2cccc(C#Cc3cnn(C)c3)c2c(=O)c1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2nc1-c1ccccc1 |r|
C[C@@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2nc1-c1ccccc1 |r|
C[C@@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3cnn(C)c3)c2cc1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3cnn(C)c3)c2cc1-c1ccccc1 |r|
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2nc1-c1ccccc1
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(c2)N2CCCC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(NC(C)=O)n2)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N(C)C(C)=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCCCC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCN(C)C2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCNC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCCOC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2Cc3ncccc3C2=O)nc1C |r|
C[C@H](N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCCC2=O)nc1C)C(F)(F)F |r|
C[C@H](N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCNC2=O)nc1C)C(F)(F)F |r|
C[C@H](N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCOC2=O)nc1C)C(F)(F)F |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N(C)C(C)=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N(C)C(=O)COC)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N(C)C(=O)[C@@H](C)OC)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N(C)C(=O)[C@H](C)OC)nc1C |r|
CCOCC(=O)N(C)c1cccc(Nc2nc(C)c(s2)-c2cc3CN([C@@H](C)C4CC4)C(=O)c3c(c2)S(=O)(=O)NC)n1 |r|
CCN(C(=O)COC)c1cccc(Nc2nc(C)c(s2)-c2cc3CN([C@@H](C)C4CC4)C(=O)c3c(c2)S(=O)(=O)NC)n1 |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCCCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCCOC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCN(C)CC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CC(=O)N3CCC[C@H]3C2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCCS2(=O)=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCCC2=O)nc1C |r|
CCNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N(C)C(=O)COC)nc1C |r|
CCNS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
CC(C)NS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
CC(C)NS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCCOC2=O)nc1C |r|
CC(C)NS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCCC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCOC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCNC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCCOC2=O)nc1C |r|
C[C@H](N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCCCC2=O)nc1C)C(F)(F)F |r|
C[C@H](N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC1COC1)-c1sc(Nc2cccc(n2)N2CCCC2=O)nc1C)C(F)(F)F |r|
CNS(=O)(=O)c1cc(cc2CN(C(=O)c12)C(C)(C)C)-c1sc(Nc2cccc(n2)N2CCCOC2=O)nc1C
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C(C)(C)C)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCNCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2C[C@H](C)NCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCN[C@H](C)C2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCN[C@@H](C)C2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2C[C@@H](C)NCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2[C@H](C)CNCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNC(C)(C)C2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CC(C)(C)NCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2[C@@H](C)CNCC2=O)nc1C |r|
CCNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNCC2=O)nc1C |r|
CC(C)NS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNCCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CC[C@@H](O)C2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2C[C@H](O)CC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CC[C@H](O)C2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2[C@H](CO)CCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2[C@@H](CO)CCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCN(CCO)CC2=O)nc1C |r|
CC(C)NS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CC[C@H](O)C2=O)nc1C |r|
CC[C@H](C)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC)-c1sc(Nc2cccc(n2)N2CCCOC2=O)nc1C |r|
CC[C@H](C)N1Cc2cc(cc(c2C1=O)S(=O)(=O)NC)-c1sc(Nc2cccc(n2)N2CCOCC2=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1sc(Nc2cccc(n2)N2CCNC2=O)nc1C |r|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C)c3c2cc1-c1c[nH]nc1C |(-5.55,.49,;-4.22,1.26,;-2.89,.49,;-2.89,-1.05,;-1.55,-1.82,;-1.55,-3.36,;-.22,-4.13,;1.11,-3.36,;2.58,-3.84,;3.35,-5.17,;3.48,-2.59,;5.02,-2.59,;2.58,-1.34,;2.98,.14,;1.89,1.23,;2.29,2.72,;3.77,3.12,;4.86,2.03,;4.47,.54,;5.55,-.55,;1.11,-1.82,;-.22,-1.05,;-.22,.49,;-1.55,1.26,;-1.55,2.8,;-2.8,3.71,;-2.32,5.17,;-.78,5.17,;-.31,3.71,;1.03,2.94,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(C)c4)c3c2cc1-c1cn(C)nc1C
COc1ccc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)CC2CCCC2)nc1C
COc1ccc(cc1S(=O)(=O)Nc1c(C)cccc1C)-c1sc(NC2CCCCCC2)nc1C
COc1ccc(cc1S(=O)(=O)NC1CCNCC1)-c1sc(N[C@H](C)CC2CCCCC2)nc1C |r|
COc1ccc(cc1S(=O)(=O)NC1CCNCC1)-c1sc(N[C@H](C)C2CCCCC2)nc1C |r|
COc1ccc(cc1S(=O)(=O)NC1CCCNC1)-c1sc(N[C@H](C)C2CCCCC2)nc1C |r|
COc1ccc(cc1S(=O)(=O)Nc1cc(C)cc(O)c1)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ccc(cc1S(=O)(=O)Nc1ccc(F)cc1)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ccc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ncc(cc1S(=O)(=O)Nc1cccc(O)c1)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ncc(cc1S(=O)(=O)Nc1ccc(F)cc1F)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ncc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ncc(cc1S(=O)(=O)N[C@@H]1CC[C@H](O)CC1)-c1sc(NC(=O)CC2CCOCC2)nc1C |r,wU:12.12,15.16,(-8.95,-1.08,;-7.77,-2.07,;-6.44,-1.3,;-6.44,.24,;-5.11,1.01,;-3.77,.24,;-3.77,-1.3,;-5.11,-2.07,;-5.11,-3.61,;-6.65,-3.61,;-5.5,-5.1,;-3.77,-4.38,;-2.23,-4.38,;-1.46,-5.72,;.08,-5.72,;.85,-4.38,;2.39,-4.38,;.08,-3.05,;-1.46,-3.05,;-2.44,1.01,;-1.03,.38,;-0,1.52,;1.53,1.36,;2.62,2.45,;2.22,3.94,;4.11,2.05,;5.2,3.14,;6.68,2.74,;7.77,3.83,;7.37,5.32,;5.89,5.72,;4.8,4.63,;-.77,2.86,;-2.28,2.54,;-3.42,3.57,)|
COc1ncc(cc1S(=O)(=O)NC1CCCC(O)C1)-c1sc(NC(=O)CC2CCOCC2)nc1C
COc1ncc(cc1S(=O)(=O)Nc1cccc(c1)C(O)=O)-c1sc(NC(=O)CC2CCOCC2)nc1C
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)N3CCN(CC3)C(=O)C=C)nc12
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)Nc3ccc(NC(=O)C=C)cc3)nc12
CCC(=O)N1CCN(CC1)S(=O)(=O)c1cccc(Nc2ncc3N(C)C(=O)c4cc(C)ccc4N(C)c3n2)c1
CN1c2ccc(C)cc2C(=O)N(C)c2cnc(Nc3cccc(c3)S(=O)(=O)N3CCC(O)CC3)nc12
Nc1ncc(s1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1nc(c(s1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1)C(F)(F)F |r|
Nc1nnc(s1)-c1cc(N)cc(c1)S(=O)(=O)c1ccccc1
Nc1nsc(n1)-c1cc(N)cc(c1)S(=O)(=O)c1ccccc1
Nc1ncc(s1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1
Nc1nc(c(s1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
Cc1nc(N)sc1-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1
Nc1ncc(s1)-c1cc(Oc2ccccc2)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
COc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(-c2cc(cc(c2)S(=O)(=O)c2ccccc2)N2CCOCC2)c(n1)C(F)(F)F
CN(C)c1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
COc1ccc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1)C(F)(F)F
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc(c1)C(F)(F)F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc2ccccc2c1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(cc1)C#N)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(F)c(Cl)c1)N1CCOCC1
Cc1cnccc1-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc(c1)C#N)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(cc1)C(F)(F)F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1
CNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(-c2cc(cc(c2)S(=O)(=O)c2ccc(cc2)C#N)N2CCOCC2)c(n1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(cc1)C#N)N1CCOCC1)C(F)(F)F
OCCNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
O=S(=O)(c1ccccc1)c1cc(cc(c1)-c1cnc(NC2CC2)nc1)N1CCOCC1
Cc1ccc(cc1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(=O)Nc1ccc(cc1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCN(CC1)c1cc(cc(c1)S(=O)(=O)c1ccccc1)-c1cnc(N)nc1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCCCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1cccc(c1)C#N)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(CO)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
CC(=O)Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
CNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1)C(F)(F)F
Nc1ncc(-c2cc(cc(c2)S(=O)(=O)Cc2ccccc2)N2CCOCC2)c(n1)C(F)(F)F
Cc1cn2cc(cnc2n1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
OCCNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(cc1)N1CCOCC1)N1CCOCC1
CC(C)(O)CNc1ccc(cc1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CC1CCOC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CC1CCOCC1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1OC)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
Oc1cccc(c1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
Fc1ccc(CS(=O)(=O)c2cc(cc(c2)-c2ccc3NC(=O)COc3c2)N2CCOCC2)cc1
COc1ccc(cc1N)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
COc1nc(N)ccc1-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
Fc1ccc(CS(=O)(=O)c2cc(cc(c2)-c2ccc3NCCOc3c2)N2CCOCC2)cc1
Fc1ccc(CS(=O)(=O)c2cc(cc(c2)-c2cccc(OC(F)(F)F)c2)N2CCOCC2)cc1
NCCNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1c[nH]c2ccccc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCCCC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)[C@H]1CCOC1)N1CCOCC1 |r|
CC(C)(C)OC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
COc1cncc(c1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc2[nH]ccc2c1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(NS(N)(=O)=O)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(cc1)N1CCOCC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1c[nH]cn1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CC1CCCCC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CNC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOCC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc2[nH]cnc2c1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CC1CCC(F)(F)CC1)N1CCOCC1
CC(C)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CN(C1)C1CCOCC1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(C)(C)OC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)cn1)N1CCOCC1
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOC1)N1CCOCC1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1)C(F)(F)F |r|
Nc1ncc(-c2cc(cc(c2)S(=O)(=O)C2CCOC2)N2CCOCC2)c(n1)C(F)(F)F
Nc1cnc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
Nc1cnc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOC1)N1CCOCC1
CCC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(C)C(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CN(C1)C(=O)C1CC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CN(C1)C(=O)Cc1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CN(C1)C(=O)c1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CN(Cc2ccc(F)cc2)C1)N1CCOCC1
NC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CCc1ccc(F)cc1)N1CCOCC1
CC(=O)N1CCC(CC1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(C)(O)CNc1ccc(CS(=O)(=O)c2cc(cc(c2)-c2cnc(N)nc2)N2CCOCC2)cc1
C[C@H]1CC(C[C@@H](C)O1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1 |r|
CC(C)(C)C(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C(F)(F)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCC(F)(F)CC1)N1CCOCC1
CC(C)N1CCC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(C)N1CCC(CC1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(=O)N1CCC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(C)(C)NC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CCNC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
COCNC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CN(C)C(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ccc(nn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccncc1)N1CCOCC1
Nc1ccc(nc1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1F)N1CCOCC1
Cc1cc(N)nnc1-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1F)N1CCOCC1
Nc1ncc(cc1C(F)(F)F)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1ccc(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
O=C(C1CC1)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(NC2CC2)nc1)N1CCOCC1
O=S(=O)(C1CCOC1)c1cc(cc(c1)-c1cnc(NC2CC2)nc1)N1CCOCC1
O=S(=O)(Cc1ccccc1)c1cc(cc(c1)-c1cnc(NC2CC2)nc1)N1CCOCC1
Nc1ccc(-c2cc(cc(c2)S(=O)(=O)[C@@H]2CCOC2)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1cc(F)c(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1cc(Cl)c(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
CNc1ccc(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1coc2ccccc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc2ccoc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc2CCOc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc2ccoc2c1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)\C=C\c1ccccc1O)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1c[nH]c2ccccc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc2CCOc2c1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(nc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1COc2ccccc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(Oc2ccccc2)cc(n1)N1CCOCC1
Cc1nc(N)ncc1-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)c1ccccc1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(F)(F)c1ccccc1
Nc1ncc(cn1)-c1cc(Cc2ccccc2)cc(n1)N1CCOCC1
CC(c1ccccc1)c1cc(nc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=C)c1ccccc1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C1(CC1)c1ccccc1
Nc1ncc(cn1)-c1cc(Oc2ccc(Cl)c(c2)C(F)(F)F)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(OC2CN(C2)C(=O)C2CC2)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(OC2CCOC2)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)C1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(F)(F)C1CCOCC1
Nc1ncc(cn1)-c1cc(Oc2ccccc2Cl)cc(n1)N1CCOCC1
COc1ccccc1Oc1cc(nc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(Oc2ccccc2OC(F)(F)F)cc(n1)N1CCOCC1
Cc1ccccc1Oc1cc(nc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)c1ccccc1Cl
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1Cl
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)N1CCCc2ccccc12
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C1CCOc2ccccc12
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)[C@H]1CCOC1 |r|
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)[C@@H]1CCOC1 |r|
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)C1CCOc2ccccc12
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)[C@@H]1CCOc2ccccc12 |r|
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)[C@@H]1CCOc2ccccc12 |r|
Nc1cc(c(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(=O)Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1
O=S(=O)(c1ccccc1)c1cc(nc(c1)-c1cnc(NC2CC2)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)C1COc2ccccc12
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)C1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)C1CCOC1
CC1CN(CC(C)O1)c1cc(cc(n1)-c1cnc(N)nc1)S(=O)(=O)c1ccccc1
Nc1ncc(cn1)-c1cc(cc(n1)N1CC2CCC(C1)O2)S(=O)(=O)c1ccccc1
CC#Cc1cccc2nc(C(C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#CC(C)(C)C)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
COC(C)C#Cc1cccc2cc(C(C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cncn3C)c2c(=O)n1C1CC1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CC3)c2c(=O)n1C1CC1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1C1CC1
CC(NC(=O)c1nccnc1N)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cc[nH]c(=O)c3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccc(=O)[nH]c3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC=O)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1cnn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1cncc2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3ccn[nH]3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)[nH]1
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)c(F)c1
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1nccnc1N)c1nc2cccc(C#C)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1C
CC(NC(=O)c1nccnc1N)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)cc1
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#C)c2c(=O)n1-c1ccc(F)cc1
C[C@@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C\c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|
C[C@@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C/c3cnn(C)c3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3c[nH]c(C)n3)c2c(=O)n1C |r|
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3(O)CN4CCC3CC4)c2c(=O)n1-c1ccccc1 |TLB:23:24:31.32:29.28,THB:25:24:31.32:29.28,(2.65,-.58,;1.31,-1.35,;1.31,-2.89,;2.65,-3.66,;3.98,-2.89,;2.65,-5.2,;3.89,-6.11,;5.36,-5.63,;3.42,-7.57,;1.88,-7.57,;.85,-8.72,;-.66,-8.4,;-1.14,-6.93,;-.11,-5.79,;1.4,-6.11,;-.02,-.58,;-1.36,-1.35,;-2.69,-.58,;-4.02,-1.35,;-5.36,-.58,;-5.36,.96,;-4.02,1.73,;-4.02,3.27,;-4.02,4.81,;-4,6.9,;-2.63,7.59,;-5.6,6.54,;-6.7,9.12,;-7.94,8.22,;-6.61,7.45,;-5.14,7.93,;-4.82,9.43,;-6.16,10.2,;-2.69,.96,;-1.36,1.73,;-1.36,3.27,;-.02,.96,;1.31,1.73,;2.65,.96,;3.98,1.73,;3.98,3.27,;2.65,4.04,;1.31,3.27,)|
CC(NC(=O)c1c(N)nn2cccnc12)c1nc2cccc(C#Cc3csc(C)n3)c2c(=O)n1-c1ccccc1
CC#Cc1cccc2cc(C(C)NC(=O)c3c(N)nn4cccnc34)n(-c3ccccc3)c(=O)c12
COc1cnc(C(=O)NC(C)c2cc3cccc(C#Cc4cnn(C)c4)c3c(=O)n2-c2ccccc2)c(C)n1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#CC3CCNCC3)c2c(=O)n1-c1ccccc1
CC(NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cn[nH]c3)c2c(=O)n1-c1ccccc1
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(\C=C\c3ccccc3)c2c(=O)n1-c1ccccc1 |r|
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2ccccc2c(=O)n1-c1ccccc1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2nccc(-c3ccncc3)c2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2ccc(cc2s1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2ccc(cc2o1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1ccc2cc(ccc2n1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccncc3)n2c1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1ccc2oc(N)nc2c1
Nc1ncnc2ccc(cc12)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1ncc2cc(ccc2n1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccncc3)n2n1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(-c3ccccc3)c2c1
Nc1nsc2ccc(cc12)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nsc2cc(ccc12)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1cc2nccc(-c3ccncc3)c2s1
Nc1nc2cccc(-c3ccc4nccc(-c5ccncc5)c4c3)c2o1
Nc1noc2cc(ccc12)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cccc(-c3ccc4nccc(-c5ccncc5)c4c3)c2s1
Nc1noc2ccc(cc12)-c1ccc2nccc(-c3ccncc3)c2c1
CC(=O)Nc1cn2cc(ccc2n1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(-c3cn[nH]c3)c2c1
CN1CCN(CC1)c1ccnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(N3CCOCC3)c2c1
CN1CCN(CC1)c1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(NC3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1c[nH]c2nccc(-c3ccncc3)c12
Cn1cc(cn1)-c1ccnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(CCN3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(N3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(N3CCC(O)CC3)c2c1
CN1CCN(CC1)c1cc(ccn1)-c1ccnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(-c3cccnc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(NC3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(NCCN3CCOCC3)c2c1
CN1CCC(CC1)Oc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3cccnc3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3cn[nH]c3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C#CC3CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccn2c1
Cn1cc(cn1)-c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)c1ccc(cn1)-c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NCCN3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C#N)c(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(OC3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(OC3CCOCC3)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccc4nc(N)oc4c3)n2c1
Nc1nc2cc(ccc2o1)C1CCc2ncc(-c3ccc(nc3)N3CCOCC3)n2C1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccnc(c3)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CCOCC3)c(=O)c2c1
Cc1nc2ccc(nn2c1-c1ccncc1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(N3CCOCC3)n2n1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3cccnc3)n2n1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3cn[nH]c3)n2n1
CC(=O)N1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1cnc2ncc(-c3ccncc3)n2c1
Nc1nc2cc(ccc2o1)-c1ccn2ncc(-c3ccncc3)c2n1
Nc1nc2ccc(cc2o1)-c1ccc2ncn(C3CCOCC3)c(=O)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCOCC1
CN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC(=O)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1cn2c(cnc2cn1)-c1ccncc1
Nc1nc2cc(ccc2o1)-c1cn2c(cnc2cn1)-c1cn[nH]c1
Nc1nc2cc(ccc2s1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1ccncc1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(=O)[nH]c2c1
CCN1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
CC(C)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CCNCC3)c(=O)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1cccnc1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1cn[nH]c1
CN1CCN(CC1)c1nc2cc(ccc2c(=O)n1C)-c1ccc2oc(N)nc2c1
Cn1c(nc2cc(ccc2c1=O)-c1ccc2oc(N)nc2c1)N1CCOCC1
CN1CCC(CC1)Nc1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC(=O)N1CCC(CC1)Nc1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NC3CCOCC3)n2c1
CC(C)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNCC1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(NC3CCN(CC3)C(=O)C3CC3)c2c1
CS(=O)(=O)CCN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)C(=O)c1c(C)nc2ccc(cn12)-c1ccc2oc(N)nc2c1
Cc1nc2ccc(cn2c1C(=O)N1CCOCC1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(cc2c1)C#N
Cn1cc(cn1)-c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCC(CC1)Nc1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(NC3CCOCC3)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(cc2c1)C(=O)N1CCOCC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCS(=O)(=O)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(O)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CCO)CC1
CC(C)N1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CC(C)(C#N)c1ccc(Nc2ncnc3ccc(cc23)-c2ccc3oc(N)nc3c2)cc1
CN(C)CC(=O)N1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)C(=O)c1cnc2ccc(nn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2n1
C[C@H]1CN(C[C@@H](C)O1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCS(=O)(=O)CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1cnn(CCO)c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(n2c1)S(=O)(=O)N1CCOCC1
CN1CCN(CC1)S(=O)(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCNCC3)n2c1
CS(=O)(=O)N1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CC(=O)N1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2ccc(cc2s1)-c1ccc2ncc(nc2c1)N1CCOCC1
CN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2nc(N)sc2c1
Nc1nc2cc(ccc2s1)-c1ccc2ncc(nc2c1)N1CCOCC1
Nc1nc2ccc(cc2o1)-c1ccc2ncc(nc2c1)N1CCOCC1
CN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2nc(N)oc2c1
CCOC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CNC(=O)CN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)[C@@H]1CCCN1 |r|
Nc1nc2cc(ccc2o1)-c1cn2c(cnc2cn1)C(=O)N1CCOCC1
CN1CCN(CC1)C(=O)c1cnc2cnc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2ccc(cc2s1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2s1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2sc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(N[C@H]3CC[C@H](O)CC3)nc2c1 |r,wU:21.23,wD:18.19,(6.65,-3.77,;5.88,-2.44,;4.34,-2.28,;4.02,-.77,;2.69,,;2.69,1.54,;4.02,2.31,;5.36,1.54,;5.36,,;6.5,-1.03,;1.36,2.31,;1.36,3.85,;.02,4.62,;-1.31,3.85,;-2.64,4.62,;-3.98,3.85,;-3.98,2.31,;-5.31,1.54,;-5.31,,;-6.65,-.77,;-6.65,-2.31,;-5.31,-3.08,;-5.31,-4.62,;-3.98,-2.31,;-3.98,-.77,;-2.64,1.54,;-1.31,2.31,;.02,1.54,)|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2ccc3oc(N)nc3c2)CC1
CC(=O)Nc1nc2ccc(cc2s1)-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3)S(C)(=O)=O)cc2n1
CC1CN(CC(C)N1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
C[C@H]1CN(C[C@@H](C)O1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(NCCN3CCOCC3)nc2c1
CC(N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNC(=O)C1
CN1CCCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN(C1CCN(CC1)C(C)=O)c1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CC(C1)C(=O)N1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN(C)CC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN1CCCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CCN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CC1CN(CC(C)N1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NC3CC[C@H](O)CC3)n2c1 |r,wU:23.25,(5.65,-3.53,;4.88,-2.2,;3.35,-2.04,;3.03,-.53,;1.7,.24,;1.7,1.78,;3.03,2.55,;4.37,1.78,;4.37,.24,;5.51,-.79,;.36,2.55,;.36,4.09,;-.97,4.86,;-2.3,4.09,;-3.77,4.56,;-4.67,3.32,;-3.77,2.07,;-4.17,.59,;-5.65,.19,;-3.08,-.5,;-1.99,-1.59,;-2.39,-3.08,;-1.3,-4.17,;.19,-3.77,;1.28,-4.86,;.59,-2.28,;-.5,-1.19,;-2.3,2.55,;-.97,1.78,)|
CN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2sc(N)nc2c1
CN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2nc(N)oc2c1
CN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2nc(N)sc2c1
CC(=O)NC1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCN(CCO)CC3)n2c1
CC1CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1ccnc(c1)N1CCOCC1
CN(C1CCN(C)CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC2CC2)CC1
CNC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN(C1CCN(C)CC1)c1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CC(C1)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)C(=O)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)C(=O)N1CCOCC1
CN1CCC(CC1)NC(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CC(C)N1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCN(CC4CC4)CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(O)CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(CC3)N3CCOCC3)n2c1
CC1CN(CCN1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN(C1CCN(C)CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN(CCN1CCOCC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1ccc(nc1)N1CCOCC1
NC1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)C(=O)N1CCOCC1
CN1CCN(CC1)C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(CC1)N1CCOCC1
CN(C)C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC1CN(CCO1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Cc1nccn1-c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCCCC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCCC1
Cc1cn(cn1)-c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
C[C@@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1ccccc1
CS(=O)(=O)CCN1CCC(CC1)Nc1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC(C)(C)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCn1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(CCO)c(=O)c2c1
Cc1ncccc1-c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NC3CC3)n2c1
CCNC(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NCCO)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)Nc3cccnc3)n2c1
CC(C)(C)N1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
NCC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
COC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Cc1ccc(cn1)-c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1ccccn1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCCCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC3)n2c1
CS(=O)(=O)CCN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CS(=O)(=O)CCN1CCC(CC1)NC(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(O)C3)n2c1
CC1CN(CCO1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(O)C3)n2c1
CN1CCC(CC1)NC(=O)c1cnc2ccc(nn12)-c1ccc2oc(N)nc2c1
NC1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CCC3)c(=O)c2c1
CC(C)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
C[C@H](N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
C[C@@H](N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(O)C1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1cnc(N)nc1
CC(=O)N1CCC(CC1)Nc1ncnc2ccc(nc12)-c1ccc2oc(N)nc2c1
CN1CCC(CC1)Nc1ncnc2ccc(nc12)-c1ccc2oc(N)nc2c1
CC(C)(N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CNC(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)C(=O)NC1CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(O)C1
CCN(CC)CCNc1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(NCCN3CCCC3)nc2c1
CCN(CC)CCCNc1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(NCCCN3CCCC3)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(NCCCN3CCOCC3)nc2c1
Cc1ccn(n1)C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN(CC)CCn1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)[C@H]1CCCN1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)C1(N)CC1
CN1CCN(CC1)C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nnc(-c3ccncc3)n2c1
Nc1nc2ccc(cc2o1)-c1ccc2nnc(-c3ccncc3)n2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nc(N)sc2c1
Nc1nc2cc(ccc2o1)-c1cnc(N)nc1
CC(=O)Nc1cn2cc(ccc2n1)-c1ccc2oc(N)nc2c1
CC(=O)Nc1ncc(s1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1cccc2[nH]nc(N)c12
CC(C)Oc1nc(cnc1N)-c1ccc2oc(N)nc2c1
COc1nc(cnc1N)-c1ccc2oc(N)nc2c1
CC(Oc1nc(cnc1N)-c1ccc2oc(N)nc2c1)C(F)(F)F
Nc1nc2cc(ccc2o1)-c1ccc2oc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1ccc2oc(N)nc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccc2nc(N)oc2c1
Nc1nc2ccc(cc2o1)-c1ccc2nc(N)sc2c1
CC(=O)Nc1nc2cc(ccc2o1)-c1ccc2oc(N)nc2c1
Nc1cn2cc(ccc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1ccc2nc(N)oc2c1
Nc1cn2cc(ccc2n1)-c1ccc2nc(N)oc2c1
Nc1nc2cc(ccc2o1)-c1ccc2sc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1ccc2sc(N)nc2c1
CC(=O)Nc1nc2cc(ccc2s1)-c1ccc2oc(N)nc2c1
CC(=O)Nc1nc2cc(ccc2s1)-c1ccc2nc(N)oc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CC3)c(=O)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(CCN3CCCC3)c(=O)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CCCC3)c(=O)c2c1
NC(=O)[C@@H]1CCCN1c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@H]1CCCN1c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@@H]1CCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@H]1CCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C1CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC[C@H](O)C1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCN(CC3)C3CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@H](O)C3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@@H](O)C3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(C3)N3CCOCC3)n2c1
C[C@@H]1CN(CCN1)C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1CN(CCN1)C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CC(C)[C@H](N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CC(C)[C@@H](N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncn(CCCN3CCCC3)c(=O)c2c1
COCCn1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
CN1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN1CCN(CCNc2cnc3ccc(cc3n2)-c2ccc3oc(N)nc3c2)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)C(=O)N1CCN(CC1)C1CC1
CN1CCN(CC1=O)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)CN1CCCC1
CCN(CC)CC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN1CCN(CCn2cnc3ccc(cc3c2=O)-c2ccc3oc(N)nc3c2)CC1
CCN(CC)CCCn1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nnc(C(=O)N3CCOCC3)n2c1
NC(=O)[C@@H]1CCCN1C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
NC(=O)[C@H]1CCCN1C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CC(C)N1CCN(CC1)C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)C1(N)CCC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)C(=O)N1CCN(CC2CC2)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NCCCN3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(CCN3CCOCC3)c(=O)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(CCCN3CCOCC3)c(=O)c2c1
CN1CCN(CCCn2cnc3ccc(cc3c2=O)-c2ccc3oc(N)nc3c2)CC1
CN(C)CCn1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NCCCN3CCCC3)n2c1
Cc1ccc(NC(=O)c2cnc3ccc(cn23)-c2ccc3oc(N)nc3c2)cn1
CCN(CC)CCNC(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NCCN3CCCC3)n2c1
Cc1ccn(n1)C1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
N[C@@H](CO)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
N[C@H](CO)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2nnc(-c3cccnc3)n2c1
Nc1nc2ccc(cc2o1)-c1ccc2nnc(-c3cccnc3)n2c1
CCN(CC)CCCNC(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN(C)C1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1ccc2nnc(C(=O)N3CCCC3)n2c1
CN1CCN(CCNC(=O)c2cnc3ccc(cn23)-c2ccc3oc(N)nc3c2)CC1
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2sc(N)nc2c1 |r|
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2nc(N)sc2c1 |r|
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2nc(N)oc2c1 |r|
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1cccc2nc(N)oc12 |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc2oc(N)nc2c1 |r|
CC(=O)Nc1nc(C)c(s1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCN(CC1)C1CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCCC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CC[C@@H](O)C1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N(CCO)CCO)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C(=O)N3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)n1cccn1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)n1ccnc1
Cc1ccn(n1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1cccc2c(N)nsc12 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CC[C@H](O)C1 |r|
CN1CCN(CC1=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN(CC)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCNC(=O)C1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCNCC1
CC(=O)N1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2oc(N)nc2c1)N1CCOCC1
CC(C)N1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
C[C@H]1CN(CCN1C)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCN(CCO)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCS(=O)(=O)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCN(CC2CC2)CC1
CC1(C)CN(CCN1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(CC1)n1cccn1
Cc1cn(cn1)C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Cc1cn(cn1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCC(O)CC1
C[C@H]1CN(CCN1)c1cnc2cccc(-c3ccc4oc(N)nc4c3)c2n1 |r|
C[C@H]1CN(CCN1)c1cnc2cccc(-c3ccc4nc(N)oc4c3)c2n1 |r|
Cc1nccn1C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(CC1)n1ccnc1
Nc1nc2cc(ccc2o1)-c1ccn2ncc(C(=O)N3CCCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccn2ncc(C(=O)N3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
Cc1c(ccc2ncc(C(=O)N3CCOCC3)n12)-c1ccc2oc(N)nc2c1
C[C@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1cc2nc(N)oc2cc1C |r|
Cc1cc2oc(N)nc2cc1-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Cc1cc2oc(N)nc2cc1-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
Cc1nccn1C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
C[C@@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccn2ncc(-c3ccncc3)c2c1
Cc1cc(cc2c(cnn12)C(=O)N1CCOCC1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(cc(Cl)c2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
Nc1nc2cc(cc(Cl)c2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(cc(F)c2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(cc(F)c2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
Cc1c(ccc2oc(N)nc12)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
C[C@H]1CN(CCN1)c1cnc2ccc(cc2n1)-c1cccc2c(N)noc12 |r|
Cc1cc(cc2nc(N)oc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Cc1cc(cc2nc(N)oc12)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
CN(C)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
NC1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Cc1cc(cc2c(cnn12)C(=O)N1CCCC1)-c1ccc2oc(N)nc2c1
Cc1c(ccc2oc(N)nc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(c(Cl)cc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(c(Cl)cc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
Nc1nc2cc(c(F)cc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(c(F)cc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
C[C@H]1CN(CCN1)c1cnc2ccc(-c3ccc4oc(N)nc4c3)c(C)c2n1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC[C@@H](C1)N1CCOCC1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC[C@H](C1)N1CCOCC1 |r|
CS(=O)(=O)N1CCN(CC1)C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN(C)[C@@H]1CCN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CN1CCN(CC1)[C@@H]1CCN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CN1CCN(CC1)C(=O)c1cnn2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)[C@H]1CCN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CN(C)[C@H]1CCN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Cc1c(ccc2ncc(nc12)N1CC(C1)N1CCOCC1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNC(C1)C(F)(F)F
CN1CCC(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Cc1c(ccc2ncc(nc12)N1CC(C1)N1CCNCC1)-c1ccc2oc(N)nc2c1
COCCN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC1(C)CN(CCN1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNCC1=O
CN1CCN(C(=O)C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN1CCN(C(=O)C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CC(C)N1CCN(C(=O)C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC2CC2)CC1=O
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCn2cccc2C1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC(F)(F)F)CC1
C[C@H]1CN(CCN1)c1cnc2ccc(cc2c1)-c1ccc2oc(N)nc2c1 |r|
Cc1cc(cc2c(cnn12)-c1ccncc1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccn2ncc(C(=O)N3CCC(CC3)N3CCOCC3)c2c1
C[C@H]1CN(CCN1)c1cnc2scc(-c3ccc4oc(N)nc4c3)c2c1 |r|
Nc1nc2cc(cnc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CC(=O)Nc1cc2ccc(cn2n1)-c1cc(F)c2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1nc2cc(cnc2s1)-c1cccnc1
C[C@H]1CN(CCN1)c1cc2cc(ccc2nc1N)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2nc(N)c(nc2c1)N1CC(C1)N1CCOCC1
CS(=O)(=O)Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CNc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1ccc2oc(Nc3ccccc3)nc2c1
CN1CCC(CC1)Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1ccc2oc(NC3CC3)nc2c1
Nc1ncc(cc1C(F)(F)F)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CC(Oc1nc(cnc1N)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1)C(F)(F)F
Nc1nc2nc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNC(C1)C(F)F
COc1ncc(cc1N)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1F)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ncc(cc1NS(=O)(=O)c1cccc(F)c1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cncc(c1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CC(=O)n1nc(N)c2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2[nH]nc(N)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2c(N)n[nH]c2c1
COc1ccc(CNc2n[nH]c3cc(ccc23)-c2ccc3oc(N)nc3c2)cc1
CC(=O)Nc1n[nH]c2cc(ccc12)-c1ccc2oc(N)nc2c1
CC(=O)Nc1n[nH]c2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1cc(F)c2oc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1cc(F)c2oc(N)nc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cc(F)c2oc(N)nc2c1
CC(=O)Nc1nc2cc(ccc2s1)-c1cc(F)c2oc(N)nc2c1
Nc1nc2cc(cc(F)c2o1)-c1ccc2nc(N)sc2c1
Nc1nc2cc(cc(F)c2o1)-c1ccc2sc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1cc(F)c2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2ccc(cc2o1)-c1cc(F)c2ncc(C(=O)N3CCOCC3)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1cccc(c1)S(=O)(=O)Nc1ccccc1
Fc1ccc(F)c(NS(=O)(=O)c2cccc(c2)-c2ccc3ncc(C(=O)N4CCOCC4)n3c2)c1
CNS(=O)(=O)c1cccc(c1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CS(=O)(=O)Nc1cccc(c1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ccc(cc1S(=O)(=O)Nc1ccccc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CNS(=O)(=O)c1cc(ccc1OC)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CN1CCN(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1cncc(c1)S(=O)(=O)Nc1ccccc1
Cc1cc(cn2c(cnc12)C(=O)N1CCOCC1)-c1ccc2oc(N)nc2c1
Cc1cc(cn2c(cnc12)C(=O)N1CCOCC1)-c1ccc2nc(N)oc2c1
CNS(=O)(=O)c1cncc(c1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Fc1ccccc1S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1cccc(NS(=O)(=O)c2ccccc2)c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cccc(c1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ccc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ccc(cc1NS(C)(=O)=O)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Fc1cccc(c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Clc1ccc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CS(=O)(=O)Nc1cc(ccc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(ccc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
COc1ccc(cc1NS(=O)(=O)c1cccnc1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CO[C@H]1CCN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
CO[C@@H]1CCN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@@H](C3)N3CCOCC3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@H](C3)N3CCOCC3)n2c1 |r|
COC1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(F)C3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(C3)N3CC[C@H](O)C3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(C3)N3CC[C@@H](O)C3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(F)(F)C3)n2c1
CN(C1CCOCC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(F)(F)C3)n2c1
Nc1nsc2c(cccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@@H](F)C3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@H](F)C3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@H](C3)n3cccn3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC[C@@H](C3)n3cccn3)n2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(C3)n3cccn3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3C4CCC3COC4)n2c1
C[C@@H]1CCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1CCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1COCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1COCCN1C(=O)c1cnc2ccc(cn12)-c1cccc2nc(N)oc12 |r|
Nc1nc2cccc(-c3ccc4ncc(C(=O)N5CCOCC5)n4c3)c2s1
CNc1noc2cc(ccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1n[nH]c2cc(ccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1noc2cc(ccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nsc2cc(ccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1n[nH]c2c(cccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1noc2c(cccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1cnc2[nH]ncc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCn4cncc4C3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC4(C3)OCCO4)n2c1
C[C@@H]1COCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2c(cccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CNc1nsc2cc(ccc12)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(C3)N3CC(F)(F)C3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC4(C3)OCCO4)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(C3)N3CCC(F)(F)C3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(F)(F)CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC(C3)N3CCC(F)(F)C3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCC(F)CC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CC4CCC(C3)O4)n2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1ccc2c(Nc3ccccc3)nsc2c1
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1cccc2[nH]ncc12
Cc1cc2ncc(C(=O)N3CCOCC3)n2cc1-c1ccc2oc(N)nc2c1
C[C@@H]1CN(CCN1C)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
O=C(N1CCOCC1)c1cnc2ccc(cn12)-c1ccc2c(Nc3ccccc3)noc2c1
C[C@H]1CN(CCN1)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
C[C@@H]1CN(CCN1)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1CN(CCN1C)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1 |r|
CC1(C)CN(CCO1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CC1(C)COCCN1C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CC1(C)CN(CCN1)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Clc1ncc(-c2ccc3ncc(C(=O)N4CCOCC4)n3c2)c2cn[nH]c12
COc1ncc(-c2ccc3ncc(C(=O)N4CCOCC4)n3c2)c2cn[nH]c12
CC(C)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1
CC(C)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1cncc(NS(C)(=O)=O)c1
CC(C)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(CC3)C(C)C)c(=O)c2c1
CC(C)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncn(C3CCN(C)CC3)c(=O)c2c1
CN1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1cnc(Cl)c(NS(C)(=O)=O)c1
CN1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CN1CC(C1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
COc1nc(C)ccc1-c1cnc2sc(nn12)N1CCC(N)(CO)CC1
COCCOc1cc(ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1)C(C)C
CCOc1cc(F)ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1
COCCOc1cc(Cl)ccc1-c1cnc2sc(nn12)N1CCC(N)(CO)CC1
COc1cc(C)ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1
CCOc1cc(F)ccc1-c1cnc2sc(nn12)N1CC[C@@](N)(CO)C1 |r|
COc1cc(Cl)ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1
COc1cc(F)ccc1-c1cnc2sc(nn12)N1CC[C@](N)(CO)C1 |r|
COc1cc(F)ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1
COc1cc(F)ccc1-c1cnc2sc(nn12)N1CC[C@](O)(CN)C1 |r|
COCCOc1cc(Cl)ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1
CCOc1cc(ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1)C(F)(F)F
COc1cc(C)ccc1-c1cnc2sc(nn12)N1CCNC(CCO)C1
COc1nc(C)ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1
COc1nc(ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1)C(C)C
COc1nc(ccc1-c1cnc2sc(nn12)N1C[C@@H]2OCC[C@@H](N)[C@@H]2C1)C(C)C |r|
COc1nc(ccc1-c1cnc2sc(nn12)N1C[C@H]2OCC[C@H](N)[C@H]2C1)C(C)C |r|
CCOc1nc(ccc1-c1cnc2sc(nn12)N1C[C@H]2OCC[C@H](N)[C@H]2C1)C(C)C |r|
CCOc1nc(ccc1-c1cnc2sc(nn12)N1CCC(O)(CN)CC1)C(C)C
COc1cc(C(O)=O)c(NC(C)c2cc(C)cc3c2oc(cc3=O)N2CCC(C)(C)CC2)cc1F
CC(Nc1ccccc1S(O)(=O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(N(C)c1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccc(cc1C(O)=O)C#N)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1cc(F)ccc1[N+]([O-])=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1c(Cl)cccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CONC(=O)c1ccccc1NC(C)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccccc1-c1nnn[nH]1)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1cccc2CNC(=O)c12)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1cc2OCOc2cc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccccc1S(=O)(=O)C(F)F)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccsc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccccc1-c1noc(=O)[nH]1)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1cccc2cc(sc12)C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccc(nc1C(O)=O)C1CC1)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CCC(C)(C)CC1)c(C1CC1)c2=O
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CCC(C)(C)CC1)c(-c1cnoc1)c2=O
CCc1c(oc2c(cc(C)cc2c1=O)C(C)Nc1ccccc1C(O)=O)N1CCC(C)(C)CC1
CC(Nc1ccccc1C(O)=O)c1cc(cc2c1oc(cc2=O)N1CCC(C)(C)CC1)C(F)(F)F
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCCC2(CNC(=O)C2)C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC(Cl)C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCCC(C)(C)C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC(C1)N(C)C
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(CC1)C(F)(F)F
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCCC2(CCOCC2)C1
CC(C)CNc1cc(=O)c2cc(C)cc(C(C)Nc3ccccc3C(O)=O)c2o1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2CCC(C1)O2
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCOC(C1)c1ccc(cc1)S(C)(=O)=O
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2(C1)CCCCC2
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC2(CCCCO2)CC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC2(CCCC2)CC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccc(F)cc2C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC2(CC1)Cn1nc(cc1CO2)C(=O)N(C)C
COC12CC(C1)N(C2)c1cc(=O)c2cc(C)cc(C(C)Nc3ccccc3C(O)=O)c2o1 |(7.68,-2.11,;6.91,-.77,;5.37,-.77,;4.47,-2.02,;3,-1.54,;4.07,-.77,;2.99,,;4.47,.47,;1.65,.77,;1.65,2.31,;.32,3.08,;.32,4.62,;-1.01,2.31,;-2.35,3.08,;-3.68,2.31,;-5.02,3.08,;-3.68,.77,;-2.35,,;-2.35,-1.54,;-1.01,-2.31,;-3.68,-2.31,;-5.02,-1.54,;-5.02,,;-6.35,.77,;-7.68,,;-7.68,-1.54,;-6.35,-2.31,;-6.35,-3.85,;-7.68,-4.62,;-5.02,-4.62,;-1.01,.77,;.32,,)|
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCS(=O)(=O)CC1
CCNc1cc(=O)c2cc(C)cc(C(C)Nc3ccccc3C(O)=O)c2o1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(F)(F)CC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCCOCC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCn2cnnc2C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(NC13CC4CC(CC(CO)(C4)C1)C3)cc2=O |TLB:31:24:33:27.32.28,31:28:33:23.24.25,25:26:23.24.31:32,THB:25:24:33.27.26:32|
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCn2cccc2C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2CC(C2)C1 |(,-2.31,;-1.33,-1.54,;-2.67,-2.31,;-4,-1.54,;-4,,;-5.33,.77,;-6.67,,;-6.67,-1.54,;-5.33,-2.31,;-5.33,-3.85,;-6.67,-4.62,;-4,-4.62,;-1.33,,;-2.67,.77,;-2.67,2.31,;-4,3.08,;-1.33,3.08,;,2.31,;,.77,;1.33,,;2.67,.77,;2.67,2.31,;1.33,3.08,;1.33,4.62,;4,,;4,-1.54,;5.33,-2.31,;6.67,-1.54,;6.67,,;5.33,-.77,;5.33,.77,)|
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC(C1)C(C)(F)F
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C1)c1ccncc1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2(CCN2c2ccccc2)C1
CCC1(CN(C1)c1cc(=O)c2cc(C)cc(C(C)Nc3ccccc3C(O)=O)c2o1)c1ccccc1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC2(C1)CC(F)(F)C2
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCc2ccccc2C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CC(C1)c1ccccc1
COc1ccc(NC(C)c2cc(C)cc3c2oc(cc3=O)N2Cc3ccccc3C2)c(n1)C(O)=O
CC(Nc1cccc(F)c1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccc(F)cc2C1
C[C@H](Nc1cccc(F)c1C(O)=O)c1cc(C)cc2c1oc(N1Cc3ccc(F)cc3C1)c(C)c2=O |r|
CC(Nc1sc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccccc2C1
C[C@@H](Nc1ccnnc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1 |r|
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1 |r|
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1Cc3ccccc3C1)c(C)c2=O
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1Cc3ccc(F)cc3C1)c(C)c2=O
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CC(C)(C1)c1ccccc1)c(C)c2=O |r|
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CC[C@@H](C1)c1ccccc1)c(C)c2=O |r|
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CCC(CC1)(C#N)c1ccccc1)c(C)c2=O |r|
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CC3(CCC3(F)F)C1)c(C)c2=O |r|
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccccc2C1
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccc(F)cc2C1
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC2(CC2)CC1
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccc3OCOc3c2C1
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccccc2C1 |r|
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccc3OCOc3c2C1 |r|
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(N1CCC3(CC3)CC1)c(C)c2=O
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(N1CCCCC1)c(C)c2=O
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(N1CCC3(CC3)CC1)c(C)c2=O |r|
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(N1Cc3ccc(F)cc3C1)c(C)c2=O |r|
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(N1CCCCC1)c(C)c2=O |r|
C[C@@H](Nc1ccc(Cl)nc1C(O)=O)c1cc(C)cc2c1oc(N1CCC(F)(F)CC1)c(C)c2=O |r|
CC(Nc1ccccc1C(O)=O)c1cc(F)cc2c1oc(N1Cc3ccc(F)cc3C1)c(C)c2=O
C[C@H](Nc1ccccc1C(O)=O)c1cc(F)cc2c1oc(N1Cc3ccccc3C1)c(C)c2=O |r|
C[C@H](Nc1ccccc1C(O)=O)c1cc(F)cc2c1oc(N1CCC(F)(F)CC1)c(C)c2=O |r|
C[C@H](Nc1ccccc1C(O)=O)c1cc(F)cc2c1oc(N1CCC3(CC3)CC1)c(C)c2=O |r|
CC(Nc1ccccc1C(O)=O)c1cc(cc2c1oc(cc2=O)N1Cc2ccc(F)cc2C1)C(F)(F)F
CC(Nc1ccccc1C(O)=O)c1cc(cc2c1oc(cc2=O)N1Cc2ccc(cc2C1)C#N)C(F)(F)F
C[C@H](Nc1ccccc1C(O)=O)c1cc(cc2c1oc(cc2=O)N1Cc2ccccc2C1)C(F)(F)F |r|
CC(Nc1ccccc1C(O)=O)c1cc(cc2c1oc(N1Cc3ccc(F)cc3C1)c(C)c2=O)C(F)(F)F
C[C@H](Nc1ccccc1C(O)=O)c1cc(cc2c1oc(N1Cc3ccccc3C1)c(C)c2=O)C(F)(F)F |r|
CC(Nc1ccc(F)cc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccc(F)cc2C1
CC(Nc1ccc(cc1C(O)=O)B(O)O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccccc2C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)CC1
CNC(=O)C1CCN(CC1)c1cc(=O)c2cc(C)cc(C(C)Nc3ccccc3C(O)=O)c2o1
COC1CCN(CC1)c1cc(=O)c2cc(C)cc(C(C)Nc3ccccc3C(O)=O)c2o1
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCCCC1 |r|
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC2(CN(C)C(=O)O2)CC1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(N1CCC(C)(C)CC1)c(C#N)c2=O
CC(Nc1ccccc1C(O)=O)c1cc(cc2c1oc(cc2=O)N1CCC(F)(F)CC1)C(F)(F)F
CC(Nc1ccccc1C(O)=O)c1cc(F)cc2c1oc(cc2=O)N1CCC2(CC2)CC1
CC(Nc1ccccc1C(O)=O)c1cc(F)cc2c1oc(cc2=O)N1CCC(F)(F)CC1
CC(Nc1ccc(Cl)nc1C(O)=O)c1cc(F)cc2c1oc(cc2=O)N1Cc2ccccc2C1
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1C2CC1CCC2
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncnc(NCc3ccccc3)c2c1
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1
CS(=O)(=O)Nc1cncc(c1)-c1ccc2ncnc(NCc3ccccc3)c2c1
C[C@@H](Nc1ncnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)c1ccccc1 |r|
C[C@H](Nc1ncnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)c1ccccc1 |r|
COc1cc(cnc1OC)-c1ccc2ncnc(NC(C)c3ccccc3)c2c1
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)C#N)c1ccccc1 |r|
C[C@H](Nc1c(cnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)C#N)c1ccccc1 |r|
CC(Nc1c(cnc2ccc(cc12)-c1cnc(N)nc1)C#N)c1ccccc1
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cnc(N)nc1)C#N)c1ccccc1 |r|
CC(Nc1c(cnc2ccc(cc12)-c1cnc2[nH]ncc2c1)C#N)c1ccccc1
CC(Nc1c(cnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)C#N)c1ccc(F)cc1
C[C@@H](Nc1ncnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)c1ccc(F)cc1 |r|
C[C@H](Nc1ncnc2ccc(cc12)-c1cnc(Cl)c(NS(C)(=O)=O)c1)c1ccc(F)cc1 |r|
CC(Nc1ncnc2ccc(cc12)-c1cnc(N)nc1)c1ccc(F)cc1
CC(Nc1c(cnc2ccc(cc12)-c1cncc(c1)-c1n[nH]c(=O)o1)C#N)c1ccccc1
C[C@@H](Nc1cccc(F)c1C(O)=O)c1cc(C)cc2c1oc(N1Cc3ccc(F)cc3C1)c(C)c2=O |r|
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1C2CC1CCC2 |r|
c1cc2c(cc1\C=C/3\C(=O)NC(=O)S3)OC(O2)(F)F
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3ccc(NC(=O)c4cc(F)cc(c4)C(F)(F)F)c1c23
Cc1ccccc1C1NC(=O)N2CCc3ccc(NC(=O)c4csc5ccccc45)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCCc3ccc(NC(=O)c4cc(F)cc(c4)C(F)(F)F)c1c23
Cc1ccccc1C1NC(=O)c2cccc3ccc(NC(=O)c4csc5ccccc45)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCOc3ccc(NC(=O)c4cc(F)cc(c4)C(F)(F)F)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)n2ccc3ccc(NC(=O)c4cc(F)cc(c4)C(F)(F)F)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)cc3Br
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3C#N
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3NC(=O)C(F)(F)F
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@@H](NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@H](NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3N=[N+]=[N-]
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3N1CC(F)(F)C1
Nc1n[nH]c2ccc(cc12)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Cn1nc(cc1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl)C(F)(F)F
Cn1cc(cn1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cccc2nncn12
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cnn(c1)C1CCOCC1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cnoc1
OB(O)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Cc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3F
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3NC1CC1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3Nc1cnn(c1)C1CCOCC1
CC(C)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Cn1nc(cc1Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl)C(F)(F)F
Cn1cc(Nc2cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)N4CCc2c34)c2cc(F)ccc2Cl)cn1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3NC1COC1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3NC1CCOCC1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cn[nH]c1
C[C@H](O)C(=O)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
C[C@@H](O)C(=O)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3ccc(-c4nc5c(F)cc(cc5[nH]4)C(F)(F)F)c1c23
OCC(=O)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1c[nH]c2ncc(cc12)C(F)(F)F
Fc1n[nH]cc1Nc1cc(Nc2nccc3c(cc(F)cc23)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(Nc1nccc2c(cc(F)cc12)C(F)(F)F)cc3Nc1cc(n[nH]1)C(F)(F)F
NCC(=O)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
C[C@H](N)C(=O)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3NC(=O)[C@@H]1CCCN1 |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(Nc1nccc2c(cc(F)cc12)C(F)(F)F)cc3Br
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(Nc1nccc2c(cc(F)cc12)C(F)(F)F)cc3C#N
Nc1cc(n[nH]1)-c1cc(Nc2nccc3c(cc(F)cc23)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(Nc1nccc2c(cc(F)cc12)C(F)(F)F)cc3F
Fc1n[nH]cc1-c1cc(Nc2nccc3c(cc(F)cc23)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1cc(c2ccnc(Nc3cc(C#N)c4CCN5c4c3[C@@H](NC5=O)c3cc(Cl)ccc3Cl)c2c1)C(F)(F)F |r|
Fc1cc(c2ccnc(Nc3cc(C#N)c4CCN5c4c3[C@H](NC5=O)c3cc(Cl)ccc3Cl)c2c1)C(F)(F)F |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1c([nH]nc1C(F)(F)F)C1CC1 |(-.3,-6.48,;1.11,-5.86,;2.35,-6.76,;3.76,-6.14,;3.92,-4.61,;5.33,-3.98,;2.67,-3.7,;1.27,-4.33,;2.84,-2.17,;1.59,-1.26,;1.75,.27,;.5,1.17,;3.16,.89,;3.63,2.36,;5.17,2.36,;5.65,.89,;4.4,-.01,;4.24,-1.54,;5.97,-2.17,;6.19,-3.69,;7.61,-4.27,;8.83,-3.32,;7.83,-5.79,;6.62,-6.74,;6.83,-8.27,;5.62,-9.22,;8.26,-8.84,;9.47,-7.89,;9.26,-6.37,;10.9,-8.47,;12.33,-9.05,;10.33,-9.9,;11.48,-7.04,;7.22,-1.26,;7.06,.27,;8.3,1.17,;8.3,2.71,;9.77,3.19,;10.67,1.94,;9.77,.7,;10.24,-.77,;10.72,-2.23,;8.78,-1.24,;11.71,-.29,;7.06,3.62,;5.52,3.78,;6.43,5.03,)|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1c(n[nH]c1-c1ccccc1)C(F)(F)F |(-.3,-6.48,;1.11,-5.86,;2.35,-6.76,;3.76,-6.14,;3.92,-4.61,;5.33,-3.98,;2.67,-3.7,;1.27,-4.33,;2.84,-2.17,;1.59,-1.26,;1.75,.27,;.5,1.17,;3.16,.89,;3.63,2.36,;5.17,2.36,;5.65,.89,;4.4,-.01,;4.24,-1.54,;5.97,-2.17,;6.19,-3.69,;7.61,-4.27,;8.83,-3.32,;7.83,-5.79,;6.62,-6.74,;6.83,-8.27,;5.62,-9.22,;8.26,-8.84,;9.47,-7.89,;9.26,-6.37,;10.9,-8.47,;12.33,-9.05,;11.48,-7.04,;10.33,-9.9,;7.22,-1.26,;7.06,.27,;8.3,1.17,;8.3,2.71,;9.77,3.19,;10.67,1.94,;9.77,.7,;10.24,-.77,;11.75,-1.09,;12.22,-2.55,;11.19,-3.7,;9.69,-3.38,;9.21,-1.91,;7.06,3.62,;5.81,4.52,;7.96,4.86,;6.15,2.37,)|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3ccc(Nc4nccc5c(cc(F)cc45)C(F)(F)F)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3ccc(Nc4ncnc5cc(F)cc(F)c45)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3ccc(Nc4ncnc5c(Cl)cc(F)cc45)c1c23
Nc1cc([nH]n1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Nc1cc([nH]n1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@@H](NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Nc1cc([nH]n1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@H](NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccn[nH]1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(Cl)c1)cc3-c1cc(n[nH]1)C(F)(F)F
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(Cl)c1)cc3N1CCOCC1
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(Br)c2CCN3c2c1C(NC3=O)c1cccc2ccccc12
OC(=O)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
NC(=O)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cccc2ccccc12
Fc1cn(Cc2ccccc2)nc1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1cccc(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3Br
Fc1ccc(Br)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3Br
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(Br)c2CCN3c2c1C(NC3=O)c1ccccc1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cc(n[nH]1)C(F)(F)F
Fc1ccc(Cl)c(c1)[C@H]1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cc(n[nH]1)C(F)(F)F |r|
Fc1ccc(Cl)c(c1)[C@@H]1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cc(n[nH]1)C(F)(F)F |r|
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(Br)c2CCN3c2c1C(NC3=O)c1ccccc1Cl
Cc1ncc([nH]1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Cc1nc[nH]c1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3C#C
Cc1cc(n[nH]1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cn[nH]c1C(F)(F)F
Cc1n[nH]c(c1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl)C(F)(F)F |(3.33,-11.94,;4.79,-12.41,;5.27,-13.88,;6.81,-13.88,;7.38,-12.42,;6.04,-11.51,;6.04,-9.97,;4.7,-9.2,;4.7,-7.66,;3.37,-6.89,;1.67,-7.84,;1.67,-9.38,;.34,-7.07,;.34,-5.53,;-.99,-4.76,;-.99,-3.22,;-2.33,-5.53,;-2.33,-7.07,;-.99,-7.84,;-3.66,-7.84,;-4.43,-6.5,;-2.89,-9.17,;-4.99,-8.61,;6.04,-6.89,;6.04,-5.35,;7.37,-4.58,;8.7,-5.35,;10.04,-4.58,;8.7,-6.89,;9.79,-7.97,;9.02,-9.31,;7.37,-9.2,;7.37,-7.66,;4.7,-4.58,;3.37,-5.35,;2.03,-4.58,;.85,-5.19,;2.03,-3.04,;3.37,-2.27,;4.7,-3.04,;6.04,-2.27,;8.85,-11.97,;10.32,-11.51,;8.39,-10.5,;9.3,-13.44,)|
Nc1n[nH]cc1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1c[nH]cn1
FC(F)c1[nH]ncc1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Oc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@H](NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
Oc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@@H](NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |r|
COc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)[C@@H]1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3Br |r|
Fc1ccc(Cl)c(c1)[C@H]1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3Br |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-n1ccc(n1)C(F)(F)F
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-n1cc(cn1)C(F)(F)F
Fc1cnn(c1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-n1cc(nn1)C(F)(F)F
CP(C)(=O)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1nnn[nH]1
Nc1cc(Nc2nccc3c(cc(F)cc23)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(Nc1nccc2c(cc(F)cc12)C(F)(F)F)cc3NC(=O)C(F)(F)F
NC(=N)Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
CC(C)(O)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
OC1(CN(C(=O)Nc2cc(NC(=O)C(F)(F)F)c3CCN4c3c2C(NC4=O)c2cc(F)ccc2Cl)c2ccc(F)cc12)C(F)(F)F
Fc1n[nH]cc1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Nc1cc(-c2nc3c(F)cc(cc3[nH]2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(Br)c2CCN3c2c1C(NC3=O)c1cc(Cl)ccc1Cl
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(Cl)ccc1Cl
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(Cl)ccc1C(F)(F)F
Nc1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1C(F)(F)F
Nc1cc(-c2nc3cc(Cl)ccc3[nH]2)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Nc1cc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(C#N)c2CCN3c2c1[C@H](NC3=O)c1cc(Cl)ccc1Cl |r|
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(C#N)c2CCN3c2c1[C@@H](NC3=O)c1cc(Cl)ccc1Cl |r|
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3[C@H](NC(=O)c1c23)c1cc(F)ccc1Cl)C#N |r|
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3[C@@H](NC(=O)c1c23)c1cc(F)ccc1Cl)C#N |r|
Cn1nc2ccc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl
Cn1nc2ccc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(Cl)ccc1Cl
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl)-c1cc(n[nH]1)C(F)(F)F
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl)-c1ccc2ncnn2c1C#N
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(Cl)ccc1Cl)-c1ccc2ncnn2c1C#N
Fc1ccc(Cl)c(c1)[C@H]1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1C#N |r|
Fc1ccc(Cl)c(c1)[C@@H]1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1C#N |r|
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(c2CCN3c2c1[C@H](NC3=O)c1cc(Cl)ccc1Cl)-c1ccc2ncnn2c1C#N |r|
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(c2CCN3c2c1[C@@H](NC3=O)c1cc(Cl)ccc1Cl)-c1ccc2ncnn2c1C#N |r|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1C#N
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3[C@H](NC(=O)c1c23)c1cc(Cl)ccc1Cl)C#N |r|
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3[C@@H](NC(=O)c1c23)c1cc(Cl)ccc1Cl)C#N |r|
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl)-c1cn[nH]c1C(F)F
Cn1nc2c(cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl)-c1c[nH]nc1F
NC1NC(C#N)=C(C=C1)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@H](NC(=O)N3CCc1c23)c1cc(Cl)ccc1Cl |r,c:5,7|
NC1NC(C#N)=C(C=C1)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2[C@@H](NC(=O)N3CCc1c23)c1cc(Cl)ccc1Cl |r,c:5,7|
CCn1nc2ccc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl
OC(=O)c1ccccc1C1NC(=O)N2CCC3C2C1=C(NC(=O)c1cc(F)cc(c1)C(F)(F)F)C=C3Br |c:21,38|
CC(C)n1nc2ccc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(Br)c2CCN3c2c1C(NC3=O)c1cc(Cl)ncc1Cl
CN(C)CCn1nc2ccc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)c2n(CC(F)(F)F)nc3ccc(NC(=O)c4cc(F)cc(c4)C(F)(F)F)c1c23
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)cc3Br
Cn1nc2ccc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)c1c23)c1cc(Cl)c(F)cc1Cl
Nc1c[nH]c(c1C#N)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1n[nH]cc1C#N
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1c[nH]nc1C#N
OC(=O)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(Cl)ncc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1F
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(c2CCN3c2c1C(NC3=O)c1cc(Cl)ccc1Cl)-c1ccc2ncnn2c1
Fc1cc(cc(c1)C(F)(F)F)C(=O)Nc1cc(c2CCN3c2c1C(NC3=O)c1cc(Cl)ccc1Cl)-c1cccnc1C#N
Nc1cccc(-c2cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)N4CCc2c34)c2cc(Cl)ccc2Cl)c1C#N
Nc1cccc(-c2cc(NC(=O)c3cc(F)cc(c3)C(F)(F)F)c3C(NC(=O)N4CCc2c34)c2cc(F)ccc2Cl)c1C#N
Nc1nc(ccc1-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl)C#N
NC1NC(C#N)=C(C=C1)c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl |c:5,7|
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cccnc1C#N
Nc1ncc(c(n1)C#N)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Nc1c(ccc2ncnn12)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1Br
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1C#C
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cncnc1C#N
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2[nH]ncc2c1C#N
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cnc(F)nc1C#N
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2ncnn2c1C(F)(F)F
COc1c(ccc2ncnn12)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cnc2[nH]cnc2c1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cnc2[nH]cnc2c1
N#Cc6c(c2cc(NC(=O)c1cc(F)cc(C(F)(F)F)c1)c4c3c2ccn3C(=O)NC4c5cc(F)ccc5Cl)cc(F)c7ncnn67
Nc1ccc(c(c1)C#N)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1ccc2nccn2c1C#N
Nc1cc(C#N)c(cn1)-c1cc(NC(=O)c2cc(F)cc(c2)C(F)(F)F)c2C(NC(=O)N3CCc1c23)c1cc(F)ccc1Cl
Fc1ccc(Cl)c(c1)C1NC(=O)N2CCc3c2c1c(NC(=O)c1cc(F)cc(c1)C(F)(F)F)cc3-c1cn2ncnc2cc1C#N
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(COCCN3CCC(C)(C)CC3)nc2)n(C)c1=O
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCC(=O)N2CCC3(CC3)C2)n(C)c1=O |r|
COC1CCN(CCO[C@H](C)c2ccc(cn2)-c2ccc3nnc4n(C)c(=O)n(C(C)C)c4c3c2)CC1 |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCCC2)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCC(C2)OC2CC2)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CC[C@@H](C)C2)n(C)c1=O |r|
C[C@@H](OCCN1CCC2(CC2)C1)c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1 |r|
C[C@@H](OCCN1CCC2(CC2)CC1)c1ccc(cn1)-c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1 |r|
CO[C@@H]1CCN(CCO[C@H](C)c2ccc(cn2)-c2ccc3nnc4n(C)c(=O)n(C5CCOCC5)c4c3c2)C1 |r|
CO[C@H]1C[C@@H](C1)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCCC2)n(C)c1=O |r,wU:2.1,wD:4.6,23.27,(3.84,4.98,;3.36,3.51,;4.39,2.37,;5.93,2.29,;5.85,.75,;4.31,.83,;6.88,-.39,;6.56,-1.9,;7.9,-2.67,;7.9,-4.21,;6.56,-4.98,;5.23,-4.21,;3.89,-4.98,;2.56,-4.21,;2.56,-2.67,;3.89,-1.9,;5.23,-2.67,;1.23,-1.9,;1.23,-.36,;-.11,.41,;-1.44,-.36,;-1.44,-1.9,;-.11,-2.67,;-2.77,.41,;-2.77,1.95,;-4.11,-.36,;-5.44,.41,;-6.78,-.36,;-8.11,.41,;-8.27,1.94,;-9.78,2.26,;-10.55,.93,;-9.52,-.22,;9.04,-1.64,;10.55,-1.96,;8.41,-.23,;9.18,1.1,)|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@H](OCCN2CCCC2)C(F)(F)F)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](OCCN2CCCC2)C(F)(F)F)n(C)c1=O |r|
Nc1c[nH]c2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CCOCC1
CC(C)(O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3[nH]nc(N)c3n2)cc1
CS(=O)(=O)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3[nH]nc(N)c3n2)cc1
CC1(C)C(=O)Nc2cc(NC(=O)Nc3ccc(cc3)-c3nc(N4CCOCC4)c4[nH]nc(N)c4n3)ccc12
Nc1n[nH]c2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)c(c2)C(F)(F)F)cc1)N1CCOCC1
Nc1n[nH]c2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(COCCN3CCOCC3)c(c2)C(F)(F)F)cc1)N1CCOCC1
Cn1c2cnc3cc(F)c(-c4ccc(OCCCN5CCCCC5)nc4)c4OC5CCCCC5n(c2c34)c1=O
CC[C@@H]1COc2c(c(F)cc3ncc4n(C)c(=O)n1c4c23)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CC(C)n1c2c(n(C)c1=O)N=NC1CC(F)C(C3C=NC(OCCCN4CCCCC4)=CC3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN(C)C)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(N5CCC(N(C)C)CC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(N5CCC(CN(C)C)C5)nc4)cc3c21
CC(C)n1c2c(n(C)c1=O)N=NC1C=C(F)C(c3ccc(COCCN(C)C)nc3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CCCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CC[C@@H](F)C5)nc4)cc3c21
CC(C)n1c2c(nnc3cc(F)c(cc23)-c2ccc(COCCN3CCC(F)CC3)nc2)n(C)c1=O
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CC6CC6C5)nc4)cc3c21
CC(C)n1c2c(n(C)c1=O)N=NC1C=C(F)C(c3ccc(C(=O)NCCN(C)C)nc3)=CC21
CC(C)n1c2c(n(C)c1=O)N=NC1CC(F)C(C3C=NC(OCCCN4CCC(F)CC4)=CC3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC[C@H](F)C5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC[C@@H](F)C5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC6CC6C5)nc4)cc3c21
Cc1ccccc1Nc2c(cc(cn2)C(=O)NC)NC(=O)c3cc(cc(c3)F)C(F)(F)F
Cc1ccccc1Nc2c(cc(cn2)C(=O)NC)NC(=O)c3cc(cc(c3)Br)F
COC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
COC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(C3(C(F)(F)F)N=N3)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(F)cc(F)cc3[nH]2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)cc(Cl)c2)c1
Cc1ccccc1Nc1ncc(-c2cncnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NS(=O)(=O)c2ccc(F)cc2C)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(N(S(=O)(=O)c2ccc(F)cc2C)S(=O)(=O)c2ccc(F)cc2C)c1
Cc1ccccc1Nc1ncccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)ccc2OC)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(N(S(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)c1
Cc1ccccc1Nc1ncc(C(=O)N2CCCC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C2=CCNCC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2oc(C)nc2C)c1
Cc1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NS(=O)(=O)c2ccccc2)c1
Cc1ccccc1Nc1ncc(C2CC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)N2CCOCC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NCc2ccccc2)c1
CNC(=O)c1cnc(Nc2ccccc2)c([N+](=O)[O-])c1
CNC(=O)c1cnc(Nc2cccc(F)c2)c([N+](=O)[O-])c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2c(C)nc(N)[nH]c2=O)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C(O)c2cccc(F)c2)c1
Cc1ccccc1Nc1ncc(C(N)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cccc(F)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2ccc(O)c(O)c2)c1
CNC(=O)c1cnc(Nc2ccccc2)c(N)c1
CNC(=O)c1cnc(Nc2cccc(F)c2)c(N)c1
CNC(=O)c1cnc(Nc2ccccc2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NCC2CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cccc(Cl)c2)c1
CNC(=O)c1cnc(Nc2ccc(C)cc2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(N2CCc3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C#N)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(C)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3ccccc3o2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(C)(C)O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccccc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2coc3ccccc23)c1
Cc1ccccc1Nc1ncc(-c2cccc(S(N)(=O)=O)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2ccc(C#N)cc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2S(C)(=O)=O)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ncn3ccccc23)c1
Cc1ccccc1Nc1ncc(C#N)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1cc(F)cc(c1)C(F)(F)F)C(=O)NCc1ccnn1C
Cc1ccccc1Nc1ncc(C(=O)NCc2cnn(C)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(NC(=O)OC(C)(C)C)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NS(=O)(=O)c2cn(C)nc2C)c1
COc1cccc(-c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)c1
COc1ncc(-c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)cn1
CNc1ncc(Br)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(Nc2ccccc2C)n1
Cc1ccccc1Nc1ncc(Br)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1Nc1ncnn2cccc12
Cc1ccccc1Nc1ncc(NS(C)(=O)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(CO)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CCN(C)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2nccs2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CCN(C)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NS(C)(=O)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(N)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(N2CC(NC(=O)OC(C)(C)C)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(N2CC(N)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2ccn[nH]2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1cc(F)cc(c1)C(F)(F)F)-c1cncc(c1)C#N
Cc1ccccc1Nc1ncc(-c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cccnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2c(C)noc2C)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2ccc(C(N)=O)cc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2ccc(NC(=O)OC(C)(C)C)cc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cn[nH]c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2ccc(O)cc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2ccccc2C#N)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1ccc(-c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)cc1
CNC(=O)c1cnc(Nc2ccccc2C)c(NCc2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCCO)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2c[nH]c3ccccc23)c1
Cc1ccccc1Nc1ncc(-c2cnn(C3CCOCC3)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccn2nccc12
Cc1ccccc1Nc1ncc(-c2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C3CCNCC3)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)N1CCOc2ccccc21
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1csc2ccccc12
COc1cc(F)cc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)c1
Cc1cc(F)cc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc(F)cc(Br)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc(F)cc(Cl)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccnc2c1ccn2C
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc(Br)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2c1cnn2C
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc(F)cc(F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(F)c(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc2cc[nH]c2c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(Cl)c(Cl)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2ccncc12
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(C#N)cc1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccccc1C(F)(F)F
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc2[nH]ncc2c1
Cc1ccc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)cc1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccccc1OC(F)(F)F
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2nn(C)cc12
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2ccccc12
CC(=O)Nc1ccc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)cc1
Cc1cccc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc(C#N)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(C(F)(F)F)cc1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc(S(C)(=O)=O)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2cnccc12
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc(N(C)C)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2cn(C)nc12
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(OC(F)(F)F)cc1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(S(C)(=O)=O)cc1
COc1cccc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cccc2cccnc12
COc1ccc(C(=O)Nc2cc(-c3cnn(C)c3)cnc2Nc2ccccc2C)cc1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccccc1C
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccccc1S(C)(=O)=O
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccc(S(N)(=O)=O)cc1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1ccccc1O
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc2ccccc2s1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1cc2ccccc2n1C
O=C(Nc1cccnc1NCc1ccccc1)c1csc2ccccc12
COCCNc1ncccc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(cc1NC(=O)c1csc2ccccc12)C(=O)NCc1ccnn1C
Cc1ccccc1Nc1ncc(cc1NC(=O)c1csc2ccccc12)C(=O)NC1CS(=O)(=O)C1
Cc1ccccc1Nc1ncc(C(=O)NCC2CS(=O)(=O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(cc1NC(=O)c1csc2ccccc12)C(=O)NCc1nccs1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nsc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2ccccc2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)[C@H](N)C2CCCCC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(F)c2)c1
CNC(=O)c1cnc(C2CCCc3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1csc2ccc(Cl)cc12
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NC(=O)c1csc2ccc(F)cc12
Cc1ccccc1Nc1ncc(-c2cnn(CCO)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
COCCn1cc(-c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)cn1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccc(Cl)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccc(F)cc23)c1
CC(C)(C)OC(=O)N1CCC(Nc2ncccc2NC(=O)c2csc3ccccc23)CC1
O=C(Nc1cccnc1NC1CCNCC1)c1csc2ccccc12
O=C(Nc1cccnc1NC1CCCCC1)c1csc2ccccc12
Cc1ccccc1Nc1ncc(NC(=O)CC#N)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(NCC#N)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccnc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nn(C)c3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)[C@@H](N)C2CCCCC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3ccc(C)cc3)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cc(F)cc(F)c2)c1
CCC(C(=O)Nc1cc(C(=O)NC)cnc1Nc1ccccc1C)c1ccccc1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCN(C(C)=O)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2c(F)ccc(F)c2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)[C@@H]2C[C@H]2c2ccccc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C(c2ccccc2)C(C)C)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cn(C)c3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(N(C)C(=O)C2CCc3ccccc3C2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)[C@@H](OC)c2ccccc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CC2CCc3ccccc32)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)[C@]23C[C@H]4C[C@H](C[C@H](C4)C2)C3)c1
Cc1ccccc1Nc1ncc(-c2cnn(C)c2)cc1NS(=O)(=O)c1ccccc1
CNC(=O)c1cnc(Nc2cccnc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccc(OC)cc2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2n[nH]c3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc3ccccc3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1cc(F)cc(c1)C(F)(F)F)C(=O)NCc1ccn(C)n1
Cc1ccccc1Nc1ncc(NCC(=O)O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
O=C(NC1CS(=O)(=O)C1)c1cnc(N2CCCc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
O=C(NCc1nccs1)c1cnc(N2CCCc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3ccccc3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3ncccc3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3ccccc3cn2)c1
CNC(=O)c1cnc(NCc2nccn2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(NCC(N)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nc(SC)ncc2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C3CC3)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2(O)CCCCC2)cc1NC(=O)c1csc2ccccc12
COCCNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1csc2ccccc12)C(=O)NCc1ccc(Cl)cc1
Cc1ccccc1Nc1ncc(C(=O)NC2COC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2cccnc2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)Nc2cc[nH]c(=O)n2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2CCCO2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC(F)(F)F)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC(C)c2ccccc2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2CCOCC2)cc1NC(=O)c1csc2ccccc12
COc1cncc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)c1
CNC(=O)c1cnc(Nc2ccnc(C)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccc(C)nc2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(N2CC3CCCN3CC2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)N1CC[C@H](Nc2ccccc2C)[C@H](C(=O)Nc2cc(F)cc(C(F)(F)F)c2)C1
CNC(=O)c1cnc(N)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3c(n2)CCCN3)c1
COC(=O)c1cnc(Nc2ccc(C)cc2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn(C)c3ccccc23)c1
O=C(Nc1cc(C(=O)NC2CS(=O)(=O)C2)cnc1N1CCCc2ccccc21)c1cc(F)cc(C(F)(F)F)c1
O=C(NCc1nccs1)c1cnc(N2CCCc3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cn1nccc1CNC(=O)c1cnc(N2CCCc3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1cc(F)cc(c1)C(F)(F)F)C(=O)NCC1CC(F)(F)C1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1cc(F)cc(c1)C(F)(F)F)C(=O)NC1CC(F)(F)C1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc(Cl)c2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2CN)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(N2C(=O)NCc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
CC1CCc2ccccc2N1c1ncc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1csc2ccccc12
CC1CCc2ccccc2N1c1ncc(C(=O)NCc2nccs2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(N2c3ccccc3CCC2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(=O)NCCS(C)(=O)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1cnccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1cnccc1NC(=O)c1csc2ccccc12
Cc1ccc(Nc2ncc(C(=O)NC3CS(=O)(=O)C3)cc2NC(=O)c2csc3ccccc23)cc1
Cc1ccc(Nc2ncc(C(=O)NCc3ccn(C)n3)cc2NC(=O)c2csc3ccccc23)cc1
Cc1ccc(Nc2ncc(C(=O)NCc3cnn(C)c3)cc2NC(=O)c2csc3ccccc23)cc1
Cc1ccc(Nc2ncc(C(=O)NCc3nccs3)cc2NC(=O)c2csc3ccccc23)cc1
CNC(=O)c1cnc(Nc2ccc(C)cc2)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1N[C@H]1CCN(C(=O)C2(O)CC2)C[C@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1N[C@H]1CCN(C(=O)C2(O)CC2)C[C@@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
CNC(=O)N1CC[C@H](Nc2ccccc2C)C(C(=O)Nc2cc(F)cc(C(F)(F)F)c2)C1
Cc1ccccc1Nc1ncc(C(=O)Nc2cc[nH]n2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1cc(NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)n[nH]1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nccc3ccccc23)c1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1cc(F)cc(c1)C(F)(F)F)C(=O)Nc1ccncc1
Cc1ccccc1Nc1ncc(C(=O)Nc2ccn(C)n2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(F)c3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3cnccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3ccncc23)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2cccnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2ccnnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc(C(F)(F)F)n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc(C)n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc(N)n2)c1
CNC(=O)c1cnc(N2CCNc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
O=C(NC1CS(=O)(=O)C1)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CCCS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CCS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CC(F)(F)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2cccc(F)c2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cccnc2)c1
Cc1ccccc1N[C@H]1CCN(C(=O)CC2CCOCC2)C[C@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1N[C@H]1CCN(C2CCC2)C[C@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(N2C[C@H]3C[C@H]3c3ccccc32)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1N[C@H]1CCN(C(=O)CC2CCOCC2)C[C@@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
O=C(NC1CS(=O)(=O)C1)c1cnc(N2C[C@H]3C[C@H]3c3ccccc32)c(NC(=O)c2csc3ccccc23)c1
O=C(NC1(c2cccnc2)CC1)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
C[C@@H](NC(=O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1cccnc1
C[C@H](NC(=O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1cccnc1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCOc3ccccc32)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCSc3ccccc32)c1
Cc1ccc(Nc2ncc(C(=O)NCc3ccnn3C)cc2NC(=O)c2csc3ccccc23)cc1
Cc1ccccc1Nc1ncc(C(=O)Nc2ccncn2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccc(NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)nc1
Cc1cnnc(NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2cncnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(Nc2nnc3c(C(F)(F)F)cccn23)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CC3(COC3)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(N2CCNCC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ncccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(N2CCN(C(=O)OC(C)(C)C)CC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
COCCn1cc(NC(=O)c2csc3ccccc23)c(N2CCOc3ccccc32)cc1=O
Cn1cc(NC(=O)c2csc3ccccc23)c(N2CCOc3ccccc32)cc1=O
Cn1cc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(N2CCOc3ccccc32)cc1=O
Cc1ccccc1Nc1ncc(C(=O)NC2CC(O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CCC(O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CCC(O)CC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
O=C(NC1CS(=O)(=O)C1)c1cnc(N2CCCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
C[C@@H](NC(=O)c1cnc(N2CCCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1cccnc1
Cc1ccccc1Nc1cc(=O)n(Cc2ccccc2C#N)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1cc(=O)n(C)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(N2CCNCc3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(N2CCC(C)c3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ncccc23)c1
CCn1cccc(C(=O)Nc2cc(C(=O)NC)cnc2Nc2ccccc2C)c1=O
CNC(=O)c1cnc(Nc2ccc(F)cc2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(N)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(Cl)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CCOc1ccccc1Nc1ncc(C(=O)NC)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cn(C)nc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(Cl)c2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ncco2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(C(F)(F)F)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(C)c2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccc(C#N)cc2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(F)c2F)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(C(C)(C)C)c2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C(C)C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2nccs2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2F)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2nc(C)c(C)s2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(F)c2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc(F)c2OC)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2nc(C)cs2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2nn(C)cc2Br)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2ccccc2S(C)(=O)=O)c1
Cc1ccccc1Nc1ncc(CNS(=O)(=O)c2ccccc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1cc(=O)[nH]cc1NC(=O)c1csc2ccccc12
COC(=O)Cn1cc(NC(=O)c2csc3ccccc23)c(Nc2ccccc2C)cc1=O
Cc1ccccc1Nc1cc(=O)n(CC(=O)O)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CS(=O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(OC(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C#N)c2)c1
C[C@@H](NC(=O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1ccncc1
C[C@H](NC(=O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1ccncc1
O=C(NCCN1CCOCC1)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
C[C@]1(O)C[C@@H](NC(=O)c2cnc(N3CCOc4ccccc43)c(NC(=O)c3csc4ccccc34)c2)C1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(-c3ccccc3)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc3cccnc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc3ccccc23)c1
O=C(Nc1cccc(=O)n1Cc1ccccc1)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c3ccccc3c2)c1
CNC(=O)c1cnc(NCc2cncn2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1NC(=O)c1cc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(Nc2ccccc2C)cn1
CNC(=O)c1cc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(N(C)c2ccccc2C)cn1
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CC(=O)N(C)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(Nc2cc(F)c3cn[nH]c3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2c(C)sc3ccccc23)c1
CC(=O)N1CC(NC(=O)c2cnc(N3CCOc4ccccc43)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)C1
Cc1ccccc1Nc1ncc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1nsc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CS(=O)C2)cc1NC(=O)c1nsc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CC(F)(F)C2)cc1NC(=O)c1nsc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3ccccn3)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3cccnc3)CC2)c1
CNC(=O)c1cnc(Nc2ncccc2C)c(NC(=O)c2csc3ccccc23)c1
CC1CN(c2ncc(C(=O)N[C@H](C)c3cccnc3)cc2NC(=O)c2csc3ccccc23)c2ccccc2O1
C[C@@H](NC(=O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1ccccn1
O=C(Nc1cc(C(=O)NC2CC(F)(F)C2)cnc1N1C(=O)NCc2ccccc21)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3cnccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3c2CCCC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3c2CCC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3ccccc3)CC2(F)F)c1
Cc1ccccc1Nc1cnc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ccncc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ccc(N2CCC(N)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cccc(OC)n2)c(NC(=O)c2csc3ccccc23)c1
O=C(NC1CC(F)(F)C1)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
C[C@H](NC(=O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1)c1ccccc1
CN1CC[C@H](NC(=O)c2cnc(N3CCOc4ccccc43)c(NC(=O)c3csc4ccccc34)c2)C1
Cc1ccccc1Nc1cc2nnc(N)n2cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(O)CO)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1nc2nncn2cc1NC(=O)c1csc2ccccc12
CCN(C(=O)C1=CSC2C=CC=CC12)c1nnc2cc(Nc3ccccc3C)c(N)cn12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3cc(C)ccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3cc(OC)ccc23)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1cncc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1cc2ccccc2o1
CNC(=O)c1cnc(NCCOC)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(NC2CCCCC2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(NC2CCCC2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NC2(C)CS(=O)(=O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2Cl)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1cc(=O)n(CC(=O)NCC2CC(F)(F)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(OC(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnccc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccnc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccnc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nc3ccccc3n(C)c2=O)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)n(C(F)F)n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2c[nH]c3cccc(OC)c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccnc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nccnc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cc(C)cc(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn3ccccc3n2)c1
CCn1nc(C(=O)Nc2cc(C(=O)NC)cnc2Nc2ccccc2C)c2ccccc21
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(C(F)(F)F)n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn3c(Cl)cccc3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(F)c(F)c2OC)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(C#N)n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn3c(C(F)(F)F)cccc3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CC2COc3ccccc3O2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(Cl)c(C#N)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2n[nH]c3c(F)cccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2cnccc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnn(C)c2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCNc3ccccc32)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CC2OCCc3ccccc32)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cncc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(S(N)(=O)=O)c2)c1
Cc1cc(Cn2cc(NC(=O)c3csc4ccccc34)c(Nc3ccccc3C)cc2=O)no1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(OC(F)(F)F)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc3[nH]ccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c3[nH]ncc3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c3cc[nH]c3c2)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@@H](O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
O=C(Nc1cc(C(=O)N[C@H]2C[C@H](O)C2)cnc1Nc1ccccc1)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@@H](O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CC(=O)N(Cc3ccccc3)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@H](O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2cccnc2OC)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2cccc(OC)c2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3c2CCOC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3c2CCC(C)(C)C3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3cc(F)cc(F)c23)c1
CNC(=O)c1cnc(Nc2ncccc2OC)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2coc3c(F)cc(F)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2OC)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2coc3ccc(Cl)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccc(OC)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(CNC2CS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=S)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncncc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc3c(Cl)cccn23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nc3ccccn3c2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc(O)cc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn(C)nc2C(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)c3ccccc3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)cc3cccnc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnn3cc(F)ccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3cc(C)[nH]c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn3c(F)cccc3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)cc3cc[nH]c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(Cl)ccnc3[nH]2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3cc(F)ccc3[nH]2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2n[nH]c3cccc(F)c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nc3ccccn3c2C)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C(C)n2ccccc2=O)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3cc[nH]c3cc2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnn3cccc(OC)c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3c(cnn3C)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C(F)(F)F)ccn2)c1
Cc1ccccc1CNc1cccc(=O)n1Cc1ccccc1C
Cc1ccccc1Nc1ncc(C(=O)NC2CC(=O)N(C)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CC(=O)N(C)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(N2CC(S(C)(=O)=O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2ccccc2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccnc3c(F)cccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nn(C)c(C3CC3)c2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(C)cccc3[nH]2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCCCC2(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3cccc(F)c3s2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccnc2CS(C)(=O)=O)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccnc3ccc(Br)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(Cl)c2C)c1
CC#CCC(C(=O)Nc1cc(C(=O)NC)cnc1Nc1ccccc1C)c1ccccc1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3c(c2)COC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(=O)[nH]c3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)n3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)nn2C(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc3cc(F)ccn23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(Cl)cncc3s2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3ccccc3c2Br)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(OC)c2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2n[nH]c3ccc(C#N)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3cccc(Cl)c3s2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nn(C(C)C)c3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc3ccccn23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2c[nH]c3ccc(F)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccn(C(F)F)c2=O)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Br)cc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(Cl)cccn3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2onc3c2CCCC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCCC3CCCCC32)c1
CCc1c(Cl)c(C(=O)Nc2cc(C(=O)NC)cnc2Nc2ccccc2C)nn1C
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(C#N)c2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2c[nH]c3cc(F)c(F)cc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnn3cccc(Br)c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc3ccc(F)cn23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)cc3cccnc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C(C)Cc2ccc(F)cc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nn(C)c3c2CCC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn[nH]c2-c2ccc(F)cc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3c2OC(C)(C)CC3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3cccc(F)c3)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Br)cc(C(C)C)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCc3cccc(Cl)c32)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)cc(OC)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(F)c(C)c2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn(C)c3ncccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3ccc(F)c(F)c3)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CC(C)Oc2ccccc2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2coc3cccc(Br)c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(C(F)F)cn2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(Br)cccc3[nH]2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(Br)cccn3c2)c1
Cc1ccccc1Nc1ncc(C(=O)NC2CCOc3ccccc32)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3cc(F)ccc3o2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)c(F)c(C)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3occ(Cl)c3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)cc(F)c2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ncsc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCC(F)(F)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3ccoc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)ccc2OC(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2cccnn2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2cc(F)ccc2Br)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3ccccc3Cl)CC2)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2cnn3cccc(F)c23)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cccc(Br)c2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2ccc(F)cc2C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3cccc(Br)c3)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3c(c2)CCN3C)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3ccccc3n2C)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc3c(Cl)cc(Cl)cc3[nH]2)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2cn(C)cn2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cn3cccc(Br)c3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Br)cc3c2cnn3C)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2(C#N)CCCC2)cc1NC(=O)c1csc2ccccc12
CCOc1c(F)c(F)cc(C(=O)Nc2cc(C(=O)NC)cnc2Nc2ccccc2C)c1F
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2(c3cccc(Cl)c3)CC2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2c[nH]c3ccc(Cl)cc23)c1
COc1cnccc1CCNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(Br)c3cccnc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2cc(Cl)ccc2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3ccn(C)c23)c1
Cc1ccccc1Nc1ncc(C(=O)NCC(F)F)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2n[nH]c3ccc(Br)cc23)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2c3c(nn2C)CCC3)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2[nH]c3ccccc3c2Br)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3c(ccn3C)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(C(F)(F)F)n2C)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2cnccc2C(F)(F)F)cc1NC(=O)c1csc2ccccc12
COC[C@@H](C)NC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C#N)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2c[nH]c3cccc(Cl)c23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3c2OC(C)(C)C3)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3[nH]c(C(F)(F)F)nc23)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2CCC(F)(F)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2cnn(C(C)C)c2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CC(C#N)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2ccc3c(c2)OCCO3)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cnc(OC)c(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)N2CC(C)(F)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(Cl)c(C)c2F)c1
COc1ccnc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2ccc3cccnc3c2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2nc(C3CC3)no2)cc1NC(=O)c1csc2ccccc12
COC1CN(C(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)C1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2cc(Br)ccc2F)c1
Cc1ccccc1Nc1ncc(C(=O)N2CC(C)(C#N)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CCC(F)(F)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CCCOC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CC[C@@H](F)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CC[C@@H](F)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1c(NC(=O)c2csc3ccccc23)ccn(C)c1=O
COc1ccc(SC2(C(=O)O)CC(=O)NC2c2ccccc2C)cc1
CNC(=O)c1cnc(NCCC#N)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2csc3cncnc23)c1
Cc1ccccc1Nc1c(NC(=O)c2csc3ccccc23)ccc2cc[nH]c12
Cc1ccccc1Nc1nnccc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(N[C@@H]2CCOC2)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nc(Cl)cc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)cc(C#N)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cc3cccnc3cc2F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2ccc3ncccc3c2)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2C3CCC(C3)[C@H]2C(=O)O)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2ccon2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2cnc3c(C)cccn23)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2(O)CCCC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2CCN(C)C(=O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3nnc(Br)n3c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCC(C)(C)O)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(F)c2Cl)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(CO)c(F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NC2NC(=O)c3ccccc32)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2CCNC(=O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCCn2ccnn2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CCC(F)(F)C[C@@H]2O)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2ccncn2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)Nc2ncn(C)n2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CCN(C)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3ncc(Br)n3c2)c1
Cc1ccccc1Nc1ncc(C(=O)N2CC3(COC3)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc(COC)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCCn2nccn2)cc1NC(=O)c1csc2ccccc12
Cc1cncc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2(C#N)CC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2(C)CC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2nnc3ccccn23)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2(O)CCOC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2CCOCC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NC2COCC(O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2ncccn2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cc(Cl)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2CCC(O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CCC(C)(O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2COC[C@@H]2F)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)cc1NC(=O)c1csc2ccccc12
COCC(=O)N1CCC(NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)CC1
Cc1ccccc1Nc1ncc(C(=O)NCc2nccc3ccccc23)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CCO[C@@H]2C)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cc(Br)ccc2Cl)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CC[C@@H](O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC(=O)N2CCCC2)cc1NC(=O)c1csc2ccccc12
COc1cc(CCNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)ccn1
Cc1ccccc1Nc1ncc(C(=O)NCC2(O)CC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CC(C(=O)O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2cn(C)nc2C)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCc2cocn2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2(O)CCOCC2)cc1NC(=O)c1csc2ccccc12
Cc1cc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)no1
Cc1ccccc1Nc1ncc(C(=O)NC(C)c2cn[nH]c2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)Nc2ncnn2C)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CC(C)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2(S(C)(=O)=O)CCC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)Nc2ccc3cn(C)nc3c2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC(O)C2CCCC2)cc1NC(=O)c1csc2ccccc12
CCn1ccc(C)c(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)c1=O
Cc1ccccc1Nc1ncc(C(=O)NC2(C(N)=O)CC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CC(O)C2)cc1NC(=O)c1csc2ccccc12
Cc1cc(CC(C)NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)on1
COCC1CN(C(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)C1
Cc1ccccc1Nc1ncc(C(=O)NC(C)c2nnc3ccccn23)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CC[C@]3(CCC(=O)N3)CC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2COC[C@@H]2O)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2COc3ccccc3C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CC(C)(O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC2CCCOC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2CCOC2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CCC(F)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)Nc2cnn(C)c2)cc1NC(=O)c1csc2ccccc12
Cc1ccn2c(CNC(=O)c3cnc(Nc4ccccc4C)c(NC(=O)c4csc5ccccc45)c3)nnc2c1
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CC[C@@H](O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CCn3nccc32)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N2CC(CF)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)O)cc1NC(=O)c1csc2ccccc12
Nc1cc(C(=O)NC2CS(=O)(=O)C2)cnc1N1CCOc2ccccc21
O=C(O)c1cnc(N2CCOc3ccccc32)c(NC(=O)c2csc3ccccc23)c1
Nc1cc(C(=O)O)cnc1N1CCOc2ccccc21
CNC(=O)c1cnc(N2CCC[C@@H]3CCC[C@@H]32)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1cccnc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ncccc2Cl)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ncccc2Cl)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2nccnc2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(NCc2cncnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(NCCO)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
O=C(NC1CC(F)(F)C1)c1cnc(Nc2ccccc2Cl)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cccc3c2cnn3C)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2nc3cccc(C(F)(F)F)n3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)CCc2ccncc2C)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2onc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3cnccc3n2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cn2ccccc2=O)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccn3ccnc3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc3cnccc3c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)C2CCc3ccccc3O2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccnc(C(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2noc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)Cc2cnc3ccccn23)c1
CCOC(=O)[C@H]1CC[C@@H](NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)C1
CCOC(=O)[C@@H]1CC[C@@H](NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)C1
Cc1ccccc1Nc1ncc(C(=O)N(C)C2CS(=O)(=O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(NC2CC3(COC3)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1nccnc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccncc2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CC[C@H](C(=O)O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@@H]2CC[C@@H](C(=O)O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2cccc3c2CCO3)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc3c2OCC3)c(NC(=O)c2csc3ccccc23)c1
CSc1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CCCCC(CC)COC(=O)CCSc1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc3c2CCC3)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc3c2OCC3)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
Cc1ccccc1[C@H]1NC(=O)C[C@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1[C@H]1NC(=O)C[C@@H]1C(=O)Nc1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2noc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccn2)c(NC(=O)c2csc3ccccc23)c1
Nc1ncc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1csc2ccccc12
Nc1ncc(C(=O)O)cc1NC(=O)c1csc2ccccc12
COC(=O)c1cnc(N)c(NC(=O)c2csc3ccccc23)c1
Nc1ncc(C(=O)NC2CC(F)(F)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(N)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(F)c(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(OC)c(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cccc3ccn(C)c23)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(N(CCCS(C)(=O)=O)c2ccccc2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccc(C)cn2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2cccc3c2CCO3)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@H](C(=O)OC(C)(C)C)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@@H](C(=O)O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@H](C(=O)O)C2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2cccc(C)n2)c(NC(=O)c2csc3ccccc23)c1
CC1(NC(=O)c2cnc(N)c(NC(=O)c3csc4ccccc34)c2)CC1
Nc1ncc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)cc1NC(=O)c1csc2ccccc12
CC(NC(=O)c1cnc(N)c(NC(=O)c2csc3ccccc23)c1)c1cn[nH]c1
CC(NC(=O)c1cnc(N)c(NC(=O)c2csc3ccccc23)c1)c1nnc2ccccn12
CNC(=O)[C@H]1C[C@@H](NC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3csc4ccccc34)c2)C1
Cc1ccccc1Nc1ncc(C(=O)N[C@H]2C[C@@H](C(=O)N(C)C)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(F)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(Cl)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C(F)(F)F)ccc2F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2COC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2cocn2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2cccnc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2ccc(Cl)cc2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
COCCNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(F)c(Cl)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2(O)CC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2(C)CC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
COc1cncc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)c1
Cc1cncc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(C(F)(F)F)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(C#N)c(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)c(F)c(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(-c2ncc[nH]2)cc1NC(=O)c1csc2ccccc12
Cc1ccccc1Nc1ncc(C(=O)NCC(F)F)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1cc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)no1
Cc1ccccc1Nc1ncc(C(=O)NCC2CS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(C(F)(F)F)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(C)c(F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2ncccn2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
COc1ccnc(CNC(=O)c2cnc(Nc3ccccc3C)c(NC(=O)c3cc(F)cc(C(F)(F)F)c3)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(OC)c(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(F)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(C)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1
Cc1ccccc1Nc1ncc(S(N)(=O)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
O=C(NC1CS(=O)(=O)C1)c1cnc(N2CCOCC2)c(NC(=O)c2csc3ccccc23)c1
COC(=O)CCS(=O)(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cc(C)n(C)n2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2nccc3[nH]ccc23)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2cnccc2C)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ncccc2C(C)C)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2c3c(nn2C)CCCC3)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccc3c(c2)COC3)c(NC(=O)c2csc3ccccc23)c1
CCc1nccnc1Nc1ncc(C(=O)NC)cc1NC(=O)c1csc2ccccc12
CCn1nccc1Nc1ncc(C(=O)NC)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2ccc3cnn(C)c3c2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccnc3c2ccn3C)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccc3c(c2)OCC3)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2cncc(F)c2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccc3cccnc3c2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2cncc3ccccc23)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ncccc2C2CC2)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2c3c(nn2C)CCC3)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccc3c(c2)N(C)C(=O)CO3)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(NC2CCOc3ccc(F)cc32)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2cn(C)nc2C)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1ccc(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)n1
Cc1ccccc1Nc1ncc(S(C)(=O)=O)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NCC2(C#N)CC2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(Cl)c(Cl)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2ccncn2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1ncc(C(=O)NC2(C)CS(=O)(=O)C2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(C#N)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(Cl)c(F)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2ccon2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(OC)c(Cl)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(F)c(F)c(OC)c2)c1
Cc1ccccc1Nc1ncc(C(=O)NCc2nnc3ccccn23)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)c(F)c(F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(OC)nc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(Cl)nc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2noc3ccc(Cl)cc23)c1
Cc1ccccc1Nc1ncc(C(=O)Nc2cnn(C)c2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
Cc1ccccc1Nc1c(NC(=O)c2csc3ccccc23)ccn2cnnc12
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2cc(C)nc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)c2coc3c(F)cc(Cl)cc23)c1
Cc1ccccc1Nc1ncc(-c2ccn[nH]2)cc1NC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cccc3[nH]ccc23)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1cc(=O)n(CCc2ccncn2)cc1NC(=O)c1csc2ccccc12
CC1COCCN1c1ncc(C(=O)N[C@H]2C[C@@H](C(N)=O)C2)cc1NC(=O)c1csc2ccccc12
COC1CN(c2ncc(C(=O)N[C@H]3C[C@@H](C(C)=O)C3)cc2NC(=O)c2csc3ccccc23)C1
CNC(=O)c1cnc(Nn2nccc2C(F)(F)F)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cc(F)c(Nc2ccccc2C)c(NC(=O)c2csc3ccccc23)c1
Cc1ccccc1Nc1c(F)cc(C(=O)NC2CS(=O)(=O)C2)cc1NC(=O)c1csc2ccccc12
CNC(=O)c1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)c2csc3ccccc23)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(N(CC(N)=O)C(=O)c2csc3ccccc23)c1
COc1cncc(CNC(=O)c2cc(NC(=O)c3csc4ccccc34)n(CC3CCC3)c(=O)c2)c1
Nc1c2c(nn1C(=O)c1cc(F)cc(C(F)(F)F)c1)CCCC2
Cc1nn(C(=O)c2cc(F)cc(C(F)(F)F)c2)c(N)c1-c1ccccc1
Nc1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
O=C(Nc1cnccc1-n1cccn1)c1cc(F)cc(C(F)(F)F)c1
CC(C)(O)c1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CC(C)(O)c1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)c2nsc3ccccc23)c1
Nc1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)c2nsc3ccccc23)c1
O=C(NCc1ccccc1CN1CCCCC1)c1cc(F)cc(C(F)(F)F)c1
O=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1cc(F)cc(C(F)(F)F)c1
Cc1cccc(-n2nc(C)cc2NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
O=C(Nc1cc(C2CC2)nn1-c1ccccc1F)c1cc(F)cc(C(F)(F)F)c1
Cc1cc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)n(-c2ccccc2F)n1
COc1nccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1Nc1ccccc1Cl
Nc1cc(-c2ccc(F)cc2)nn1-c1nc2ccccc2[nH]1
N#Cc1cccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1Cc1ccccc1Cl
O=C(Nc1ccn2cnnc2c1Nc1ccccc1Cl)c1cc(F)cc(C(F)(F)F)c1
O=C(N[C@@H]1CCC[C@H]1N1CCCc2ccccc21)c1cc(F)cc(C(F)(F)F)c1
O=C(N[C@H]1CCC[C@H]1N1CCOc2ccccc21)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)N2CCc3ccccc32)c1
CNC(=O)c1cnc(Nc2ccccc2C)c(NC(=O)NC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c1
CNC(=O)c1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)NC23C[C@H]4C[C@@H](C2)C[C@@H](C3)C4)c1
O=C1C[C@@H](CNC(=O)c2cc(F)cc(C(F)(F)F)c2)[C@H](c2cc(F)ccc2Cl)N1
CNC(=O)c1ccc(Nc2cc(F)ccc2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)n1
O=C(Nc1cc(-c2cnn(C(F)F)c2)cnc1Nc1cc(F)ccc1Cl)c1cc(F)cc(C(F)(F)F)c1
O=C(Nc1cc(-c2ccc3ncnn3c2)cnc1Nc1cc(F)ccc1Cl)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cc(F)ccc2Cl)c(Nc2nccc3c(Cl)cccc23)c1
O=C(Nc1ccnn1-c1ccccc1)c1cc(F)cc(C(F)(F)F)c1
O=C(Nc1cccc(=O)n1Cc1ccccc1Cl)c1csc2ccccc12
Cc1ccccc1[C@@H]1Nc2ccccc2[C@H]1CNC(=O)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(Nc2cc(CO)ccc2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(Nc2cc(F)ccc2Cl)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
O=C(Nc1cc(-c2ccc3ncnn3c2)cnc1Nc1cc(CO)ccc1Cl)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1cnc(N[C@@H]2CCCC[C@@H]2CO)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
CNC(=O)c1cnc(NC(CO)CCO)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
O=C1CCCC(c2nc3c(F)cc(C(F)(F)F)cc3[nH]2)N1Cc1cc(F)ccc1Cl
O=C(Nc1cc(-c2ccc3ncnn3c2)cnc1N[C@H]1CCCC[C@@H]1CO)c1cc(F)cc(C(F)(F)F)c1
O=C(Nc1cc(-c2ccc3ncnn3c2)cnc1N[C@H]1CCCC[C@H]1CO)c1cc(F)cc(C(F)(F)F)c1
O=C(Nc1cc(-c2ccc3ncnn3c2)cnc1NC(CO)CCO)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)c1ccc(N2CCCCC2CCO)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
O=C1NCc2ccccc2C1c1ccccc1-c1nc2c(F)cc(C(F)(F)F)cc2[nH]1
O=C1C[C@H](CCO)[C@@H](CNC(=O)c2cc(F)cc(C(F)(F)F)c2)[C@H](c2cc(F)ccc2Cl)N1
CNC(=O)c1cnc(-n2c(=O)ccc3ccccc32)c(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1
O=C(N[C@@H]1CCC[C@H](O)[C@H]1c1cc(F)ccc1Cl)c1cc(F)cc(C(F)(F)F)c1
O=C(N[C@@H]1CCC[C@@H](O)[C@H]1c1cc(F)ccc1Cl)c1cc(F)cc(C(F)(F)F)c1
CNC(=O)CN1CC(=O)N[C@H](c2cc(F)ccc2Cl)[C@H]1C(=O)NC1CCCC(C(F)(F)F)C1
O=C1CN[C@H](C(=O)NC2CCCC(C(F)(F)F)C2)[C@@H](c2cc(F)ccc2Cl)N1
CNC(=O)c1cc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(Nc2cc(F)ccc2Cl)s1
Cc1ccccc1Nc1nc2ccccc2cc1NC(=O)N1CC(O)c2ccccc21
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCC(Nc2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5ccc(F)cc5F)c4)nc23)CC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(C)(=O)=O)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)[C@@H](C)C1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)[C@@H](C)C1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/n5ccnn5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/CN(C)C)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=CC(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)C2)C1
COc1ncc(-c2ccc3ncnc(N4CCC5(CN(C(=O)/C=C/C(C)=O)C5)C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=CC(=O)N1C[C@H](C)N(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)C[C@H]1C
COc1ncc(-c2ccc3ncnc(N4C[C@@H](C)N(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/CF)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CCCC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)CC2)C1
C=C(F)C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)CC2)C1
COc5ncc(c4ccc3ncnc(N1CCC2(CC1)CN(C(=O)/C=C/C(C)=O)C2)c3c4)cc5NS(=O)(=O)c6ccc(F)cc6F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccccc5)c4)cc23)CC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)C5CCCCC5)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)C1CCCCC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cncc(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cncc(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2nc(C)nc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2nc(N)nc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2nc(C#N)nc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2nc(O)nc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5ccc(Cl)s5)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5ccc(Cl)s5)c4)cc23)CC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(Cl)s5)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(Cl)s1
C=CC(=O)N1CCN(c2ncnc3c2CN(c2cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c2)CC3)CC1
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(C(C)(C)C(F)(F)F)c1
COc1ncc(-c2ccc3ncnc(N4CCC5(CN(C(=O)/C=C/C(C)=O)C5)C4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(F)(F)F)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)[C@@H](C)C1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=C(F)C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6c(F)cccc6F)c5)cc34)CC2)C1
C=C(F)C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6c(F)cccc6F)c5)cc34)C2)C1
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=CC(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6c(F)cccc6F)c5)cc34)CC2)C1
COc1ncc(-c2ccc3ncnc(N4C[C@@H](C)N(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=C(F)C(=O)N1C[C@H](C)N(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)C[C@H]1C
C=CC(=O)N1C[C@H](C)N(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)C[C@H]1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)C5=CC(=O)CCC5)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=CC(=O)N1CC(N2CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)CC2)C1
COc1ncc(-c2ccc3ncnc(N4CCN(C5CN(C(=O)/C=C/C(C)=O)C5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=C(F)C(=O)N1CC(N2CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)CC2)C1
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cncc(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=C(F)C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)C2)C1
COc1ncc(-c2ccc3ncnc(N4CCC5(CN(C(=O)/C=C/n6ccnn6)C5)C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/c5ncco5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=C(C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1)C(C)C
COC/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=C(COC)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=C(OC)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=C(F)C(=O)N1C[C@H](C)N(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)C[C@H]1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)c5cccc(O)c5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCC5(CC=CC5=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCC5(CC=CC5=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)C5=CC(=O)CCC5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)C5=CC(=O)CCC5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(Cl)s1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)C5=CC(=O)CC5)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)CCS(C)(=O)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/P(C)(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C(F)=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(N(C)S(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(N(C)S(=O)(=O)c5c(F)cccc5F)c4)cc23)CC1
CCc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)CC1
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(Cl)c(NS(=O)(=O)c6c(F)cccc6F)c5)cc34)C2)C1
CC(=O)/C=C/C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(Cl)c(NS(=O)(=O)c6c(F)cccc6F)c5)cc34)CC2)C1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)[C@@H](C)C1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(Cl)c(NS(=O)(=O)c5c(F)cc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1cccc(F)c1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccccc1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1cc(F)ccc1F
COc1ccc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CCc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1cccc2cccc(Cl)c12
COc1ncc(-c2ccc3ncnc(N4CCC5(CN(C(=O)/C=C/C(C)=O)C5)C4)c3c2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cncc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccncc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1cc(Cl)cn1C
CNc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC5CCCC5)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC5CCCC5)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC5CCCC5)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
CCOc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC5CC5)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(C)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)[C@@H](CC#N)C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)C[C@@H]1CC#N
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)C[C@@H]1CC#N
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)C[C@@H]1CC#N
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)[C@@H](CC#N)C4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)cc23)C[C@@H]1CC#N
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cn1
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cn5)c4)cc23)CC1
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cn5)c4)cc23)CC1
COc1c(F)cc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cn1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1C#N
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(C#N)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(C)cc1F
C=C1CCN(C2CN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6ccc(F)cc6F)c5)cc34)C2)C1=O
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NCc5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)C5OC5C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)Nc1ccc(F)cc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(O)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(NC4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccccc1F
C=C(F)C(=O)N1CC2(CCN(c3ncnc4ccc(-c5cnc(OC)c(NS(=O)(=O)c6c(F)cc(F)cc6F)c5)cc34)CC2)C1
COc1ncc(-c2ccc3ncnc(N4CC5(CN(C(=O)/C=C/C(C)=O)C5)C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CC5CC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4C5CCC4CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
C=C(F)C(=O)N1C2CCC1CN(c1ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc13)C2
C=CC(=O)N1CCC(Nc2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)C1
COc1ncc(-c2ccc3ncnc(NC4CCN(C(=O)/C=C/C(C)=O)C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
C=C(F)C(=O)N1C2CCC1CN(c1ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cc(F)cc5F)c4)cc13)C2
COc1ncc(-c2ccc3ncnc(N4CC5CN(C(=O)/C=C/C(C)=O)CC5C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CC5CCC4CN5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OCC(F)(F)F)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1c(F)cncc1F
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1c(F)cncc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1c(F)cncc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ncc(Cl)s1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1S(=O)(=O)Nc1ccc(F)cc1F
C=C(C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1)C(C)O
C=C(C(C)=O)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1Cl
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(C)(=O)=O
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1Cl
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccncc1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1Cl
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1Cl
COc1ncc(-c2ccc3ncnc(N4CC5CCC(C4)N5C(=O)/C=C/C(C)=O)c3c2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(Cl)cc1F
COc1ncc(-c2ccc3ncnc(N4CCC5(CC4)CN(C(=O)/C=C/C(C)=O)C5)c3c2)cc1NS(=O)(=O)c1sc(C)nc1C
CNC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C(C#N)=C/C(C)(C)C)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COC(=O)c1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CSc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(CO)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ccc(Cl)c(S(=O)(=O)Nc2cc(-c3ccc4ncnc(N5CCN(C(=O)/C=C/C(C)=O)CC5)c4c3)cnc2OC)c1
COc1ccc(S(=O)(=O)Nc2cc(-c3ccc4ncnc(N5CCN(C(=O)/C=C/C(C)=O)CC5)c4c3)cnc2OC)c(F)c1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(C)cccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)c2ccccc12
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(C)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
N#Cc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CCOc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccccc1F
[2H]C([2H])([2H])Oc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(C(F)(F)F)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4[C@H](C)CN(C(=O)/C=C/C(C)=O)C[C@@H]4C)c3c2)cc1NS(=O)(=O)c1ccccc1F
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(C4=CNC(OC(F)(F)F)C(NS(=O)(=O)c5ccc(F)cc5F)=C4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(N(C)C)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(C4=CNC(OC(F)(F)F)C(NS(=O)(=O)c5ccc(F)cc5F)=C4)cc23)CC1
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1Cl
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1c(F)cccc1Cl
C=CS(=O)(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC(F)F)c(NS(=O)(=O)c5ccc(F)cc5F)c4)cc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(C(=O)O)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cncc1F
C=C(F)C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)nc23)CC1
CCC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)nc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/CF)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1F
C=CC(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)nc23)CC1
COC/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC)c(NS(=O)(=O)c5c(F)cccc5F)c4)nc23)CC1
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(F)(F)F)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1cc(F)ccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1cccc(F)c1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccncc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1cnccc1C
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(Cl)cncc1Cl
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1Cl
CC(=O)/C=C/C(=O)N1CCN(c2ncnc3ccc(-c4cnc(OC(F)(F)F)c(NS(=O)(=O)c5ccc(F)cc5F)c4)nc23)CC1
CCOc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)[C@H](C)C4)c3n2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(C)cccc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1Cl
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1sc(C)nc1C
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccccc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4=CCN(C(=O)/C=C/C(C)=O)CC4)c3n2)cc1NS(=O)(=O)c1c(F)cccc1Cl
COc1ncc(-c2cc3c(N4CCN(C(=O)/C=C/C(C)=O)CC4)ncnc3cc2C)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(C(F)(F)F)c3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
[2H]C([2H])([2H])n1cc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc(NS(=O)(=O)c2ccc(F)cc2F)c1=O
COc1ncc(-c2cc3c(N4CCN(C(=O)/C=C/C(C)=O)CC4)ncnc3cn2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(N4CCN(C(=O)/C=C/C(C)=O)CC4)c3c2)cc1SS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2ccc3ncnc(C4CCN(C(=O)/C=C/C(C)=O)C4)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc4ncc(c3ccc2ncnc(N1CCN(C(=O)/C=C/C(=O)C(F)(F)F)CC1)c2c3)cc4NS(=O)(=O)c5ccc(F)cc5F
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(I)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc23)cc2cccc(C)c2c1=O |(7.35,-15.23,;6.01,-14.47,;4.69,-15.24,;3.34,-14.47,;3.34,-12.93,;4.67,-12.16,;6.01,-12.93,;7.34,-12.16,;7.34,-10.62,;6,-9.85,;6,-8.31,;7.41,-7.69,;7.26,-6.16,;8.4,-5.13,;9.87,-5.61,;11.02,-4.59,;12.48,-5.07,;10.7,-3.08,;9.23,-2.6,;8.91,-1.09,;8.09,-3.63,;5.76,-5.83,;5,-4.5,;5.78,-3.17,;3.45,-4.48,;2.68,-5.82,;3.43,-7.17,;4.97,-7.16,;8.67,-9.84,;10,-10.62,;11.32,-9.85,;12.65,-10.61,;12.66,-12.15,;11.32,-12.92,;11.32,-14.46,;10,-12.15,;8.67,-12.92,;8.67,-14.46,)|
Cc1cccc2cc(Cn3nc(C#CCO)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc(F)c(O)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(C#CCO)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(C#CC3CC3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccnc1-n1c(Cn2nc(I)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccnc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccnc1-n1c(Cn2nc(Br)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccnc1-n1c(Cn2nc(Cl)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(Br)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(Cl)c3c(N)ncnc32)cc2cccc(C)c2c1=O
COc1cc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3C)c3ncnc(N)c23)ccc1Cl
COc1cc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3F)c3ncnc(N)c23)ccc1Cl
Cc1ccccc1-n1c(Cn2nc(-c3ccc(Cl)c(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4ccc(Cl)c(O)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(Cl)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4ccc(O)c(Cl)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)cc3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc(O)c(F)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(I)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1ccccc1-n1c(Cn2nc(C#C[C@@H](C)O)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1cccc2cc(Cn3nc(Cl)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(Cn3nc(Br)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)cc3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(C#C[C@@H](C)O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3cccc(Cl)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cccc(F)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3cccc(F)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(I)c3c(N)ncnc32)cc2cccc(F)c2c1=O
Cc1ccccc1-n1c(Cn2nc(C#C[C@@H](C)O)c3c(N)ncnc32)cc2cccc(F)c2c1=O
COc1ccc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3C)c3ncnc(N)c23)cc1OC
COc1ccc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3C)c3ncnc(N)c23)cc1
Cc1cccc2cc(Cn3nc(-c4ccc(O)cc4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
COc1ccc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3F)c3ncnc(N)c23)cc1OC
Cc1ccccc1-n1c(Cn2nc(-c3cnc4[nH]ccc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc(Cl)cc3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc4cc[nH]c4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc(Cl)c(O)c3)c3c(N)ncnc32)cc2ccccc2c1=O
CC(=O)Nc7nc6ccc(c4nn(Cc2cc1cccc(C)c1c(=O)n2c3ccccc3C)c5ncnc(N)c45)cc6s7
Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc32)cc2cccc(F)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)ncnc32)cc2cccc(F)c2c1=O
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(C3CCCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(C3CCCC3)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc32)cc2cccc(F)c2c1=O
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(C(C)C)c(=O)c12
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(C(C)C)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(C(C)C)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(C3CCCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc(F)c(O)c4)c4c(N)ncnc43)n(C3CCCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(C3CCCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(C(C)C)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc(F)c(O)c4)c4c(N)ncnc43)n(C(C)C)c(=O)c12
Cc1cccnc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccnc1-n1c(Cn2nc(C#C[C@@H](C)O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
COc1ccccc1-n1c(Cn2nc(I)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4ccc(Cl)c(O)c4)c4c(N)ncnc43)n(C3CCCC3)c(=O)c12
Cc1cccnc1-n1c(Cn2nc(-c3ccc(Cl)c(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccnc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
COc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(-c3ccccc3O)c(=O)c12
COc1ccccc1-n1c(Cn2nc(C#C[C@@H](C)O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(-c3ccccc3O)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(-c3ccccc3C(C)C)c(=O)c12
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(-c3ccccc3C(C)C)c(=O)c12
COc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(C#C[C@H](C)O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(C3CC3)c(=O)c12
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(C3CCCCC3)c(=O)c12
CCc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
CCc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(-c3ccccc3O)c(=O)c12
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(-c3ccccc3O)c(=O)c12
Cc1cccnc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(-c3ccccc3C(C)C)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(-c3ccccc3Cl)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(-c3ccccc3Cl)c(=O)c12
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(-c3ccccc3Cl)c(=O)c12
CCc1ccccc1-n1c(Cn2nc(C#C[C@@H](C)O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(C3CC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(C3CC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(C3CC3)c(=O)c12
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(-c3ccccc3OCCN3CCOCC3)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(I)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(C3CCC3)c(=O)c12
COc1cccc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3C)c3ncnc(N)c23)c1
Cc1cccc2cc(Cn3nc(I)c4c(N)ncnc43)n(C)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(-c3ccccc3OCCN3CCOCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(-c3ccccc3OCCN3CCOCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(C3CCCCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(C3CCCCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(C#C[C@@H](C)O)c4c(N)ncnc43)n(C3CCCCC3)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)nccc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(C3CCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(C3CCC3)c(=O)c12
Nc1ncnc2c1c(-c1cc(O)cc(F)c1)nn2Cc1cc2cccc(Cl)c2c(=O)n1C1CC1
Cc1ccccc1-n1c(Cn2nc(-c3ccc4nc(N)sc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cc(O)cc(F)c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
CNC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)cc2s1
Cc1ccccc1-n1c(Cn2nc(-c3ccc4nc(N)ccc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc4nc(N)ncc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc4oc(N)nc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(-c3ccc4ncnc(N)c4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4C)c4ncnc(N)c34)cc2s1
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4C(C)C)c4ncnc(N)c34)cc2s1
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4C4CC4)c4ncnc(N)c34)cc2s1
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(Cl)c5c(=O)n4C4CC4)c4ncnc(N)c34)cc2s1
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(Cl)c5c(=O)n4C(C)C)c4ncnc(N)c34)cc2s1
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(F)c5c(=O)n4C(C)C)c4ncnc(N)c34)cc2s1
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4C4CCC4)c4ncnc(N)c34)cc2s1
Cc1ccccc1-n1c(Cn2nc(-c3cn[nH]c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cn[nH]c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cnn(CCO)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3cnn(CCO)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cnn(C)c4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3cnn(C)c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cn[nH]c4)c4c(N)ncnc43)n(-c3cccc(F)c3)c(=O)c12
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(-c3ccccc3F)c(=O)c12
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5ccccc5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)cc2s1
N#Cc1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2F)c2ncnc(N)c12
N#Cc1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2C)c2ncnc(N)c12
Cc1cccc2cc(Cn3nc(/C=C4/SC(=O)NC4=O)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(Cn3nc(/C=C4/CCNC4=O)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(/C=C3/SC(=O)NC3=O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(/C=C/C(N)=O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(CCC(N)=O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
CCn1c(Cn2nc(-c3ccc4nc(NC(C)=O)sc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4)c(C)c3CN)cc2s1
C=Cc1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2F)c2ncnc(N)c12
C=Cc1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2C)c2ncnc(N)c12
COc1cc(F)cc(-c2nn(Cc3cc4cccc(C)c4c(=O)n3-c3ccccc3C)c3ncnc(N)c23)c1
Cc1ccccc1-n1c(Cn2nc(-c3ccn[nH]3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4ccn[nH]4)c4c(N)ncnc43)n(-c3ccccc3F)c(=O)c12
Cc1ccccc1-n1c(CN(C)c2ncnc3[nH]cnc23)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4cn[nH]c4)c4c(N)ncnc43)n(-c3ccccc3C(C)C)c(=O)c12
CCN(Cc1cc2cccc(C)c2c(=O)n1-c1ccccc1C)c1ncnc2[nH]cnc12
Cc1ccccc1-n1c(Cn2nc(-c3cn[nH]c3)c3c(N)ncnc32)cc2ccccc2c1=O
Cc1cccc2cc(Cn3nc(-c4cn[nH]c4)c4c(N)ncnc43)n(-c3ccccc3Cl)c(=O)c12
Nc1ncnc2c1c(-c1cn[nH]c1)nn2Cc1cc2cccc(F)c2c(=O)n1-c1ccccc1F
CCc1ccccc1-n1c(Cn2nc(-c3cn[nH]c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(C(C)Nc2ncnc3[nH]cnc23)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(/C=C/C(=O)N3CCOCC3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(CCC(=O)N3CCOCC3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1ccccc1-n1c(Cn2nc(CN3CCOCC3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc([C@@H](C)Nc3ncnc4[nH]cnc34)n(C3CCC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cnc34)n(C3CCC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc5oc(N)nc5c4)c4c(N)ncnc43)n(C3CC3)c(=O)c12
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1-c1ccccc1C
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(-c3ccccc3F)c(=O)c12
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(C3CC3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc5oc(N)nc5c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4cn[nH]c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
Cc1ccccc1-n1c(Cn2nc(-c3nn[nH]n3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4ccc5oc(N)nc5c4)c4c(N)ncnc43)n(C3CCC3)c(=O)c12
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(C(C)C)c(=O)c12
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(-c3ccccc3)c(=O)c12
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1-c1ccccc1
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1C1CCC1
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(-c3ccc(F)cc3)c(=O)c12
Cc5cccc6cc(Cn3nc(c1cn[nH]c1)c2c(N)ncnc23)n(c4ccccc4C(F)(F)F)c(=O)c56
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(C3CCC3)c(=O)c12
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(-c3c(F)cccc3F)c(=O)c12
Cc1cccc(C)c1-n1c(CNc2ncnc3[nH]cnc23)cc2cccc(C)c2c1=O
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1C(C)C
CC(Nc1ncnc2[nH]cnc12)c1cc2ccccc2c(=O)n1-c1ccccc1
CCC(Nc1ncnc2[nH]cnc12)c1cc2ccccc2c(=O)n1-c1ccccc1
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(-c3cc(F)cc(F)c3)c(=O)c12
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1-c1ccc(F)cc1
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1-c1cc(F)cc(F)c1
Cc1cccc2cc(C(C)Nc3ncnc4[nH]cnc34)n(C3CCN(C)CC3)c(=O)c12
CCC(Nc1ncnc2[nH]cnc12)c1cc2cccc(C)c2c(=O)n1C1CCN(C)CC1
Cc1cccc2cc(Cn3nc(-c4ccc5nc(N)oc5c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
CC(Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Cc1cccc2cc([C@H](C)Nc3ncnc4ccccc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc(Cn3nc(-c4ccc5nc(N)cn5c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
Cc1cccnc1-n1c(Cn2nc(-c3ccc4oc(N)nc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc([C@H](C)NC(=O)c3cnn4ccccc34)n(-c3ccccc3)c(=O)c12
Cc1nc2c(N[C@@H](C)c3cc4cccc(C)c4c(=O)n3-c3ccccc3)ncnc2[nH]1
Cc1ccccc1-n1c(Cn2nc(-c3ccc4nc(N)oc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc([C@H](C)Nc3nc(Cl)nc4[nH]cnc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(F)nc4[nH]cnc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3c(C#N)cnc4ccccc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]ccc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(Cl)ncc3Cl)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(N)ncc3Cl)n(-c3ccccc3)c(=O)c12
CNc1ncc(Cl)c(N[C@@H](C)c2cc3cccc(C)c3c(=O)n2-c2ccccc2)n1
CC(=O)Nc1nc2cc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)ccc2o1
Cc1cccc2cc(Cn3nc(-c4ccc5nc(N)sc5c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
CC(=O)Nc1nc2cc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4)c4ncnc(N)c34)ccc2o1
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(F)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]nc(C#N)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]nc(C(N)=O)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(Br)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]ncc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)NC3CCOCC3)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cnc34)n(-c3ccc(F)cc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]c(Cl)nc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(Cl)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]c(O)nc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(C#N)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]nc(Cl)c34)n(-c3ccccc3)c(=O)c12
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)cc2o1
Cc1cccc2cc([C@H](C)Nc3nc(N)ncc3Cl)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(Cl)nc4[nH]cnc34)n(C3CC3)c(=O)c12
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4)c4ncnc(N)c34)cc2o1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1C1CC1
Cc1cccc2cc([C@H](C)Nc3nc(N)ncc3F)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(Br)c34)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]ccc34)n(C3CC3)c(=O)c12
CC(=O)Nc1nc2cc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)ccc2s1
CC(=O)Nc1nc2cc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4)c4ncnc(N)c34)ccc2s1
Cc1ccccc1-n1c(Cn2nc(-c3ccc4sc(N)nc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
Cc1cccc2cc(Cn3nc(-c4ccc5sc(N)nc5c4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(F)c34)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(F)nc4[nH]cnc34)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]c(Cl)nc34)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(N)ncc3F)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(N)ncc3C(N)=O)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3cc(N)nc(Cl)n3)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3cc(N)nc(N)n3)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3cc(N)nc(Cl)n3)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3cc(N)nc(N)n3)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(C(N)=O)c34)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(C(N)=O)c34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cc(C#N)c34)n(C3CC3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]cnc34)n(-c3cccc(F)c3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]nc(C(N)=O)c34)n(C3CC3)c(=O)c12
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Cc1cccc2cc([C@H](C)Nc3ncnc4[nH]nc(Cl)c34)n(C3CC3)c(=O)c12
CCc1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2C)c2ncnc(N)c12
Cc1ccccc1-n1c(Cn2nc(-c3ccc4nc(N)[nH]c4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)cc2[nH]1
Cc1ccccc1-n1c(Cn2nc(C(N)=O)c3c(N)ncnc32)cc2cccc(C)c2c1=O
COC(=O)c1nn(CC2=Cc3cccc(C)c3C(=O)C2c2ccccc2C)c2ncnc(N)c12
Cc1ccccc1-n1c(Cn2nc(C(=O)NO)c3c(N)ncnc32)cc2cccc(C)c2c1=O
CC(=O)Nc1nc2ccc(-c3nn(Cc4cc5cccc(C)c5c(=O)n4-c4ccccc4)c4ncnc(N)c34)cc2[nH]1
Cc1cccc2cc(Cn3nc(C(F)F)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
CNC(=O)c1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2)c2ncnc(N)c12
Cc1ccccc1-n1c(Cn2nc(CO)c3c(N)ncnc32)cc2cccc(C)c2c1=O
COCc1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2C)c2ncnc(N)c12
Cc1cccc2cc(Cn3nc(C4=CCOCC4)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
C=C(C)c1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2)c2ncnc(N)c12
Cc1cccc2cc(Cn3nc(C(C)C)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc(Cn3nc(C(C)(C)O)c4c(N)ncnc43)n(-c3ccccc3)c(=O)c12
CC(=O)c1nn(Cc2cc3cccc(C)c3c(=O)n2-c2ccccc2)c2ncnc(N)c12
Cc1cccc2cc(C(C)Nc3nc(N)nc4[nH]cnc34)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc(C(C)Nc3nc(O)ncc3N)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc(C(C)Nc3nc(Cl)ncc3N)n(-c3ccccc3)c(=O)c12
Cc1cccc2cc([C@H](C)Nc3nc(N)nc4[nH]cnc34)n(-c3ccccc3)c(=O)c12
Cc3cccc4cc([C@H](C)Nc1nc(N)ncc1C(F)(F)F)n(c2ccccc2)c(=O)c34
Cc1cccc2cc([C@H](C)Nc3ncc(C(F)(F)F)c(N)n3)n(-c3ccccc3)c(=O)c12
C[C@@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1C1CC1
C[C@@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1cccc(F)c1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccc(F)cc1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(F)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(F)c2c(=O)n1-c1cccc(F)c1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(F)c2c(=O)n1-c1ccc(F)cc1
C[C@H](Nc1ncnc2[nH]c(Cl)nc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2[nH]c(O)nc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1nc(N)nc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Cc1ccccc1-n1c(Cn2nc(-c3cn[nH]c3)c3c(N)ncnc32)cc2cccc(Cl)c2c1=O
Nc1ncnc2c1c(-c1cn[nH]c1)nn2Cc1cc2cccc(Cl)c2c(=O)n1-c1ccccc1F
Nc1ncnc2c1c(-c1cn[nH]c1)nn2Cc1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Nc1ncnc2c1c(-c1cn[nH]c1)nn2Cc1cc2cccc(Cl)c2c(=O)n1-c1cccc(F)c1
C[C@H](Nc1ncnc2c1ncn2C)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
[2H]c1c([2H])c([2H])c(-n2c([C@H](C)Nc3ncnc4[nH]cnc34)cc3cccc(Cl)c3c2=O)c([2H])c1[2H]
C[C@H](Nc1ncnc2ccccc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2sccc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2ccsc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
[2H]c1nc(N[C@@H](C)c2cc3cccc(Cl)c3c(=O)n2-c2ccccc2)c2nc[nH]c2n1
C[C@H](Nc1nc(N)ncc1C(F)(F)F)c3cc2cccc(Cl)c2c(=O)n3c4ccccc4
Cc1cnc(N[C@@H](C)c2cc3cccc(Cl)c3c(=O)n2-c2ccccc2)nc1C
[2H]c1nc2c(N[C@@H](C)c3cc4cccc(Cl)c4c(=O)n3-c3ccccc3)ncnc2[nH]1
[2H]c1nc2c(N[C@@H](C)c3cc4cccc(C)c4c(=O)n3-c3ccccc3)ncnc2[nH]1
[2H]c1nc2c(N[C@@H](C)c3cc4cccc(Cl)c4c(=O)n3C3CC3)ncnc2[nH]1
C[C@H](Nc1ncnc2ncn(C)c12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Cc1csc2ncnc(N[C@@H](C)c3cc4cccc(Cl)c4c(=O)n3-c3ccccc3)c12
C[C@H](NC1CCOc2ccccc21)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
CNc4ncc(C(F)(F)F)c(N[C@@H](C)c2cc1cccc(Cl)c1c(=O)n2c3ccccc3)n4
C[C@H](Nc2nc(NC1CC1)ncc2C(F)(F)F)c4cc3cccc(Cl)c3c(=O)n4c5ccccc5
C[C@H](Nc1ncnc2ncccc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2ncccc2c(=O)n1-c1ccccc1
Cc1cnc(N)nc1N[C@@H](C)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1nc(N)nc2ccccc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
CNc1nc(N[C@@H](C)c2cc3cccc(Cl)c3c(=O)n2-c2ccccc2)c2ccccc2n1
[2H]c1nc(N[C@@H](C)c2cc3cccc(Cl)c3c(=O)n2-c2ccccc2)c2nc([2H])[nH]c2n1
C[C@H](Nc1ccnc(N)n1)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
CC(C)C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
CC(C)[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1cccc(Cl)c1
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(Cl)c2c(=O)n1-c1cccc(C(F)(F)F)c1
Cc1c(CN2CCN(C(=O)[C@H](C)O)CC2)sc2c(N3CCOCC3)nc(-c3cnc(N)nc3)nc12
CN(C)CCCOc1ccc(CN2CCC(CC2)n2cnc3c(nc(nc23)-c2cccc(CO)c2)N2CCOCC2)cc1
Cc1nc(NC(=O)N2CC[C@H]2C(N)=O)sc1-c1ccnc(n1)C(C)(C)C |r|
CNC(=O)[C@@H]1CCCN1C(=O)Nc1nc(C)c(s1)-c1ccnc(c1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(c1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CCCC2)sc1-c1ccnc(c1)C(C)(C)C
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(n1)C(C)(C)C |r|
Cc1c(sc(n1)NC(=O)N2CCC[C@H]2C(=O)N)c3ccnc(c3)C(C)(C)C(F)(F)F
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(n1)C1(C)CC1 |r|
CCN(CC)c1nccc(n1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(n1)C1CCC1 |r|
CC(C)c1cc(ncn1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(c1)C1(CC1)C#N |r|
CC(C)c1nccc(n1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
CC(C)(c1cc(ccn1)-c1cnc(NC(=O)N2CCC[C@H]2C(N)=O)s1)C(F)(F)F |r|
CC(C)(c1cc(ccn1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1Cl)C(F)(F)F |r|
COc1ccc(Oc2cc(C)c(-c3csc(NC(=O)c4ccnc(F)c4)n3)c(C)c2)cc1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2c1
Cn1c2cnc3ccccc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O
Cc1ccc(cc1)-n1c2c(cnc3ccc(cc23)-c2ccncc2)n(C)c1=O
COc1ccc(cc1)-n1c2c(cnc3ccc(cc23)-c2ccncc2)n(C)c1=O
Oc1ccc2cc(-c3nc4ccccc4s3)c(=O)oc2c1
COc1nc(ccc1-c1noc(n1)-c1ccncc1)-c1ccccc1
Clc1ccc2n(CCC(=O)Nc3ccccc3)c(=O)oc2c1
COC(=O)c1ccc(CSc2ncnc3sc(C)c(C)c23)o1
COc1cccc(c1)-c1nc(no1)-c1cc2cc(OC)ccc2[nH]c1=O
Cc1ccc2cc3c(OC(=O)COc4ccccc4)nn(C)c3nc2c1
COc1ccccc1-c1nc(no1)-c1cc2cc(C)ccc2[nH]c1=O
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O
Cn1ncc2c(Oc3ccc(cc3)S(C)(=O)=O)cc(nc12)-c1cccc2[nH]ncc12
CSc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(c2)C(C)(C)C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2Cl)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1
CN(C(=O)c1cc2CCOc3ccccc3-c2s1)c1ccccc1Cl
CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccc(cc1Cl)C(=O)N(C)C
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
COc1cc(N)cc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)c1nc2c3OCOc3ccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1ccc2n(c(nc2c1OC)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CN(C)C(=O)c1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)c1nc2c(cccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C#N
NC(=O)c1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CNC(=O)c1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COC(=O)c1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CN(C)c1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
OCc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
CNc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)Oc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Oc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CC(C)Oc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1
CS(=O)(=O)Oc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
CCCCOc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(cc(n1)N1CCOCC1)N1CCOCC1
Oc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1
COc1cc(cc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)N(C)C
CCCOc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1cncc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CNc1cc(OC)c2nc(C(F)F)n(-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)c2c1
COc1cc(OC)c2nc(C(F)F)n(-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)c2c1
COc1ccc2n(c(nc2c1O)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1c(O)ccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CSc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CS(=O)(=O)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CS(=O)Cc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CS(=O)(=O)Cc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
OCc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CSCc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CCOc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Cc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FCc1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
C1CN(CCO1)c1nc(nc(n1)-n1cnc2ccccc12)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2cccnc2cn1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncncc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccnc2c1
COCCNc1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nnccc2c1
Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1C[C@H]2CC[C@H](CC2)C1 |r,wD:30.39,33.37,(27.04,-36.48,;27.04,-38.02,;28.38,-38.79,;28.39,-40.33,;27.05,-41.09,;25.72,-40.34,;25.71,-38.8,;27.05,-42.63,;25.96,-43.72,;25.56,-42.23,;28.39,-43.4,;28.4,-44.94,;29.73,-45.71,;29.74,-47.26,;28.4,-48.03,;27.06,-47.26,;27.07,-45.71,;25.73,-44.94,;31.07,-48.03,;31.07,-49.57,;32.4,-50.34,;33.74,-49.57,;35.08,-50.34,;36.43,-49.56,;36.42,-47.99,;35.07,-47.23,;33.73,-48.01,;32.4,-47.25,;37.75,-47.21,;37.63,-45.67,;38.78,-44.64,;38.36,-46.12,;39.13,-47.45,;40.5,-47.6,;41.08,-46.19,;40.36,-44.9,;39.08,-48.09,)|
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCC(F)(F)CC1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCCCC1
CN(C)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(NCCN3CCOCC3)nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncsc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(NCCN3CCCCC3)nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(NCCc3ccccc3)nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(NCC3CCCNC3)nc2c1
CN(Cc1ccccc1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(NCC3CCCCC3)nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncccc2n1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2cnccc2c1
COCCN(C)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncccc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCOCC3)c2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCCCC3)c2c1
CN(C)c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)-c1ccncc1
COCCNc1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
CN(C)c1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccncc3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3cccnc3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccccc3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCN(Cc4ccncc4)CC3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCOCC1
CC(C)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
COC1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
OC1CCN(CC1)c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCN(Cc4ccccc4)CC3)c2c1
CC(C)N1CCN(CC1)c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
C[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O
C[C@H](O)C(=O)N1CC(C1)n1cc(cn1)-c1ccc2-c3nc(cn3CCOc2c1)-c1nc(C)nn1C(C)C |r|
CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(c1)C1CN(CCO)C1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CCO)c2)s1
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(CC(C)(C)O)c1
OCCn1cc(cn1)-c1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1CC(F)(F)F
CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(C)c1
CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(CCN2CCOCC2)c1
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(CCO)c1
CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(CCO)c1
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
COc1ccc(Nc2cc(n[nH]c2=O)-c2ccncc2)cc1
COc1ccc(Nc2cc(n[nH]c2=O)-c2ccco2)cc1
COc1ccc(Nc2cc(n[nH]c2=O)-c2ccccc2)cc1
COc1ccc2[nH]c3c(c(n[nH]c3=O)-c3ccco3)c2c1
COc1ccc2[nH]c3c(c(n[nH]c3=O)-c3ccc(cc3)C(F)(F)F)c2c1
COc1ccc(cc1)-c1n[nH]c(=O)c2[nH]c3ccc(OC)cc3c12
COc1ccc2[nH]c3c(c(n[nH]c3=O)-c3ccccc3)c2c1
Cc1cc(\C=N\NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3sccc3n2)cc(C)c1O
Fc1ccc(CN2C(=O)COc3ccc(\C=C4\SC(=S)NC4=O)cc23)cc1Cl
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C2(CC2)C#N)c1=O)-c1cnc2ccccc2c1
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r|
COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r|
Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r|
Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r|
Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)|
CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r|
COc1ccc(cc1OC)-c1ccc2ncc(-c3ccc(cc3)C(N)=O)n2n1
CN(C)S(=O)(=O)c1ccc(cc1)-c1cnc2ccc(nn12)-c1ccnc2[nH]ccc12
CN(C)S(=O)(=O)c1ccc(cc1)-c1cnn2CCN(Cc12)c1ccnc2[nH]ccc12
C[C@@H]1Cn2ncc(c2CN1c1ccnc2[nH]ccc12)-c1ccc(cc1)S(=O)(=O)N(C)C |r|
CS(=O)(=O)Cn1cnc2c(nc(cc12)-c1cccc2[nH]ccc12)N1CCOCC1
C(C1CC1)n1cnc2c(nc(cc12)-c1cccc2[nH]ccc12)N1CCOCC1
C[C@@H]1COCCN1c1nc(cc2nccn12)-c1cccc2[nH]ccc12 |r|
C1CN(CCO1)c1nc(cc2nccn12)-c1cccc2[nH]ccc12
CCn1cnc(CCNC(=O)Nc2nc3ccc(cc3s2)-c2cncc(OC)c2)c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCCc3cn(C)cn3)sc2c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCCc3c[nH]cn3)sc2c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCCC(=O)NCC(F)(F)F)sc2c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCC(=O)NCC(F)(F)F)sc2c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCCCN(C)C)sc2c1
CCNC(=O)Nc1nc2ccc(cc2s1)-c1cncc(OC)c1
COc1cncc(c1)-c1ccc2nc(NC(=O)N(C)C)sc2c1
CCCn1cnc(CCNC(=O)Nc2nc3ccc(cc3s2)-c2cncc(OC)c2)c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCCc3cncn3C)sc2c1
COc1cncc(c1)-c1ccc2nc(NC(=O)NCCOc3ccccc3)sc2c1
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)C
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)NCCN(C)C
CC(Nc1cccc(Cl)c1F)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)NCCN(C)C
CC(Nc1ccc(F)cc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)C
CC(Nc1ccc(F)c(F)c1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)C
C[C@@H](Nc1cc(F)cc(F)c1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
C[C@@H](Nc1ccccc1C(=O)NS(C)(=O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1 |r|
CC(Nc1ccccc1S(O)(=O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
C[C@@H](Nc1ccccc1C(=O)NO)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1 |r|
CC(Nc1cc(Cl)ccc1C(O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
CC(Nc1cccc(c1)C(O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
CC1=CN2C(=O)C=C(N=C2C(=C1)[C@@H](C)Nc3ccccc3C(=O)O)N4CCOCC4
CC(Nc1ccccc1)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
CC(Nc1ccccc1-c1nnn[nH]1)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(O)=O
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CC(O)=O
CC(Nc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)NCCN1CCNCC1
CC(Oc1ccccc1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
CC(Oc1ccccc1C)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
CC(Oc1cccc(C)c1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
CC(Oc1ccccc1F)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
CC(Oc1cccc(c1)C#N)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
COc1ccccc1OC(C)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
COc1cccc(OC(C)c2cc(cn3c2nc(cc3=O)N2CCOCC2)C(=O)N(C)CCO)c1
CC(Oc1ccc(F)c(C)c1)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
CC(Oc1cccc(F)c1C)c1cc(cn2c1nc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccc(Cl)cc1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccc(F)cc1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccc(cc1)C#N
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cc(F)cc(F)c1
COc1ccc(cc1)-c1cnc2[nH]cc(-c3ccc(OC)c(OC)c3)c2c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccc(C)cc1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccc(c1)N(C)C
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccc(C)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccc(c1)C#N
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccc(N)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cncc(N)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccc(OC)c(OC)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccccc1N
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccccc1C
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccnc1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccncc1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1ccccc1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccc(F)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cccc(NS(=O)(=O)c2ccccc2)c1
CCN(CC)CCCNc1nc(nc2ccsc12)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
O=c1cc(oc2c3ccccc3ccc12)N1CCOCC1
O=c1cc(oc2c(cccc12)-c1cccc2c3ccccc3sc12)N1CCOCC1
COc1ccc(cn1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1F)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1N)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NC(=O)C(F)(F)F)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cnc2nc(N)nc(C)c2c1
CCCCS(=O)(=O)Nc1cc(cnc1OC)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NC(=O)c1ccc(F)cc1F)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NC(=O)Nc1ccc(F)cc1F)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cn1)-c1cnc2nc(N)nc(C)c2c1
Cc1nc(N)nc2ncc(cc12)-c1cnc2[nH]ccc2c1
Cc1nc(N)nc2ncc(cc12)-c1cnc2[nH]cc(NS(=O)(=O)c3ccc(F)cc3F)c2c1
Cc1nc(N)nc2ncc(cc12)-c1cnc2[nH]nc(NS(=O)(=O)c3ccc(F)cc3F)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1cnc2nc(N)nc(C)c2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1OC)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1cccs1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1cccnc1)-c1cnc2nc(N)nc(C)c2c1
Oc1ccc2nc(nc(N3CCOCC3)c2c1)-c1ccccc1
C[C@@H](O)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)-c2cnc(N)nc2)N2CCOCC2)CC1 |r|
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
CC(C)n1c(C)nc2c(nc(nc12)N1CCOCC1)-c1cnc(N)nc1
O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCCCC1
CC1CN(CCO1)c1cc(=O)c2ccc3ccccc3c2o1
O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCSCC1
O=c1cc(nc2c3ccccc3ccn12)N1CCOCC1
CC(Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(Cl)c1-c1ccccn1
CC(Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(N(C)C)c1-c1ccccn1
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(N2CC(O)C2)c1-c1ccccn1 |r|
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(N2CCOCC2)c1-c1ccccn1 |r|
CC(Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(C#N)c1-c1ccccn1
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(-c2ccccn2)c1-c1ccccn1 |r|
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(-c2ncccc2C)c1-c1ccccn1 |r,wD:1.1,(-4.01,-2.77,;-4.01,-1.54,;-5.35,-.77,;-6.68,-1.55,;-6.68,-3.09,;-8.01,-3.86,;-9.35,-3.1,;-9.35,-1.56,;-10.42,-.94,;-8.02,-.78,;-8.03,.76,;-8.03,1.99,;-2.68,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;3.73,1.38,;1.33,1.54,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.66,3.85,;-2.65,5.39,;-1.32,6.16,;.02,5.38,;.01,3.84,;1.07,3.22,;-2.68,.77,;-4.01,1.54,;-5.35,.78,;-6.68,1.56,;-6.67,3.1,;-5.33,3.86,;-4,3.08,)|
CC[C@@H](C1=Nc2cccc(c2C(=O)N1c3ccccc3)F)Nc4c5c(nc[nH]5)ncn4
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(c1-c1ccccc1)S(C)(=O)=O |r|
COc1c(-c2ccccc2)c(nc2ccc(F)cc12)[C@H](C)Nc1ncnc(N)c1C#N |r|
CC(Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(O)c1-c1ccccc1
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c([S+]([O-])CCO)c1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(C#N)c1-c1ccccc1 |r|
CC(Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(NCCO)c1-c1ccccc1
COCCNc1c(-c2ccccc2)c(nc2ccc(F)cc12)[C@H](C)Nc1ncnc(N)c1C#N |r|
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(NCCN(C)C)c1-c1ccccc1 |r|
C[C@H](Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2c(NCCS(C)(=O)=O)c1-c1ccccc1 |r|
CC(Nc1ncnc(N)c1C#N)c1nc2ccc(F)cc2cc1-c1ccccn1
Cc1ccc2OCCn3c(nc4cc(ccc34)C(F)(F)F)-c2c1
Cc1ccc2OCCn3c(nc4cc(ccc34)[N+]([O-])=O)-c2c1
Brc1ccc2OCCn3c(nc4cc(Br)ccc34)-c2c1
Cc1ccc2OCCn3c(nc4cc(Br)ccc34)-c2c1
Clc1ccc2n3CCOc4ccc(Br)cc4-c3nc2c1
Clc1ccc2OCCn3c(nc4cc(Cl)ccc34)-c2c1
Fc1ccc2n3CCOc4ccc(Br)cc4-c3nc2c1
Fc1ccc2n3CCOc4ccc(Cl)cc4-c3nc2c1
Cc1ccc2OCCn3c(nc4cc(F)ccc34)-c2c1
Cc1ccc2OCCn3c(nc4cc(C)ccc34)-c2c1
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(3.45,3.56,;2.38,2.95,;1.05,3.73,;1.06,4.97,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Oc1cc([nH]n1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:6.6,wD:13.16,(7.34,-.85,;6.12,-.67,;5.04,-1.77,;3.68,-1.07,;3.89,.44,;5.4,.7,;2.26,-1.79,;2.13,-3.4,;.73,-4.07,;-.57,-3.2,;-.48,-1.66,;.83,-1.64,;.86,-3.36,;.93,-.96,;.98,.59,;-.32,1.41,;-.27,2.95,;-1.58,3.76,;-2.94,3.04,;-2.99,1.5,;-1.68,.69,;-1.73,-.55,;-1.52,5.3,;-2.72,6.2,;-2.21,7.66,;-.67,7.61,;.39,8.73,;1.9,8.35,;2.32,6.88,;3.52,6.58,;1.25,5.75,;-.25,6.14,)|
[H][C@]1(C(O)CO)C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wD:12.14,1.0,TLB:2:1:8.7:10.11,THB:13:12:8.7:10.11,(-.64,1.55,;.13,.87,;1.58,1.51,;2.6,.82,;1.69,3.04,;2.79,3.59,;1.39,,;2.86,.48,;2.23,-.94,;,-.67,;-.29,-2.25,;1.15,-1.65,;-1.3,.28,;-2.82,.5,;-3.77,-.71,;-3.2,-2.14,;-4.15,-3.35,;-5.68,-3.13,;-6.25,-1.7,;-5.3,-.49,;-5.76,.65,;-3.58,-4.78,;-4.4,-6.04,;-3.43,-7.23,;-2,-6.66,;-.62,-7.36,;.67,-6.49,;.57,-4.96,;1.59,-4.28,;-.83,-4.26,;-2.1,-5.13,)|
CS(=O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(1.06,4.97,;1.05,3.73,;1.93,3.21,;2.12,4.34,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;2.34,1.32,;2.39,2.86,;3.74,3.59,;5.05,2.78,;5.01,1.24,;3.65,.51,;3.61,-.72,;3.79,5.12,;5.05,5.94,;4.63,7.43,;3.1,7.48,;2.12,8.67,;.58,8.39,;.06,6.95,;-1.15,6.73,;1.06,5.75,;2.58,6.04,)|
Cc1nnc(o1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:6.6,wD:13.16,(7.33,-.85,;6.11,-.67,;5.4,.7,;3.88,.44,;3.68,-1.07,;5.04,-1.77,;2.26,-1.79,;2.12,-3.4,;.73,-4.07,;-.57,-3.2,;-.48,-1.66,;.83,-1.64,;.86,-3.35,;.93,-.96,;.98,.59,;-.32,1.41,;-.27,2.95,;-1.57,3.76,;-2.93,3.04,;-2.99,1.5,;-1.68,.68,;-1.73,-.55,;-1.52,5.3,;-2.72,6.2,;-2.2,7.65,;-.67,7.61,;.39,8.73,;1.9,8.35,;2.32,6.87,;3.52,6.58,;1.24,5.75,;-.25,6.13,)|
Cc1noc(n1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.16,wD:6.6,(4.75,4.05,;3.52,4.21,;2.78,5.56,;1.27,5.27,;1.1,3.76,;2.47,3.09,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
[H][C@]1(C(C)O)C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wD:11.13,1.0,TLB:2:1:7.6:9.10,THB:12:11:7.6:9.10,(-.64,1.54,;.13,.87,;1.58,1.51,;1.76,2.72,;2.54,.74,;1.38,,;2.86,.48,;2.23,-.94,;,-.67,;-.29,-2.25,;1.15,-1.65,;-1.3,.28,;-2.82,.5,;-3.77,-.71,;-3.2,-2.14,;-4.15,-3.35,;-5.67,-3.13,;-6.25,-1.7,;-5.29,-.49,;-5.75,.65,;-3.58,-4.78,;-4.4,-6.03,;-3.42,-7.22,;-2,-6.66,;-.62,-7.36,;.67,-6.49,;.57,-4.96,;1.59,-4.27,;-.83,-4.26,;-2.1,-5.13,)|
NS(=O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(1.06,4.97,;1.05,3.73,;1.93,3.21,;2.12,4.34,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;2.34,1.32,;2.39,2.86,;3.74,3.59,;5.05,2.78,;5.01,1.24,;3.65,.51,;3.61,-.72,;3.79,5.12,;5.05,5.94,;4.63,7.43,;3.1,7.48,;2.12,8.67,;.58,8.39,;.06,6.95,;-1.15,6.73,;1.06,5.75,;2.58,6.04,)|
Fc1cnc2[nH]cc(-c3ncc(F)c(N[C@H]4C5CCC(CC5)[C@@H]4c4nc(=O)o[nH]4)n3)c2c1 |r,wU:22.24,wD:15.14,(3.52,6.58,;2.32,6.87,;1.9,8.35,;.39,8.73,;-.67,7.61,;-2.2,7.65,;-2.72,6.2,;-1.52,5.3,;-1.57,3.76,;-2.93,3.04,;-2.99,1.5,;-1.68,.68,;-1.73,-.55,;-.32,1.41,;.98,.59,;.93,-.96,;-.48,-1.66,;-.57,-3.2,;.73,-4.07,;2.12,-3.4,;.86,-3.35,;.83,-1.64,;2.26,-1.79,;3.68,-1.07,;5.04,-1.77,;6.11,-.67,;7.33,-.85,;5.4,.7,;3.88,.44,;-.27,2.95,;-.25,6.13,;1.24,5.75,)|
Oc1cc(on1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.16,wD:6.6,(4.75,4.05,;3.53,4.21,;2.47,3.09,;1.1,3.76,;1.27,5.28,;2.79,5.56,;-.29,2.98,;-1.7,3.76,;-3.04,2.98,;-3.04,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.03,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.84,-3.94,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.13,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
CC(=O)NS(=O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:14.16,wD:7.6,(3.73,4.94,;3.72,3.71,;4.78,3.08,;2.38,2.95,;1.05,3.73,;1.06,4.97,;2.12,4.34,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Fc1cnc2[nH]cc(-c3ncc(F)c(N[C@H]4C5CCC(CC5)[C@@H]4c4nnn[nH]4)n3)c2c1 |r,wU:15.14,wD:22.24,(-5.47,-.22,;-5.12,-1.4,;-6.19,-2.51,;-5.76,-4.01,;-4.26,-4.36,;-3.53,-5.71,;-2.01,-5.43,;-1.83,-3.93,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;.93,-.95,;.98,.59,;-.33,1.41,;-1.7,.63,;-3.03,1.41,;-3.03,2.98,;-1.7,3.76,;-2.37,2.68,;-.96,1.7,;-.29,2.98,;1.1,3.76,;2.47,3.09,;3.52,4.21,;2.78,5.56,;1.27,5.27,;-.42,-1.67,;-3.19,-3.25,;-3.61,-1.77,)|
Oc1cc(no1)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.16,wD:6.6,(4.75,4.05,;3.53,4.21,;2.47,3.09,;1.1,3.76,;1.27,5.28,;2.79,5.56,;-.29,2.98,;-1.7,3.76,;-3.04,2.98,;-3.04,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.03,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.84,-3.94,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.13,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
Fc1cnc2[nH]cc(-c3ncc(F)c(N[C@H]4C5CCC(CC5)[C@@H]4Cn4oc(=O)[nH]c4=O)n3)c2c1 |r,wU:15.14,wD:22.24,(-5.47,-.22,;-5.12,-1.4,;-6.19,-2.51,;-5.76,-4.01,;-4.26,-4.36,;-3.53,-5.71,;-2.01,-5.43,;-1.83,-3.93,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;.93,-.95,;.98,.59,;-.33,1.41,;-1.7,.63,;-3.03,1.41,;-3.03,2.98,;-1.7,3.76,;-2.37,2.68,;-.96,1.7,;-.29,2.98,;1.05,3.73,;2.38,2.95,;2.5,1.43,;4,1.09,;4.49,-.04,;4.79,2.42,;3.77,3.57,;4.03,4.78,;-.42,-1.67,;-3.19,-3.25,;-3.61,-1.77,)|
OP(O)(=O)CC[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:13.15,wD:6.5,(3.73,4.94,;3.72,3.71,;4.79,4.32,;4.78,3.08,;2.38,2.95,;1.05,3.73,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;.93,-.95,;-.42,-1.67,;-.48,-3.21,;.83,-4.02,;2.19,-3.3,;2.24,-1.76,;3.33,-1.18,;-1.83,-3.93,;-2.01,-5.43,;-3.53,-5.71,;-4.26,-4.36,;-5.76,-4.01,;-6.19,-2.51,;-5.12,-1.4,;-5.47,-.22,;-3.61,-1.77,;-3.19,-3.25,)|
OP(O)(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(ncc1F)-c1c[nH]c2ncc(F)cc12 |r,wU:11.13,wD:4.3,(1.06,4.97,;1.05,3.73,;2.12,4.34,;1.93,3.21,;-.29,2.98,;-1.7,3.76,;-3.03,2.98,;-3.03,1.41,;-1.7,.63,;-.96,1.7,;-2.37,2.68,;-.33,1.41,;.98,.59,;2.34,1.32,;2.39,2.86,;3.74,3.59,;5.05,2.78,;5.01,1.24,;3.65,.51,;3.61,-.72,;3.79,5.12,;5.05,5.94,;4.63,7.43,;3.1,7.48,;2.12,8.67,;.58,8.39,;.06,6.95,;-1.15,6.73,;1.06,5.75,;2.58,6.04,)|
C[C@@H](Oc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
CC(N(C)c1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCCC1
C[C@@H](N(C)c1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)CCO |r|
C[C@@H](N(C)c1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCC(O)CC1 |r|
CC(Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)CCO
COCCN(C)C(=O)c1cc(C(C)Nc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
CCN(C)C(=O)c1cc(C(C)Nc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H](Nc1cc(F)cc(F)c1F)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
C[C@@H](Nc1cc(F)c(F)c(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
CC(Nc1cc(Cl)cc(Cl)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
COc1cc(F)cc(NC(C)c2cc(cc3c2oc(cc3=O)N2CCOCC2)C(=O)N(C)C)c1
CC(Nc1cc(C)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
C[C@@H](Nc1cc(F)cc(Cl)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
CC(Nc1ccc(F)c(Cl)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
C[C@@H](Nc1cccc(Cl)c1F)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
CC(Nc1cc(F)ccc1F)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
C[C@@H](Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
C[C@@H](Nc1ccc(F)c(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
CC(Nc1cccc(F)c1F)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
CC(Nc1cccc(Cl)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
CC(Nc1cccc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
CC(Nc1ccc(F)cc1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C
CCN(CC)C(=O)c1cc(C(C)Nc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H](Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCC1 |r|
CC(Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCCC1
CC(Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCCCC1
CC(Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1
CC(Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCC(O)CC1
CNC(=O)c1cc([C@@H](C)Nc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1 |r|
CCNC(=O)c1cc(C(C)Nc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
COCCNC(=O)c1cc(C(C)Nc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H](Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCO[C@@H](C)C1)C(=O)N(C)C |r|
C[C@H](Nc1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCO[C@@H](C)C1)C(=O)N(C)C |r|
CN(C)C(=O)c1cc(CNc2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
CN(C)C(=O)c1cc(CN(C)c2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H](N(C)c1cc(F)cc(F)c1)c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N(C)C |r|
C[C@H]1COCCN1c1cc(nc(n1)-c1ccc(NC(=S)NCCO)cc1)C1(CC1)S(=O)(=O)C1CC1 |r|
O=S(=O)(Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1)c1ccccc1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2[nH]ccc2c1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc(NC(=O)Nc2ccc(F)cc2)cc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOCC1
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)NCCO)cc1 |r|
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)NCCN(C)C)cc1 |r|
OC(=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4ccsc4n3)c(=O)c2c1
COc1cc(CN=Nc2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc(OC)c1O |w:7.7|
[O-][N+](=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4sccc4n3)c(=O)c2c1
OC(=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4sccc4n3)c(=O)c2c1
N#Cc1cccc(Cn2cc(\C=N\Nc3nc(nc(n3)N3CCOCC3)N3CCOCC3)c3ccccc23)c1
Fc1cccc(Cn2cc(\C=N\Nc3nc(N4CCOCC4)c4sccc4n3)c3ccccc23)c1
[O-][N+](=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4ccsc4n3)c(=O)c2c1
CCn1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
Clc1ccc(s1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2c(ncnc2s1)-c1ccncc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2c(ncnc2s1)-c1ccncc1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2c(ncnc2s1)-c1ccncc1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1sc2ncnc(-c3ccncc3)c2c1C
COc1ncc(cc1NS(C)(=O)=O)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1F)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cn1)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ccc(cn1)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nc(N)nc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2nc(N)nc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nncc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2ncnc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncnc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ccnc2cn1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2nccc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccncc3)c2c1
COc1ccc(cn1)-c1cc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)cc(c1)C(O)=O
COC(=O)c1cc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)cc(c1)-c1ccc(OC)nc1
COC(=O)c1cc(I)cc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)c1
COc1ccc(cn1)-c1cc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)cc(c1)C(=O)NCCC(C)C
COc1ccc(cn1)-c1cc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)cc(c1)C(=O)NCCc1ccccc1F
COc1ccc(cn1)-c1cc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)cc(c1)C(=O)NC(CO)CO
COc1ccc(cn1)-c1cc(CNc2ccc(cc2)S(=O)(=O)N(C)c2nnc(C)s2)cc(c1)C(=O)NCCc1ccccc1F
Cc1nnc(NS(=O)(=O)c2ccc(NCc3cc(cc(c3)-c3ccc4OCOc4c3)C(O)=O)cc2)s1
Cc1nnc(NS(=O)(=O)c2ccc(NCc3cc(cc(c3)-c3ccc4OCCOc4c3)C(O)=O)cc2)s1
COc1ccc(cn1)-c1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)c1
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:22.23,wD:19.19,(-9.08,-3.23,;-8.02,-3.85,;-9.08,-4.47,;-8.02,-5.08,;-6.68,-3.08,;-5.35,-3.85,;-4.01,-3.08,;-4.01,-1.54,;-5.35,-.77,;-6.68,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;1.33,-3.08,;-0,-3.85,;-.01,-5.39,;1.33,-6.16,;1.32,-7.39,;2.66,-5.39,;2.66,-3.85,;,-.77,;-1.33,-1.54,)|
CO[C@H]1CC[C@H](CC1)N1CC(=O)Nc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wD:2.1,5.8,(-2.38,8.32,;-1.32,7.7,;-1.32,6.16,;-2.65,5.39,;-2.66,3.85,;-1.33,3.08,;.01,3.84,;.01,5.38,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-3.75,-1.39,;-1.33,-1.54,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;1.33,1.54,;,.77,;4,1.54,;3.99,3.08,;5.33,3.85,;6.66,3.08,;6.66,1.54,;5.33,.77,;7.99,3.86,;9.06,3.24,;9.06,4.47,;7.99,5.09,)|
CO[C@H]1CC[C@@H](CC1)N1CC(=O)Nc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wU:5.8,wD:2.1,(2.39,8.32,;1.33,7.7,;1.33,6.16,;-.01,5.39,;-0,3.85,;1.33,3.08,;2.66,3.85,;2.66,5.39,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-8.02,3.85,;-9.08,3.23,;-9.08,4.47,;-8.02,5.08,)|
CO[C@@H]1CC[C@H](CN2C(=O)CNc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wU:5.5,2.1,(6.68,-7.38,;6.68,-6.15,;5.34,-5.38,;5.34,-3.84,;4,-3.07,;2.67,-3.85,;1.33,-3.08,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,;2.68,-5.39,;4.01,-6.15,)|
CO[C@H]1CC[C@H](CN2CC(=O)Nc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wU:2.1,wD:5.5,(6.68,7.38,;6.68,6.15,;5.34,5.38,;5.34,3.84,;4,3.07,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-8.02,3.85,;-9.08,3.23,;-9.08,4.47,;-8.02,5.08,;2.68,5.39,;4.01,6.15,)|
CO[C@H]1CC[C@H](CN2C(=O)CNc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wU:5.5,wD:2.1,(6.68,-7.38,;6.68,-6.15,;5.34,-5.38,;5.34,-3.84,;4,-3.07,;2.67,-3.85,;1.33,-3.08,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,;2.68,-5.39,;4.01,-6.15,)|
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N([C@@H]3CC[C@H](O)CC3)c2n1 |r,wD:19.19,22.23,(-9.08,-3.23,;-8.02,-3.85,;-9.08,-4.47,;-8.02,-5.08,;-6.68,-3.08,;-5.35,-3.85,;-4.01,-3.08,;-4.01,-1.54,;-5.35,-.77,;-6.68,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;1.33,-3.08,;2.66,-3.85,;2.66,-5.39,;1.33,-6.16,;1.32,-7.39,;-.01,-5.39,;-0,-3.85,;,-.77,;-1.33,-1.54,)|
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N(CC3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(CC3CCCCC3)c2n1
CO[C@@H]1CC[C@H](CN2CC(=O)Nc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wD:5.5,2.1,(6.68,7.38,;6.68,6.15,;5.34,5.38,;5.34,3.84,;4,3.07,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-8.02,3.85,;-9.08,3.23,;-9.08,4.47,;-8.02,5.08,;2.68,5.39,;4.01,6.15,)|
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(C3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N(C3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(CC3CCOCC3)c2n1
COCCN1CC(=O)Nc2ncc(nc12)-c1ccc(nc1)C(C)(C)O
COCCN1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O
O=C1CN(CCC2CCOCC2)c2nc(cnc2N1)-c1ccc(nc1)-c1nc[nH]n1
Cc1nc(ccc1-c1cnc2NC(=O)CN(CCC3CCOCC3)c2n1)-c1nc[nH]n1
Cc1nc(ccc1-c1cnc2NCC(=O)N(CCC3CCOCC3)c2n1)-c1nc[nH]n1
O=C1CNc2ncc(nc2N1CCC1CCOCC1)-c1ccc(cc1)-c1nc[nH]n1
Cc1cc(ccc1-c1cnc2NC(=O)CN(CCC3CCOCC3)c2n1)-c1nc[nH]n1
Cc1cc(ccc1-c1cnc2NCC(=O)N(CCC3CCOCC3)c2n1)-c1nc[nH]n1
O=C1CN(CCC2CCOCC2)c2nc(cnc2N1)-c1ccc(cc1)-c1nnc[nH]1
CO[C@H]1CC[C@@H](CC1)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wU:2.1,wD:5.8,(2.39,-8.32,;1.33,-7.7,;1.33,-6.16,;-.01,-5.39,;-0,-3.85,;1.33,-3.08,;2.66,-3.85,;2.66,-5.39,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,)|
CC(C)(O)c1ccc(cn1)-c1cnc2[nH]c(=O)n(CCC3CCOCC3)c2n1
Oc1ccc(OC(F)(F)F)cc1-c1ccc(\C=C2/SC(=O)NC2=O)o1
Oc1ccc(O)c(c1)-c1ccc(\C=C2/SC(=O)NC2=O)o1
OC1=NC(=O)C(S1)=Cc1ccc(o1)-c1ccc2OCOc2c1 |w:7.8,t:1|
COC(=O)c1ccc(-c2ccc(\C=C3/SC(=O)NC3=O)o2)c(O)c1
Oc1c(F)cc(F)cc1-c1ccc(\C=C2/SC(=O)NC2=O)s1
CCN1C(=O)CNc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
Oc1ccc(Cl)cc1-c1ccc(\C=C2/SC(=O)NC2=O)o1
OC1=NC(=O)C(S1)=Cc1ccc(o1)-c1cccc(O)c1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(o1)-c1ccc(O)cc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(o1)-c1ccccn1 |w:7.8,t:1|
Oc1ccc(-c2ccc(\C=C3/SC(=O)NC3=O)o2)c(F)c1
OC(=O)c1cccc(c1)-c1ccc(\C=C2/SC(=S)NC2=O)o1
OC(=O)c1ccc(O)c(c1)-c1ccc(\C=C2/SC(=O)NC2=O)o1
Oc1ccc(-c2ccc(\C=C3/SC(=O)NC3=O)o2)c(O)c1
Oc1c(cccc1[N+]([O-])=O)-c1ccc(\C=C2/SC(=O)NC2=O)o1
OC1=NC(=O)C(S1)=Cc1ccc(o1)-c1ccccc1O |w:7.8,t:1|
Oc1ccc(cc1-c1ccc(\C=C2/SC(=S)NC2=O)o1)[N+]([O-])=O
Oc1cc(F)ccc1-c1ccc(\C=C2/SC(=O)NC2=O)o1
OC1=NC(=O)C(S1)=Cc1ccc(o1)-c1cccnc1 |w:7.8,t:1|
Cc1ccc(O)c(c1)-c1ccc(\C=C2/SC(=O)NC2=O)o1
Oc1ccc(cc1-c1ccc(\C=C2/SC(=O)NC2=O)o1)C#N
Oc1ccc(F)cc1-c1ccc(\C=C2/SC(=O)NC2=O)o1
COc1cc(cnc1Cl)N1CCc2nc(NC(=O)NCCc3cn(CC(F)F)cn3)sc2C1
O=c1cc(nc2c(COc3ccc(cc3)C#N)cccn12)N1CCOCC1
COc1ccc(OCc2cccn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1ccc(OCc2cccn3c2nc(cc3=O)N2CCOCC2)cc1
O=c1cc(nc2c(COc3ccccc3)cccn12)N1CCOCC1
Cc1cccc(Nc2cc(C)cn3c2nc(cc3=O)N2CCOCC2)c1
Cc1cc(Nc2ccccc2C)c2nc(cc(=O)n2c1)N1CCOCC1
CN(c1ccccc1)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
Cc1cc(Nc2ccccc2)c2nc(cc(=O)n2c1)N1CCOCC1
O=c1cc(nc2c(CSc3ccccc3)cccn12)N1CCOCC1
O=c1cc(nc2c(CS(=O)(=O)c3ccccc3)cccn12)N1CCOCC1
O=C(Nc1cccn2c1nc(cc2=O)N1CCOCC1)c1ccccc1
O=C(NCc1ccncc1)c1cccn2c1nc(cc2=O)N1CCOCC1
O=C(NCc1cccnc1)c1cccn2c1nc(cc2=O)N1CCOCC1
O=C(NCc1ccccn1)c1cccn2c1nc(cc2=O)N1CCOCC1
Cc1cccc(c1)C(=O)Nc1cccn2c1nc(cc2=O)N1CCOCC1
Cc1ccccc1C(=O)Nc1cccn2c1nc(cc2=O)N1CCOCC1
Cc1ccc(NC(=O)c2cccn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1cccc(NC(=O)c2cccn3c2nc(cc3=O)N2CCOCC2)c1
Cc1ccccc1NC(=O)c1cccn2c1nc(cc2=O)N1CCOCC1
O=C(Nc1ccccc1)c1cccn2c1nc(cc2=O)N1CCOCC1
Cc1cc(NCc2cccnc2)c2nc(cc(=O)n2c1)N1CCOCC1
Cc1cc(NCc2ccccn2)c2nc(cc(=O)n2c1)N1CCOCC1
Cc1ccc(CNc2cc(C)cn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1cccc(CNc2cc(C)cn3c2nc(cc3=O)N2CCOCC2)c1
C[C@@H](Nc1cc(C)cn2c1nc(cc2=O)N1CCOCC1)c1ccccc1 |r|
C[C@H](Nc1cc(C)cn2c1nc(cc2=O)N1CCOCC1)c1ccccc1 |r|
Cc1cc(NCc2ccncc2)c2nc(cc(=O)n2c1)N1CCOCC1
Cc1cc(NCc2ccccc2)c2nc(cc(=O)n2c1)N1CCOCC1
Cc1cc(Nc2c(C)cccc2C)c2nc(cc(=O)n2c1)N1CCOCC1
Cc1ccc(Nc2cc(C)cn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1cc(NCc2ccccc2C)c2nc(cc(=O)n2c1)N1CCOCC1
Cc1ccc(cc1)C(=O)Nc1cccn2c1nc(cc2=O)N1CCOCC1
Clc1ccc(NCc2cccn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1ccc(NCc2cccn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1cccc(NCc2cccn3c2nc(cc3=O)N2CCOCC2)c1
Cc1ccccc1NCc1cccn2c1nc(cc2=O)N1CCOCC1
O=C(Nc1cccn2c1nc(cc2=O)N1CCOCC1)Oc1ccccc1
O=C(Nc1ccccc1)Nc1cccn2c1nc(cc2=O)N1CCOCC1
Cc1ccc(cc1)S(=O)(=O)NCc1cccn2c1nc(cc2=O)N1CCOCC1
O=c1cc(nc2c(NS(=O)(=O)c3ccccc3)cccn12)N1CCOCC1
COc1ccc(NCc2cccn3c2nc(cc3=O)N2CCOCC2)cc1
CN(Cc1cccn2c1nc(cc2=O)N1CCOCC1)c1ccccc1
O=c1cc(nc2c(CNc3ccccc3)cccn12)N1CCOCC1
CC(N(C)c1ccccc1)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
CN(C)CC(=O)N1CCC(CC1)n1cc(cn1)-c1cnc(N)c(n1)-n1nnc2ccccc12
CN(C)CC(=O)N1CCC(CC1)n1ccc(n1)-c1cnc(N)c(n1)-n1nnc2ccccc12
CN(C)CC(=O)N1CCC(CC1)n1ncc(n1)-c1cnc(N)c(n1)-n1nnc2ccccc12
CN(C)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-n2nnc3ccccc23)n(C)n1
CN(C)CC(=O)N1CCC(CC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12
CN(C)CC(=O)N1CCC(CC1)c1cn(C)c(n1)-c1cnc(N)c(n1)-n1nnc2ccccc12
CN(C)CC(=O)N1CCC(CC1)c1cc(-c2cnc(N)c(n2)-n2nnc3ccccc23)n(C)n1
CCN1C(=S)N2CCCC2c2c(nc(nc12)-c1cccc(OC)c1)N1CCOCC1
CCN1C(=S)N2CCCC2c2c(nc(nc12)-c1ccc(OC)cc1)N1CCOCC1
COc1cccc(c1)-c1nc(N2CCOCC2)c2C3CCCN3C(=S)N(c3ccccc3)c2n1
COc1ccc(cc1)-c1nc(N2CCOCC2)c2C3CCCN3C(=S)N(c3ccccc3)c2n1
CCN1C(=S)N2CCCC2c2c1nc(CN1CCOCC1)[nH]c2=O
CCN1C(=S)N2CCCC2c2c1nc([nH]c2=O)C(C)N1CCOCC1
O=c1[nH]c(CN2CCOCC2)nc2N(C(=S)N3CCCC3c12)c1ccccc1
CC(N1CCOCC1)c1nc2N(C(=S)N3CCCC3c2c(=O)[nH]1)c1ccccc1
S=C1N2CCCC2c2c(nc(CN3CCOCC3)nc2N1c1ccccc1)N1CCOCC1
CC(N1CCOCC1)c1nc(N2CCOCC2)c2C3CCCN3C(=S)N(c3ccccc3)c2n1
CCN1C(=S)N2CCCC2c2c1nc(-c1cccc(O)c1)c(C#N)c2N1CCOCC1
CCN1C(=S)N2CCCC2c2c1nc(-c1cccc(OC)c1)c(C#N)c2N1CCOCC1
CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)cc1)c(C#N)c2N1CCOCC1
CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)c(O)c1)c(C#N)c2N1CCOCC1
CCN1C(=S)N2CCCC2c2c1nc(-c1ccc(OC)c(OC)c1)c(C#N)c2N1CCOCC1
Nc1nc2ccc(cc2s1)-c1cccnc1
Nc1nc2ccc(cc2s1)-c1ccncc1
Nc1nc2ccc(cc2s1)-c1ncccn1
Nc1nc2ccc(cc2s1)-c1cnccn1
Nc1nc2ccc(cc2s1)-c1ccc(=O)[nH]c1
Nc1nc2ccc(cc2s1)-c1cc[nH]c(=O)c1
Cn1ccc(n1)-c1ccc2nc(N)sc2c1
Cn1nccc1-c1ccc2nc(N)sc2c1
Cn1cc(cn1)-c1ccc2nc(N)sc2c1
CCn1cc(cn1)-c1ccc2nc(N)sc2c1
CCCn1cc(cn1)-c1ccc2nc(N)sc2c1
CC(C)n1cc(cn1)-c1ccc2nc(N)sc2c1
Nc1nc2ccc(cc2s1)-c1cnn(c1)C1CC1
Nc1nc2ccc(cc2s1)-c1cnn(CC2CC2)c1
Nc1nc2ccc(cc2s1)-c1cnn(Cc2ccccc2)c1
Cn1ccc(cc1=O)-c1ccc2nc(N)sc2c1
CCn1ccc(cc1=O)-c1ccc2nc(N)sc2c1
Nc1nc2ccc(cc2s1)-c1ccn(CC2CC2)c(=O)c1
COCCOn1ccc(cc1=O)-c1ccc2nc(N)sc2c1
O=c1cc(ccn1CC1CC1)-c1ccc2nc(NCC3CCOCC3)sc2c1
C[C@@H](Nc1nc2ccc(cc2s1)-c1ccn(CC2CC2)c(=O)c1)C1CCOCC1 |r|
C[C@H](Nc1nc2ccc(cc2s1)-c1ccn(CC2CC2)c(=O)c1)C1CCOCC1 |r|
O=c1cc(ccn1CC1CC1)-c1ccc2nc(NCC3CCS(=O)(=O)CC3)sc2c1
OC(=O)[C@H]1CC[C@H](CNc2nc3ccc(cc3s2)-c2ccn(CC3CC3)c(=O)c2)CC1 |r,wU:6.6,wD:3.2,(11.72,2.53,;11.11,1.45,;11.74,.39,;9.57,1.44,;8.78,2.76,;7.24,2.75,;6.49,1.4,;4.95,1.38,;4.2,.04,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;-3.71,1.53,;-5.05,.76,;-6.38,1.53,;-6.38,3.07,;-7.72,3.83,;-9.05,3.06,;-10.51,3.1,;-9.73,1.77,;-5.05,3.84,;-5.05,5.07,;-3.72,3.07,;7.28,.08,;8.82,.1,)|
CCOc1ccc(cn1)-c1ccc2nc(N)sc2c1
COc1ccc(cn1)-c1ccc2nc(N)sc2c1
CCSc1ccc(cn1)-c1ccc2nc(N)sc2c1
COCc1ccc(cn1)-c1ccc2nc(N)sc2c1
CNCc1ccc(cn1)-c1ccc2nc(N)sc2c1
CC(C)Oc1ccc(cn1)-c1ccc2nc(N)sc2c1
CCNc1ccc(cn1)-c1ccc2nc(N)sc2c1
CCN(C)c1ccc(cn1)-c1ccc2nc(N)sc2c1
Nc1nc2ccc(cc2s1)-c1ccc(CO)nc1
Cc1ccc(cn1)-c1ccc2nc(N)sc2c1
Nc1nc2ccc(cc2s1)-c1ccc(nc1)C(F)(F)F
CS(=O)(=O)c1ccc(cn1)-c1ccc2nc(N)sc2c1
Nc1nc2ccc(cc2s1)-c1ccc(OCCO)nc1
COCCOc1ccc(cn1)-c1ccc2nc(N)sc2c1
CNC(=O)c1ccc(cn1)-c1ccc2nc(N)sc2c1
CN(C)C(=O)c1ccc(cn1)-c1ccc2nc(N)sc2c1
CC(C)Oc1cncc(c1)-c1ccc2nc(N)sc2c1
CS(=O)(=O)c1cncc(c1)-c1ccc2nc(N)sc2c1
Nc1nc2ccc(cc2s1)-c1ccccc1
Nc1nc2ccc(cc2s1)-c1ccccn1
COc1ccc(cc1)C(O)C(=O)c1ccc(OC)cc1
OC(C(=O)c1ccccc1)c1ccccc1
COc1ccc(cc1)C(OC(=O)c1ccc(F)cc1)C(=O)c1ccc(OC)cc1
Clc1ccc(cc1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1
Fc1ccc(cc1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1
Fc1cccc(c1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1
Fc1ccccc1C(=O)OC(C(=O)c1ccccc1)c1ccccc1
[O-][N+](=O)c1ccc(cc1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1
O=C(OC(C(=O)c1ccccc1)c1ccccc1)c1ccccc1
Nc1ncc(s1)-c1nc(N2CCOCC2)c2cccn2n1
C1CN(CCO1)c1nc(nn2cccc12)-c1ccnc2[nH]ccc12
C1CN(CCO1)c1nc(nn2cccc12)-c1cccc2[nH]ncc12
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2cccn2n1
Nc1ncc(-c2nc(N3CCOCC3)c3cccn3n2)c(n1)C(F)(F)F
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccn2n1
COCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1C2CCC1COC2
COCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOC[C@H]1C |r|
COCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOC[C@@H]1C |r|
CN(C)C(=O)c1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
CC(C)C(O)Cc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
COCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(CO)n2n1
CN(C)Cc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
CN1CCN(Cc2ccc3c(nc(nn23)-c2cnc(N)nc2)N2CCOCC2)CC1
CC(=O)NCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
CN(C)C(=O)NCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
CS(=O)(=O)NCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
NCc1ccc2c(nc(nn12)-c1cnc(N)nc1)N1CCOCC1
C1CN(CCO1)c1ncnn2cccc12
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nc(NC(=O)NC3CC3)nn2c1
CCN(CC)CCNC(=O)Nc1nc2ccc(cn2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1
C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C |r|
C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C(F)(F)F |r|
CN(C)C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C |r|
CC(C)(C)c1ncc2CCc3nc(NC(=O)N4CCC[C@H]4C(N)=O)sc3-c2n1 |r|
CC(C)(C)c1ncc2CCc3nc(NC(=O)N4CCC[C@@]4(C)C(N)=O)sc3-c2n1 |r|
[H][C@@]12C[C@@]1(N(CC2)C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C)C(N)=O |r|
C[C@@H]1CCN([C@@H]1C(=O)N)C(=O)Nc2nc3c(s2)-c4c(cnc(n4)C(C)(C)C)CC3
C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C(F)(F)F |r|
CN(C)C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C |r|
CN(C)C[C@]1(CCCN1C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C)C(N)=O |r|
CN(C)[C@@H]1C[C@H](N(C1)C(=O)Nc1nc2CCc3cnc(nc3-c2s1)C(C)(C)C)C(N)=O |r|
CC(C)(C)c1nc-2c(CCc3nc(NC(=O)N4CCC[C@H]4C(N)=O)sc-23)s1 |r|
NC(=O)[C@@H]1CCCN1C(=O)Nc1nc2CCc3sc(CC4CC4)nc3-c2s1 |r|
CC(C)(C)c1nc-2c(CCc3nc(NC(=O)N4CCC[C@@]4(C)C(N)=O)sc-23)s1 |r|
[H][C@@]12C[C@@]1(N(CC2)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C)C(N)=O |r|
C[C@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2CCc3sc(nc3-c2s1)C(C)(C)C |r|
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NC(=O)c2cccc(Cl)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NC(C#N)c2ccccc2)c1
C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc2COc3cnc(cc3-c2s1)C(C)(C)C(F)(F)F |r|
C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc(C)c(s1)-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
CN([N-][CH+]c1coc2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1ncc2ccccn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1ccnc2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cncn1C)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1cncc2c(Br)cccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1cccc2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cn(C)c2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1csc2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnc2ccccn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1cncc2ccc(Br)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1ncn2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1cncc2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1[o+][n-]c2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1cnc2ccccc2c1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN([N-][CH+]c1cncc2cc(Br)ccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnc2CCCCn12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1ccccc1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1ccccc1C
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cccc(c1)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cccc(C)c1
COc1cccc(c1)S(=O)(=O)N(C)\N=C\c1cnn2ccc(Cl)nc12
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cccc(OC(F)(F)F)c1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cccc(c1)C#N
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cccc(F)c1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1ccc(F)cc1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1ccc(F)c(F)c1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cccnc1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1ccc[n+]([O-])c1
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(Br)ccc1C
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)C(O)=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)C(N)=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)C#N
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(F)ccc1C
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)S(C)(=O)=O
CN(\N=C\c1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1Cl)[N+]([O-])=O
COc1ccc(cc1S(=O)(=O)N(C)\N=C\c1cnn2ccc(Cl)nc12)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(C)nc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
COc1ccc(cc1OC)-c1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2n1
CN(\N=C\c1cnn2ccc(nc12)-c1cccnc1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
COc1ccc(cn1)-c1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2n1
CN(\N=C\c1cnn2ccc(nc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
COc1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2n1
CN(C)c1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2n1
CN(\N=C\c1cnn2ccc(nc12)N1CCOCC1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)NCCc1cnn2ccc(Cl)nc12)[N+]([O-])=O
CN(CCc1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(CCc1cnn2ccc(Cl)nc12)S(=O)(=O)c1cc(ccc1C)C#N
Cc1ccc(cc1S(=O)(=O)n1cc(cn1)-c1cnn2ccc(Cl)nc12)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)n1ccc(n1)-c1cnn2ccc(Cl)nc12)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)n1ccc(c1)-c1cnn2ccc(Cl)nc12)[N+]([O-])=O
COc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1
CCOc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cc1F
Cc1nc(N)nc(n1)-c1c(Nc2ccc3ncccc3c2)nc2ccccn12
Cc1nc(N)nc(n1)-c1c(Nc2ccc3ccncc3c2)nc2ccccn12
Cc1nc(N)nc(n1)-c1c(Nc2ccc3cccnc3c2)nc2ccccn12
Cc1nc(N)nc(n1)-c1c(Nc2cccc3[nH]ncc23)nc2ccccn12
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCNCC2)cc1F
COc1ccc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCNCC2)cn1
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCN(CC2)C(C)C)cc1F
COCCN1CCN(CC1)c1ccc2nc(Nc3cnc(OC)c(F)c3)c(-c3nc(C)nc(N)n3)n2c1
COc1ccc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCN(CC2)C(=O)N(C)C)cn1
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCN(CC2)C(=O)N(C)C)cc1F
COc1ccc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)C(C)(C)O)cn1
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)C(C)(C)O)cc1F
C[C@@H]1COCCN1c1cc(=O)n2CC[C@H](N(Cc3cncc(Cl)c3)c2n1)C(F)(F)F |r|
CC(=CC(=O)CCC(=O)N1CCN(CC1)Cc2cc3c(s2)c(nc(n3)c4cccc5c4cn[nH]5)N6CCOCC6)C
CC1(C)CNC(=O)c2sc(nc2C1)N1CCOC[C@@H]1Cc1c[nH]c2ccccc12 |r|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@@H]1Cc1c[nH]c2ccccc12 |r|
CC1(Cc2c(sc(n2)N3CCOCC3)C(=O)C1)C
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@@H]1Cc1csc2ccccc12 |r|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOCC1Cc1c[nH]c2ncccc12
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@H]1Cc1c[nH]c2ccccc12 |r|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOCC1Cc1ccc2ccccc2c1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOCC1Cc1cccc2ccccc12
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@@H]1Cc1ccccc1 |r|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@H]1Cc1ccccc1 |r|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@@H]1c1ccccc1 |r|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOC[C@H]1c1ccccc1 |r|
CC1(C)Cc2nc(sc2C(=O)C1)-c1ccncc1
COCCNc1nc2CC(C)(C)CC(=O)c2s1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCCCC1
O=C1CC2(CCCCC2)Cc2nc(sc12)N1CCOCC1
O=C1CC2(CCCC2)Cc2nc(sc12)N1CCOCC1
O=C1CCCc2nc(sc12)N1CCOCC1
O=C1CC(Cc2nc(sc12)N1CCOCC1)c1ccccc1
CCCC1Cc2nc(sc2C(=O)C1)N1CCOCC1
CC1Cc2nc(sc2C(=O)C1)N1CCOCC1
COC[C@H]1OC(=O)C(=CNCCCCC(O)=O)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)[C@H]3CCC4=O)OC(C)=O)[C@@]12C |r,w:8.8,t:22|
COCC1OC(=O)C([CH-]N(C)CCCCCC(O)=O)=C2C(=[OH+])C(=O)C3=C(C(CC4(C)C3CCC4=O)OC(=O)CCCCN(C)c3ccc([N+]([O-])=O)c4nonc34)C12C |t:18,24|
COCC1OC(=O)C([CH-]N(C)c2ccncc2)=C2C(=[OH+])C(=O)C3=C(C(CC4(C)C3CCC4=O)OC(=O)CCCCN(C)c3ccc([N+]([O-])=O)c4nonc34)C12C |t:17,23|
COC[C@H]1OC(=O)C(=CN(C)c2ccncc2)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)[C@H]3CCC4=O)OC(C)=O)[C@@]12C |r,w:8.8,t:23|
COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C([C@@H]2CCC(=O)[C@@]2(C)C[C@H]1OC(=O)CCCCN(C)c1ccc([N+]([O-])=O)c2nonc12)C3=O |r,t:16|
COCC1OC(=O)C([CH-]NCCCCCC(O)=O)=C2C(=[OH+])C(=O)C3=C(C(CC4(C)C3CCC4=O)OC(=O)CCCCN(C)c3ccc([N+]([O-])=O)c4nonc34)C12C |t:17,23|
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccc(cc12)-c1ccccc1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccc(Br)cc12
CC1(C)Cc2nc(sc2C(=O)N1)N1CCOc2ccc(Br)cc12
Cc1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
COc1ccc2N(CCOc2c1)c1nc2CC(C)(C)NC(=O)c2s1
Cn1cc(cn1)-c1ccc2OCCN(c3nc4CC(C)(C)CC(=O)c4s3)c2c1
Cn1cc(cn1)-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
Cn1ccnc1-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
Cc1nc(c[nH]1)-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
CC1(C)Cc2nc(sc2C(=O)N1)N1CCOc2ccc(cc12)-c1cc[nH]n1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccc(cc12)-c1cn[nH]c1
CC1(C)Cc2nc(sc2C(=O)N1)N1CCOc2ccc(cc12)-c1cn[nH]c1
CC1(C)Cc2nc(sc2C(=O)N1)N1CCOc2ccc(cc12)-c1c[nH]cn1
Cc1ccc(nn1)-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
CC1(C)Cc2nc(sc2C(=O)N1)N1CCOc2ccc(cc12)-c1ncccn1
Cc1ccc(cn1)-c1ccc2OCCN(c3nc4CC(C)(C)CC(=O)c4s3)c2c1
Cc1ccc(cn1)-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccc(cc12)-c1ccncc1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccc(cc12)-c1cccnc1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccc(cc12)-c1ccccn1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ncccc12
CN(C)Cc1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2cc(ccc12)-c1ccccc1
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2cc(Br)ccc12
CC1(C)Cc2nc(sc2C(=O)C1)N1CCOc2ccccc12
CC1(C)Cc2nc(sc2C(=O)N1)N1CCOCC1
COc1cc2nccc(Oc3ccc4c(NC(=O)c5cccc(c5)C(F)(F)F)nn(C)c4c3)c2cc1OC
COCC(O)Cn1cc(cn1)-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
Cc1ccc(Nc2ccc3OCCN(c4nc5CC(C)(C)NC(=O)c5s4)c3c2)nn1
CCN1CCN(CC\C=C\c2ccc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c(cnc3c2)C#N)CC1
CC(Oc1nc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1)C(F)(F)F
CC(C)Oc1nc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
CC(=O)Nc1cn2cc(ccc2n1)-c1cnc(N)c(OCC(F)(F)F)n1
COCCOc1nc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
CCOc1nc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
COc1nc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
COCCOc1cc(cnc1N)-c1ccc2nc(NC(C)=O)cn2n1
CCOc1cc(cnc1N)-c1ccc2nc(NC(C)=O)cn2n1
COc1cc(cnc1N)-c1ccc2nc(NC(C)=O)cn2n1
CC(=O)Nc1cn2nc(ccc2n1)-c1cnc(N)c(c1)C(F)(F)F
CCOc1cc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
COc1cc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
CC(=O)Nc1cn2cc(ccc2n1)-c1cnc(N)c(c1)C(F)(F)F
COCCOc1cc(cnc1N)-c1ccc2nc(NC(C)=O)cn2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccnnc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN3CCN(CC3)S(C)(=O)=O)c2c1
CCOC(=O)N1CCN(CC#Cc2ccnc3ccc(cc23)-c2cnc(OC)c(NS(=O)(=O)c3ccc(F)cc3F)c2)CC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN3CCOCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN3CCCCC3C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN3CCC(C)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN3CCCCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN(C3CCCCC3)C3CCCCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN(C)CCO)c2c1
CCN(CC)CC#Cc1ccnc2ccc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN(C)C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(C#CCN(C)C)c2c1
O=c1nc(oc2c(cccc12)-c1cc2ccccc2s1)N1CCOCC1
O=c1nc(oc2c(cccc12)-c1cccs1)N1CCOCC1
COc1ccc(cc1)-c1cccc2c1oc(nc2=O)N1CCOCC1
O=c1nc(oc2c(cccc12)-c1ccsc1)N1CCOCC1
NC(=O)c1ccc(cc1)-c1cccc2c1oc(nc2=O)N1CCOCC1
OCc1ccc(cc1)-c1cccc2c1oc(nc2=O)N1CCOCC1
Clc1ccc(cc1)-c1cccc2c1oc(nc2=O)N1CCOCC1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(Nc3ccncc3)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3ccc[n+]([O-])c3)cc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(NC(=O)c3cccnc3)cc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(Nc3cccnc3)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(Nc3ccccn3)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(Nc3cccc(Cl)c3)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(Nc3ccc(cc3)[N+]([O-])=O)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3cccnc3)cc2n1
Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3ccncc3)cc2n1)C(F)(F)F
Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3cccnc3)cc2n1)C(F)(F)F
Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3ccccn3)cc2n1)C(F)(F)F
Nc1ccc2c(nc(nc2c1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3ccccn3)cc2n1
Nc1ccc2c(nc(nc2c1)-c1cnc(N)nc1)N1CCOCC1
Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2ccc(NC(=O)c3ccncc3)cc2n1)C(F)(F)F
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(Nc3ccccc3)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccc(N)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ccc(Nc3cccnc3C#N)cc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3cccnc3C#N)cc2n1
CC[C@H](Oc1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1C(C)C)C(N)=O |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(O[C@H](C)C(N)=O)ccc3-c2n1 |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)N1CCCC[C@H]1C(N)=O |r|
CNC(=O)[C@@H]1CCCN1c1cc2OCCn3cc(nc3-c2cn1)-c1ncnn1C(C)C |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(ncc3-c2n1)N1CCCC1
CC(C)n1ncnc1-c1cn2CCOc3cc(ncc3-c2n1)N1CCC[C@@H]1C(N)=O |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(ncc3-c2n1)N1CCC[C@H]1C(N)=O |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(ncc3-c2n1)N(C)CC(N)=O
CC(C)n1ncnc1-c1cn2CCOc3cc(N)ncc3-c2n1
CC(C)n1ncnc1-c1cn2CCOc3cc(OC(C)(C)C(N)=O)ncc3-c2n1
CC(C)n1ncnc1-c1cn2CCOc3cc(O[C@@H](C)C(N)=O)ncc3-c2n1 |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(OCC(N)=O)ncc3-c2n1
COC(=O)Nc1ccc2-c3sc(cc3CCOc2c1)-c1nncn1-c1ccccc1Cl
COc1cc2OCCn3cc(nc3-c2cn1)-c1ncnn1C(C)C
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)N1CC[C@H]1C(N)=O |r|
CC(C)n1ncnc1-c1cn2CCOc3cc(OCC(N)=O)ccc3-c2n1
COc1cccc(c1)-c1nc(NCC(O)=O)nc(n1)N1CCOCC1
OC(=O)CNc1nc(nc(n1)-c1ccccc1)N1CCOCC1
Nc1cccc(c1)-c1nc(NCC(O)=O)nc(n1)N1CCOCC1
COC(=O)CNc1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
CN(CC(O)=O)c1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
NC(=O)CNc1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
CNC(=O)CNc1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
CN(C)C(=O)CNc1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
CS(=O)(=O)N1CCN(CNc2nc(nc(n2)-c2cccc(O)c2)N2CCOCC2)CC1
Nc1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
CN(C)C(=O)CNc1nc(nc(n1)-c1cccc(c1)C(N)=O)N1CCOCC1
CN(C)C(=O)CNc1nc(nc(n1)-c1cncc(O)c1)N1CCOCC1
CN(C)C(=O)CNc1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
CN(C)C(=O)CNc1nc(nc(n1)-c1cccc2C(O)CCc12)N1CCOCC1
CN(C)C(=O)CCNc1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
O=C1CN(CCN1)c1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
O=C1CCN(CCN1)c1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
CN(C)C(=O)c1sccc1Nc1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
CN(C)C(=O)c1cccc(Nc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)c1
CNc1cccc(Nc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)c1
NC(=O)c1cccc(Nc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)c1
NC(=O)c1cccc(Oc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)c1
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)cc1
CN(C)C(=O)c1cc(Oc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)cs1
CN(C)C(=O)[C@H]1CC[C@@H](CC1)Oc1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1 |r,wU:8.11,wD:5.4,(-11.42,3.33,;-10.35,3.94,;-10.34,5.17,;-9.02,3.16,;-9.03,1.93,;-7.68,3.92,;-6.35,3.14,;-5.01,3.9,;-5,5.44,;-6.33,6.22,;-7.67,5.46,;-3.66,6.2,;-2.34,5.42,;-.99,6.17,;.33,5.39,;.32,3.85,;-1.02,3.09,;-2.35,3.88,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;.3,.77,;1.67,6.15,;3,5.37,;4.34,6.13,;4.35,7.67,;3.03,8.45,;1.69,7.69,)|
CN(C)C(=O)N1CCC(CC1)Oc1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
C1CN(CCO1)c1nc(Nc2ccccc2)nc(n1)-c1cccc2[nH]ncc12
CC1C\C(=C/c2ccc3OCCc3c2)C(=O)O1
O=C1NC(=S)S\C1=C/c1ccc2ncsc2c1
O=C1NC(=S)S\C1=C/c1ccc2ncccc2c1
CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1
CNc1ncc(c(CC2CC2)n1)-c1ccnc(N[C@H]2CC[C@H](O)CC2)n1 |r,wU:21.23,wD:18.19,(-9.3,9.74,;-9.31,8.51,;-7.98,7.73,;-6.64,8.49,;-5.31,7.71,;-5.32,6.17,;-6.66,5.41,;-6.67,3.87,;-8.01,3.11,;-8.71,1.83,;-9.47,3.17,;-7.99,6.19,;-3.99,5.4,;-2.65,6.16,;-1.32,5.39,;-1.33,3.85,;-2.66,3.08,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;2.4,-1.39,;1.33,.77,;,1.54,;-4,3.86,)|
[H][C@]1(CN2CCC2)C[C@]([H])(C1)n1cc(-c2cccc(OCc3ccccc3)c2)c2c(N)ncnc12 |wD:8.9,1.0,(6.47,-15.11,;5.71,-13.78,;4.93,-15.11,;5.69,-16.44,;5.68,-17.98,;7.22,-17.99,;7.23,-16.45,;5.31,-12.3,;6.81,-11.9,;6.02,-10.55,;7.2,-13.39,;7.59,-10.56,;6.61,-9.37,;7.45,-8.07,;7.04,-6.58,;5.56,-6.19,;5.15,-4.71,;6.24,-3.6,;7.73,-3.99,;8.81,-2.89,;10.15,-3.66,;11.48,-2.89,;12.81,-3.66,;14.12,-2.9,;14.13,-1.36,;12.8,-.59,;11.48,-1.36,;8.13,-5.47,;8.94,-8.47,;10.35,-7.7,;10.34,-6.15,;11.69,-8.46,;11.69,-10.01,;10.35,-10.79,;9.02,-10.01,)|
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:17.19,19.22,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.56,;1.86,5.34,;1.1,6.31,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,)|
Nc1ncnc2n(cc(-c3cccc(OC[C@@H]4CCCO4)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:23.26,16.15,25.29,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.55,;1.86,5.34,;.91,6.55,;1.49,7.98,;.54,9.2,;-.98,9.12,;-1.51,10.57,;-.3,11.52,;.98,10.66,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,)|
CC1(C)CC[C@@H](COc2cccc(c2)-c2cn([C@@H]3C[C@H](CN4CCC4)C3)c3ncnc(N)c23)O1 |r,wU:5.5,wD:17.17,19.20,(-1.8,11.77,;-1.51,10.57,;-2.39,9.7,;-.3,11.52,;.98,10.66,;.54,9.2,;1.49,7.98,;.91,6.55,;1.86,5.34,;3.38,5.56,;4.33,4.34,;3.76,2.91,;2.23,2.7,;1.29,3.91,;1.76,1.24,;2.66,.02,;1.76,-1.24,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;-1.03,2.79,;.3,.77,;-.98,9.12,)|
CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cc(OC[C@@H]3CCCO3)ccc2F)c2c(N)ncnc12 |r,wU:21.22,wD:11.14,9.9,(4.28,-11.46,;5,-10.46,;6.22,-10.59,;4.36,-9.06,;2.83,-8.9,;2.2,-7.5,;3.1,-6.26,;4.64,-6.41,;5.27,-7.81,;2.74,-4.76,;3.54,-3.45,;2.24,-2.7,;1.42,-3.96,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;5.86,4.56,;6.43,5.99,;7.96,6.21,;9.01,5.1,;10.39,5.78,;10.17,7.31,;8.66,7.57,;3.38,5.55,;1.86,5.34,;1.29,3.91,;.07,3.74,;.3,.77,;-1.03,1.55,;-1.03,2.79,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,)|
COc1ccc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)C2CCCC2)nc1C
COc1ccc(cc1S(=O)(=O)Nc1ccc(O)cc1)-c1sc(NC(=O)C(C)(C)C)nc1C
Fc1ccc(NC(=O)Nc2ccc(cn2)-c2nc3CCSCc3c(n2)N2CCOCC2)cc1Cl
Fc1ccc(NC(=O)Nc2ccc(cn2)-c2nc3CCS(=O)(=O)Cc3c(n2)N2CCOCC2)cc1Cl
FC(F)(F)c1cc(NC(=O)N2CCN(CC2)c2nc3CCSCc3c(n2)N2CCOCC2)ccc1Cl
FC(F)(F)c1cc(NC(=O)N2CCN(CC2)c2nc3CCS(=O)(=O)Cc3c(n2)N2CCOCC2)ccc1Cl
CC(=O)c1cccc(NC(=O)c2cc3ccccc3[nH]2)c1
CC(=O)c1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1
O=C(Nc1cccc(c1)C(=O)c1ccccc1)c1cc2ccccc2[nH]1
O=C(Nc1ccc(cc1)C(=O)c1ccccc1)c1cc2ccccc2[nH]1
CC(O)c1cccc(NC(=O)c2cc3ccccc3[nH]2)c1
CC(O)c1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1
OC(c1ccccc1)c1cccc(NC(=O)c2cc3ccccc3[nH]2)c1
OC(c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1
C[C@@H](N1c2cc(ccc2C(=O)NC1(C)C)-n1c2cccnc2[nH]c1=O)c1ccccc1 |r|
CC1(C)OCCn2c1nc1c(nc(nc21)-c1cnc(N)nc1)N1CCOCC1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2nc3n(CCOC3(C)C)c2n1
COC1(COC1)c1nc2c(nc(nc2n1C)-c1cnc(N)nc1)N1CCOCC1
Cn1c(nc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1)C1(O)COC1
Cn1c(nc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1)C1CCC1
CCc1nc2c(nc(nc2n1C)-c1cnc(N)nc1)N1CCOCC1
Cn1cnc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2nc(n(CCO)c2n1)C(C)(C)O
Cc1c(sc2c1nc(nc2N3CCOCC3)c4cnc(nc4)N)CN5CCN(CC5)C(=O)[C@H](C)O
COC1(COC1)c1sc2c(nc(nc2c1C)-c1cnc(N)nc1)N1CCOCC1
COC(C)(C)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
Nc1nccc(n1)-c1c[nH]c2ncccc12
CCCCc1cc(nc(N)n1)-c1c[nH]c2ncccc12
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1ccc(N)nc1
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1ccco1
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1cn[nH]c1
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1ccn[nH]1
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1cnn(CCN(C)C)c1
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1cnn(CC(C)C)c1
CCCCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1cnn(c1)C1CCNCC1
OC(=O)c1ccc2occ(\C=N\Nc3nc4CCSCc4c(n3)N3CCOCC3)c(=O)c2c1
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
C[C@]12[C@H](O)CC(=O)c3coc(c13)C(=O)c1c3CCC(=O)c3ccc21 |r|
C[C@]12[C@@H](CC(=O)c3coc(c13)C(=O)c1c3CCC(=O)c3ccc21)OC(=O)CCC(O)=O |r|
C[C@]12[C@@H](CC(=O)C(=CNCC(O)=O)C1C(=O)C(=O)c1c3CCC(=O)c3ccc21)OC(=O)CCC(O)=O |r,w:7.7|
COCCn1cnc2ccc(cc2c1=O)-c1cnc(COC2CC2)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CCc1cc(CNc2cc(Cl)nn3c(c(C)nc23)-c2ccc(OC)c(c2)S(=O)(=O)NCCO)ccn1
COc1ccc(cc1)-c1c2ccccc2cc2c1oc(cc2=O)N1CCOCC1
O=c1cc(oc2c(-c3ccccc3)c3ccccc3cc12)N1CCOCC1
Cc1c(Cc2c(CO)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
CC(=O)NCc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CC(O)C1)C(F)(F)F)N1CCOCC1
Cc1c(Nc2c(CO)nc3c(N)cc(nn23)N2CCOC(CO)C2)cccc1C(F)(F)F
Cc1nc2c(cc(nn2c1Nc1cccc(c1CN1CC(O)C1)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1c(Cc2c(CNCCS(C)(=O)=O)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
CN(CCS(C)(=O)=O)Cc1nc2c(N)cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(N)=O
CN1CCN(Cc2c(Nc3c(C)nc4c(N)cc(nn34)N3CCOCC3)cccc2C(F)(F)F)CC1
Cc1c(Cc2c(CO)nc3c(cc(nn23)N2CCOCC2)C(O)=O)cccc1C(F)(F)F
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
Cc1nc2c(N)cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1N1CCOCC1)-c1ccc2nccc(-c3ccc(CN4CCOCC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(-c3ccc(Cn4cncn4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN4CCN(CCO)CC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN(C)CCO)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(-c3ccc(CN4CCOCC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(N3CCOCC3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccc(Cn4cncn4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(Cn4ccnc4)cc3)c2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccc(Cn4cncn4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(Cl)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(N3CCCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(C)cc3)c2c1
CNCCN(C)Cc1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN4CCCCC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN4CCN(CC4)C(C)C)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN(C)C)cc3)c2c1
CN(C)Cc1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(-c3ccc(CN(C)C)cc3)c2c1
CN(CCO)Cc1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CN(CCO)Cc1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccc(CN4CCOCC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN4CCN(C)CC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(Cn4ccnc4C)cc3)c2c1
CCN(Cc1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1)C1CCCCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(Cn4cccn4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN(CCO)CCO)cc3)c2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccc(CN4CCOCC4)cc3)c2c1
CCN(CC)Cc1ccc(cc1)-c1ccnc2ccc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN4CCCC4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(-c3ccc(CN(C)CCO)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(Cn4cncn4)cc3)c2c1
CCC(=O)N1CC[C@@H](C1)Oc1ccnc2ccc(nc12)-c1ccc(OC)nc1 |r|
COc1ccc(cc1OC)-c1ccc2ncnc(O[C@@H]3CCN(C)C3)c2c1 |r|
COc1ccc(cn1)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(CC3)C(C)=O)c2c1
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2ccc(cc12)-c1ccc(OC)nc1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2ccc(cc12)-c1cnc(OC)c(c1)C#N |r|
COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C)C3)c2c1 |r|
COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C3)C(C)=O)c2c1 |r|
COc1ccc(cc1OC)-c1ccc2ncnc(O[C@H]3CCN(C3)C(=O)OC(C)(C)C)c2c1 |r|
CCC(=O)N1CC[C@H](C1)Oc1cnc2ccc(cc2n1)-c1ccc(OC)c(OC)c1 |r|
COc1ccc(cc1OC)-c1ccc2ncnc(O[C@@H]3CCN(C3)C(C)=O)c2c1 |r|
COc1ccc(cc1OC)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(CC3)C(C)=O)c2c1
COc1ncc(cc1C#N)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(CC3)C(C)=O)c2c1
CCC(=O)N1CC[C@@H](C1)Oc1cnnc2ccc(cc12)-c1ccc(OC)nc1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ccnc2ccc(cc12)-c1ccc(OC)nc1 |r|
COc1ccc(cc1OC)-c1ccc2ncnc(O[C@@H]3CCN(C3)C(=O)OC(C)(C)C)c2c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1cnc2ccc(cc2n1)-c1ccc(OC)c(OC)c1 |r|
N#CCc1ccc(Nc2ncnc3ccc(cc23)-c2ccc3OCOc3c2)cc1
[O-][N+](=O)c1cccc(c1)-c1ccc2ncnc(Nc3ccc(CC#N)cc3)c2c1
CC(=O)c1ccc(cc1)-c1ccc2ncnc(Nc3ccc(CC#N)cc3)c2c1
N#CCc1ccc(Nc2ncnc3ccc(cc23)-c2ccncc2)cc1
Oc1cccc(c1)-c1ccc2ncnc(Nc3ccc(CC#N)cc3)c2c1
C[C@H](Nc1ccccc1C(O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1 |r|
C=Cc1ccc(cc1)-c1ccc2ncnc(Nc3ccc(CC#N)cc3)c2c1
COc1cc2ncnc(Nc3ccc(CC#N)cc3)c2cc1OC
N#CCc1ccc(Nc2ncnc3ccc(cc23)-c2ccc3[nH]ccc3c2)cc1
N#CCc1ccc(Nc2ncnc3ccc(cc23)-c2ccc3OCCOc3c2)cc1
N#CCc1ccc(Nc2ncnc3ccc(cc23)-c2ccccc2)cc1
COc1c(ccc2c1N=C(N3C2=NCC3)NC(=O)c4cnc(nc4)N)OCCCN5CCOCC5
N#CCc1ccc(Nc2ncnc3ccc(cc23)-c2cncc3ccccc23)cc1
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOC[C@@H]1C |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOC(C)C1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC(C)C2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CC(F)(F)F)c2n1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CC(F)(F)F)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OCC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@H](C)O[C@H](C)C2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1C[C@@H]2C[C@H]1CO2 |r|
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CC2CCC(C1)O2
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2C3CCC2COC3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2C3CCC2COC3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC(C)C2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C2CCC1COC2
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2cnn(C3CCN(CC3)C(=O)OCC)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@H]2C)c2cnn(C3CCN(CC3)C(=O)OCC)c2n1 |r|
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOC[C@@H]1C |r|
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOC[C@H]1C |r|
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOC[C@H]1C |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CC(F)(F)F)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2C3CCC2COC3)c2cnn(CC(F)(F)F)c2n1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CC(F)(F)F)c2n1
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C2CCC1COC2
CNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@@H]3C[C@H]2CO3)c2cnn(CC(F)(F)F)c2n1 |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@H]3C[C@@H]2CO3)c2cnn(CC(F)(F)F)c2n1 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1C[C@H]2C[C@@H]1CO2 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C[C@@H]2C[C@H]1CO2 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C[C@H]2C[C@@H]1CO2 |r|
COc1cc(cc(OC)c1O)-c1cn(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1csc(n1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1ccc(o1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1ccc(o1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NN(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NN2CCCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:35:42:38.39|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2 |TLB:6:27:34:30.31|
CN(C)CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2 |TLB:9:30:37:33.34|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1)N1CC2CCC(C1)O2 |TLB:6:34:41:37.38|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(NC)nc2)cc1)N1CC2CCC(C1)O2 |TLB:6:29:36:32.33|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(nc2)N(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:30:37:33.34|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCOCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CC2CCC(C1)O2 |TLB:6:27:34:30.31|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CC2CCC(C1)O2 |TLB:6:34:41:37.38|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:32:39:35.36|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CC4CCC(C3)O4)c3cnn(CC(F)(F)F)c3n2)cc1 |TLB:23:24:31:27.28|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCNCC2)cc1)N1CC2CCC(C1)O2 |TLB:9:36:43:39.40|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(NCCN(C)C)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N(C)CCN(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:34:41:37.38|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CN)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:29:36:32.33|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CN3CCN(C)CC3)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:35:42:38.39|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:29:36:32.33|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCO)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:30:37:33.34|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(OCCN3CCOCC3)nc2)cc1)N1CC2CCC(C1)O2 |TLB:6:36:43:39.40|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CN(C)C)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:31:38:34.35|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CC)c2n1 |TLB:14:15:22:18.19|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CCN(C)C)c2n1 |TLB:14:15:22:18.19|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCN(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:26:33:29.30|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3cccnc3)cc2)CC1 |TLB:15:16:23:19.20|
CN1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3ccncc3)cc2)CC1 |TLB:12:13:20:16.17|
COC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:13:14:21:17.18|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:13:14:21:17.18|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:14:15:22:18.19|
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:15:16:23:19.20|
OCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:15:16:23:19.20|
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:15:16:23:19.20|
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:18:19:26:22.23|
O=C(Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1)Nc1cccnc1 |TLB:11:12:19:15.16|
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:18:19:26:22.23|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sc(CN3CCN(C)CC3)cc2n1 |TLB:13:14:21:17.18|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sc(CN3CCN(CC3)S(C)(=O)=O)cc2n1 |TLB:13:14:21:17.18|
CN1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)NC3CC3)cc2)CC1 |TLB:12:13:20:16.17|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)NC3CC3)cc2)CC1 |TLB:15:16:23:19.20|
CN1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3cccnc3)cc2)CC1 |TLB:12:13:20:16.17|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3ccncc3)cc2)CC1 |TLB:15:16:23:19.20|
Oc1cccc(c1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Nc1ncc(cn1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Oc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Nc1ccc(cn1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
C1CC2CN(CC1O2)c1nc(nc2ccsc12)-c1ccc2[nH]ccc2c1 |TLB:8:4:7:0.1|
CC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:12:13:20:16.17|
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2sccc2n1
CC(=O)N1CCC(CC1)n1cnc2c(nc(nc12)-c1cccc(CO)c1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccn4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccc4F)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(F)cc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(cc4)-c4ccncc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(CC3)c3ccc(F)cc3F)c2n1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCNCC3)c2n1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(Cl)cc4)CC3)c2n1
Cc1ccc(CN2CCC(CC2)n2cnc3c(nc(nc23)-c2cncc(O)c2)N2CCOCC2)cc1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(F)nc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCNCC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4cccnc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(nc4)N4CCOCC4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4cncc(Cl)c4)CC3)c2n1
COc1ccc(CN2CCC(CC2)n2cnc3c(nc(nc23)-c2cccc(O)c2)N2CCOCC2)cn1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCNCC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2cnn(CC(F)(F)F)c2n1 |t:15|
FCCNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2cnn(CC(F)(F)F)c2n1 |t:17|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)C1=CCOCC1 |t:34|
Oc1cccc(c1)-c1nc(C2=CCOCC2)c2cnn(-c3ccccc3)c2n1 |t:11|
Oc1cccc(c1)-c1nc(C2CCOCC2)c2cnn(-c3ccccc3)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:16|
FCCNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:17|
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:21|
O=C(Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1)Nc1cccnc1 |t:13|
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:21|
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
Oc1ccc(cc1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
OCc1ccc(cc1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
NC(=O)c1ccc(cc1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
CS(=O)(=O)c1ccc(cc1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1ccc2cc[nH]c2c1
C1COc2cc(ccc2O1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1Oc2ccc(cc2O1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1ccsc1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1ccoc1
Oc1cccc(c1)-c1nc(N2CCCCC2)c2[nH]cnc2n1
N#Cc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
CS(=O)(=O)c1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
CS(=O)(=O)Nc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
Oc1ccccc1-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1cccs1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CC3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CC3CCN(Cc4ccccc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ccn(C3CCNCC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC(C)(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C)c2n1
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)NC)cc1)N1CC2CCC(C1)O2
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CCO)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CCN(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC(=O)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:26.28,wD:29.32,(3.02,-14.8,;4.36,-15.56,;5.68,-14.79,;5.68,-13.25,;7.02,-15.55,;8.35,-14.78,;8.35,-13.24,;9.67,-12.47,;11.01,-13.24,;11.01,-14.77,;9.69,-15.55,;12.33,-12.47,;12.33,-10.92,;13.67,-10.15,;13.67,-8.59,;12.33,-7.83,;12.33,-6.27,;12.92,-4.89,;14.43,-4.89,;15.02,-6.27,;15.02,-7.83,;13.67,-5.5,;15.02,-10.92,;16.48,-10.43,;17.4,-11.68,;16.49,-12.93,;16.97,-14.39,;18.51,-14.4,;19.27,-15.74,;18.48,-17.07,;19.24,-18.41,;16.94,-17.05,;16.19,-15.72,;15.02,-12.46,;13.67,-13.24,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@@H]3CC[C@H](O)CC3)c2n1 |r,wU:26.28,29.32,(3.05,-14.78,;4.38,-15.55,;5.71,-14.77,;5.7,-13.24,;7.04,-15.54,;8.37,-14.77,;8.37,-13.23,;9.7,-12.46,;11.03,-13.23,;11.04,-14.76,;9.71,-15.53,;12.36,-12.45,;12.36,-10.9,;13.7,-10.13,;13.7,-8.58,;12.36,-7.81,;12.36,-6.26,;12.94,-4.86,;14.45,-4.86,;15.04,-6.26,;15.04,-7.81,;13.7,-5.5,;15.04,-10.9,;16.51,-10.42,;17.42,-11.67,;16.52,-12.92,;17,-14.38,;16.19,-15.69,;16.92,-17.04,;18.46,-17.08,;19.19,-18.44,;19.26,-15.77,;18.53,-14.41,;15.04,-12.45,;13.7,-13.22,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@H]3CC[C@@H](CC3)OC)c2n1 |r,wU:26.28,wD:29.35,(2.25,-14.82,;3.57,-15.58,;4.9,-14.81,;4.9,-13.27,;6.23,-15.57,;7.56,-14.8,;7.56,-13.26,;8.89,-12.49,;10.22,-13.26,;10.23,-14.79,;8.91,-15.57,;11.55,-12.49,;11.55,-10.93,;12.89,-10.17,;12.89,-8.61,;11.55,-7.84,;11.55,-6.29,;12.13,-4.9,;13.65,-4.9,;14.23,-6.29,;14.23,-7.84,;12.89,-5.52,;14.23,-10.93,;15.7,-10.45,;16.61,-11.7,;15.71,-12.95,;16.19,-14.41,;17.72,-14.39,;18.5,-15.73,;17.74,-17.07,;16.2,-17.07,;15.43,-15.75,;18.52,-18.4,;20.06,-18.39,;14.24,-12.48,;12.89,-13.26,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@@H]3CC[C@@H](CC3)OC)c2n1 |r,wU:26.28,29.35,(3.04,-14.26,;4.37,-15.02,;5.7,-14.25,;5.7,-12.71,;7.04,-15.01,;8.37,-14.24,;8.36,-12.7,;9.69,-11.93,;11.03,-12.7,;11.03,-14.23,;9.71,-15.01,;12.35,-11.93,;12.35,-10.38,;13.69,-9.61,;13.69,-8.05,;12.35,-7.28,;12.35,-5.73,;12.94,-4.34,;14.45,-4.34,;15.04,-5.73,;15.04,-7.28,;13.69,-4.96,;15.04,-10.38,;16.5,-9.89,;17.42,-11.14,;16.51,-12.39,;16.99,-13.85,;16.19,-15.17,;16.93,-16.51,;18.47,-16.55,;19.27,-15.23,;18.53,-13.88,;19.21,-17.9,;18.41,-19.22,;15.04,-11.92,;13.69,-12.7,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC(CC3)(OC)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCCO4)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1)Nc1cccnc1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2nnn(C3CC3)c2n1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
Cn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2nnn(C3CC3)c2n1)Nc1cccnc1
Cn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccs2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccs2)cc1)N1CCOCC1
O=C(Nc1cccs1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2nnn(C3CC3)c2n1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccnc(C)c2)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N(C)C)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)OC)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1)N1CCOCC1
CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3nnn(CC)c3n2)cc1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)C)cc1)N1CCOCC1
CCCCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3nnn(CC)c3n2)cc1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCc2ccccn2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN2CCN(C)CC2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCCN(C)C)cc1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2nnn(C3CCN(Cc4ccccc4)CC3)c2n1
Cc1c(cccc1N)N
c1ccc(c(c1)O)O
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOCC1 |r|
CN(C)Cc1ccc(cc1)-c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2sc(cc2n1)C(C)(C)O
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3)S(C)(=O)=O)cc2n1
CC(C)(O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
CC(=O)NCc1cc2nc(nc(N3CCOCC3)c2s1)-c1cccc2[nH]ncc12
CC(C)(O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cccc2[nH]ncc12
CC(O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cccc2[nH]ncc12
OCc1cc2nc(nc(N3CCOCC3)c2s1)-c1cccc2[nH]ncc12
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2ccc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2ccc(N)cc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc(CO)c2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2ccccc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2ccncc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccnc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc(O)c2)CC1
Nc1ncnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1CCCC1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2cc(nn12)-c1ccncc1
CN(C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12)c1cccnc1
CN(Cc1ccccc1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(Cc1ccccn1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(Cc1ccncc1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(Cc1cccnc1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)NCc1cccnc1
COC1CCN(C1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(C)C1CCN(C1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCCCC1
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCCC1
CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1C2CCC1COC2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCOCC1
CCN(CC)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(C)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1C2CCC1COC2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CC2CCC1CO2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCOCC1
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4ccc(nc4)N4CCOCC4)cc3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4ccccc4)cc3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
CN(C)CCNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(N5CC6CCC(C5)O6)c34)C(=O)c2c1
CCNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(N5CC6CCC(C5)O6)c34)C(=O)c2c1
CNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(N5CC6CCC(C5)O6)c34)C(=O)c2c1
CNC(=O)Nc1cccc2O\C(=C/c3cn(C)c4nccc(-c5ccccc5)c34)C(=O)c12
CNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(-c5ccccc5)c34)C(=O)c2c1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccccc1
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2ccccc12
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2c(cccc12)-c1ccccc1
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2cccnc12
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2c(ccnc12)-c1ccccc1
Cn1cc(\C=C2/Oc3cc(O)ccc3C2=O)c2c(ccnc12)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
CN(C)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CCOCC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCOCC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CC2CCC(C1)O2
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CCN(CCO)CC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCN(CCO)CC1
CCn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CCN(CCO)CC1
CN(C)C(=O)c1cccc(c1)-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
CN(C)C(=O)c1ccccc1-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(N)=O
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CN)CC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(N)CC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCOCC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1C2CCC1COC2
CN1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(c2c1nccc2N3CCN(CC3)C)/C=C\4/C(=O)c5c(cc(cc5O4)O)O
O=C(Nc1ccc(cc1)N1CCNCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(cc3)-c3nc(nc(n3)N3C4CCC3COC4)N3C4CCC3COC4)cc2)CC1
CN(C)Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CNCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CN(C)CCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CN1CCN(CCOc2ccc(NC(=O)Nc3ccc(cc3)-c3nc(nc(n3)N3C4CCC3COC4)N3C4CCC3COC4)cc2)CC1
O=C(Nc1ccc(OCCN2CCCC2)cc1)Nc1ccc(cc1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
OCCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2[C@@H](CO)CC[C@H]2CO)cc1 |r|
CC(C)Nc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1C2CCC1COC2
CC(C)N(C)c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1C2CCC1COC2
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCSCC2)N2C3CCC2COC3)cc1
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1C2CCC1COC2 |r|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)C2=CCOCC2)N2C3CCC2COC3)cc1 |t:30|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
O=C(Nc1ccc(cc1)N1CCNCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1C2CCC1COC2)C1CCOCC1
CCN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CC(C)N1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)C1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)CCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCNCC2)cc1)N1C2CCC1COC2 |r|
CCN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)N2C3CCC2COC3)cc1 |r|
CC(C)N1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)N2C3CCC2COC3)cc1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCC(CC2)N(C)C)cc1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1C2CCC1COC2 |r|
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)N2C3CCC2COC3)cc1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(OCCN(C)C)cc2)cc1)N1C2CCC1COC2 |r|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)C2CCOCC2)cc1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCC(CC2)N(C)C)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(CN(C)C)cc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(OCCN(C)C)cc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)C)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCNCC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCC(CC2)N(C)C)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C[C@@H]2C[C@H]1CO2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2cccnc2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CCOC[C@H]1C |r|
COc1ccc2n(CCCN3CCN(CCO)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCN(C)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCOCC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN(C)C)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCN(CCO)CC3)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCOCC3)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN(C)C)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCN(CCCO)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCN(C)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCOCC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN(C)C)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCN(CCCO)CC3)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Cn1c(c(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2ccccc12)-c1ccccc1
COc1ccc2n(C)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(C)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2[nH]c(c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1)-c1cccnc1
COc1ccc2[nH]c(c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1)-c1ccccc1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccc4ccccc4c3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccc(Cl)cc3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccc(F)cc3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccccn3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccccc3)C(=O)c2c(O)c1
COc1ccc2[nH]c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Cc1[nH]c2ccc(Br)cc2c1\C=C1/Oc2cc(O)cc(O)c2C1=O
Cc1[nH]c2ccccc2c1\C=C1/Oc2cc(O)cc(O)c2C1=O
Oc1cc2O\C(=C/c3c[nH]c4ccc(Oc5ccccc5)cc34)C(=O)c2c(O)c1
COc1ccc2[nH]cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Oc1cc2O\C(=C/c3c[nH]c4ccc(Br)cc34)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c[nH]c4ccc(Cl)cc34)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c[nH]c4ccccc34)C(=O)c2c(O)c1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ncnc2sc(cc12)-c1ccncc1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
Cc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
Nc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
CN(C)Cc1c[nH]c2c(nc(nc12)-c1cccc(CO)c1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(CN3CCCC3)c2n1
Cn1ccc2nc(nc(N3CCOCC3)c12)-c1cccc(CO)c1
Cn1cc(CN2CCCC2)c2nc(nc(N3CCOCC3)c12)-c1cccc(CO)c1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(C3CCNCC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(C3CCN(Cc4ccc(F)cc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2cc[nH]c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc[nH]c2n1
CN(C)CCn1ccc2c(nc(nc12)-c1cccc(CO)c1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1cccc(O)c1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccccn2)cc1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(F)cc2)cc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN(C)C)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cc[nH]c2n1
FC(F)(F)Cn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
COC(Cn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1)OC
O=CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN3CCCC3)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN3CCCCC3)c2n1
CN(C)CCNCCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CN1CCN(CCn2ccc3c(nc(nc23)-c2ccc(NC(=O)Nc3ccncc3)cc2)N2CCOCC2)CC1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN3CCNCC3)c2n1
OCCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CN(C)CCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CN(C)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCNCC2)cc1)N1CCOCC1
CN(Cc1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1)S(C)(=O)=O
CN(Cc1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1)C(C)=O
CC(C)(N)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
Cc1c(CN2CCN(CC2)S(C)(=O)=O)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
CN(Cc1sc2c(nc(nc2c1C)-c1cnc(N)nc1)N1CCOCC1)C(C)=O
CN1CCN(CC1)C(=O)c1cccc(c1)-c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
CN1CCN(CC1)C(=O)c1cccc(c1)-c1sc2c(nc(nc2c1C)-c1cnc(N)nc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC(C)(C)C)c2n1
NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
OCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC(C)C)c2n1
C1CN(CCO1)c1nc(nc2n(ncc12)-c1ccccc1)-c1ccc2[nH]ccc2c1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CC(C)NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
OCCOC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCO)cc2)cc1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CCOCC1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCN3CCN(C)CC3)cc2)cc1)N1CCOCC1
CN(C)CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
O=C(Nc1ncc[nH]1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCN3CCCC3)cc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1)Nc1cccnc1
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CONC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Nc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
CN(C)C(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
CN1CCC(CC1)NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
CN(C(C)=O)c1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
Nc1cccc(n1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CONC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Nc1ccc(nc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CC(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
CC(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
CN(C)NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CNC(=O)Cc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-3.98,-22,;-3.98,-23.54,;-2.64,-24.31,;-2.64,-25.86,;-1.31,-26.62,;.03,-25.85,;1.49,-26.32,;2.4,-25.07,;1.49,-23.82,;2.09,-22.4,;1.32,-21.07,;1.95,-19.66,;.8,-18.64,;.8,-17.11,;-.53,-16.34,;-1.86,-17.12,;-3.2,-16.35,;-3.2,-14.81,;-1.87,-14.03,;-4.54,-14.04,;-4.55,-12.51,;-5.88,-11.76,;-5.9,-10.23,;-4.57,-9.45,;-3.24,-10.21,;-3.23,-11.74,;-1.85,-18.65,;-.53,-19.4,;-.21,-20.91,;-1.24,-22.06,;.02,-24.3,;-1.31,-23.54,;3.94,-25.07,;4.84,-26.32,;4.36,-27.78,;6.3,-25.85,;6.3,-24.3,;7.55,-23.39,;4.84,-23.82,;4.36,-22.36,)|
CNC(=O)Nc1ccc2O\C(=C\c3c([nH]c4c(F)cc(OC)cc34)-c3c(C)nn(C)c3C)C(=O)c2c1 |(15.41,-12.32,;16.73,-11.54,;18.07,-12.3,;19.4,-11.53,;18.07,-13.84,;19.41,-14.61,;20.75,-13.83,;22.07,-14.6,;22.07,-16.14,;23.22,-17.16,;22.59,-18.56,;23.36,-19.9,;22.76,-21.32,;23.67,-22.57,;22.77,-23.82,;21.3,-23.34,;19.96,-24.12,;19.97,-25.65,;18.63,-23.35,;18.63,-21.81,;17.29,-21.03,;17.29,-19.49,;19.96,-21.03,;21.3,-21.8,;25.21,-22.57,;26.11,-23.81,;25.63,-25.28,;27.57,-23.34,;27.57,-21.8,;28.82,-20.89,;26.11,-21.32,;25.63,-19.85,;21.06,-18.41,;20.03,-19.56,;20.75,-16.9,;19.42,-16.14,)|
COc1cc(F)c2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-3.89,-40.1,;-3.89,-41.64,;-2.56,-42.41,;-2.56,-43.96,;-1.22,-44.72,;-1.22,-46.26,;.11,-43.95,;1.58,-44.42,;2.48,-43.17,;1.58,-41.92,;2.17,-40.5,;1.41,-39.17,;2.03,-37.76,;.88,-36.74,;.88,-35.21,;-.44,-34.43,;-1.78,-35.21,;-3.11,-34.45,;-3.12,-32.9,;-1.79,-32.13,;-4.46,-32.14,;-4.47,-30.61,;-5.8,-29.86,;-5.81,-28.33,;-4.49,-27.55,;-3.15,-28.31,;-3.14,-29.84,;-1.77,-36.75,;-.44,-37.5,;-.12,-39.01,;-1.16,-40.16,;.11,-42.4,;-1.23,-41.64,;4.02,-43.17,;4.92,-44.42,;4.45,-45.88,;6.39,-43.95,;6.39,-42.4,;7.64,-41.5,;4.92,-41.92,;4.45,-40.46,)|
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCOCC5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-2.53,-10.46,;-2.53,-12,;-1.2,-12.77,;-1.2,-14.32,;.14,-15.09,;1.47,-14.31,;2.94,-14.78,;3.85,-13.53,;2.94,-12.28,;3.54,-10.86,;2.77,-9.53,;3.4,-8.12,;2.25,-7.1,;2.25,-5.57,;.92,-4.79,;-.41,-5.57,;-1.75,-4.8,;-1.76,-3.26,;-.43,-2.49,;-3.1,-2.5,;-3.11,-.97,;-1.78,-.2,;-1.79,1.34,;-3.12,2.1,;-4.45,1.31,;-4.44,-.22,;-3.14,3.63,;-1.81,4.41,;-4.47,4.39,;-4.48,5.92,;-5.81,6.68,;-7.13,5.91,;-7.13,4.37,;-5.79,3.61,;-.41,-7.11,;.92,-7.86,;1.24,-9.37,;.21,-10.52,;1.47,-12.77,;.14,-12,;5.39,-13.53,;6.29,-14.78,;5.81,-16.25,;7.75,-14.31,;7.75,-12.77,;9,-11.86,;6.29,-12.29,;5.81,-10.82,)|
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCN(C)CC5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-2.98,-34.6,;-2.98,-36.14,;-1.64,-36.92,;-1.65,-38.46,;-.31,-39.23,;1.02,-38.45,;2.49,-38.93,;3.4,-37.68,;2.49,-36.43,;3.09,-35.01,;2.32,-33.67,;2.95,-32.27,;1.8,-31.25,;1.8,-29.71,;.47,-28.94,;-.86,-29.72,;-2.2,-28.95,;-2.21,-27.41,;-.87,-26.64,;-3.55,-26.65,;-3.56,-25.12,;-2.23,-24.34,;-2.24,-22.81,;-3.57,-22.05,;-4.9,-22.84,;-4.88,-24.36,;-3.58,-20.52,;-2.26,-19.74,;-4.92,-19.76,;-4.92,-18.23,;-6.25,-17.48,;-7.57,-18.25,;-8.9,-17.49,;-7.56,-19.78,;-6.23,-20.55,;-.85,-31.25,;.47,-32.01,;.79,-33.52,;-.24,-34.67,;1.02,-36.91,;-.31,-36.14,;4.94,-37.68,;5.84,-38.93,;5.36,-40.39,;7.3,-38.45,;7.3,-36.91,;8.55,-36,;5.84,-36.43,;5.36,-34.96,)|
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N(C)CCN(C)C)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(17.28,-35.65,;17.28,-37.19,;18.62,-37.96,;18.61,-39.51,;19.95,-40.28,;21.28,-39.5,;22.75,-39.97,;23.66,-38.72,;22.75,-37.47,;23.35,-36.05,;22.58,-34.72,;23.21,-33.32,;22.06,-32.29,;22.06,-30.76,;20.73,-29.99,;19.4,-30.77,;18.06,-30,;18.05,-28.46,;19.39,-27.68,;16.71,-27.69,;16.7,-26.16,;18.03,-25.39,;18.02,-23.86,;16.69,-23.1,;15.36,-23.88,;15.38,-25.41,;16.67,-21.56,;18,-20.79,;15.34,-20.81,;15.33,-19.27,;14.02,-21.59,;12.68,-20.83,;11.36,-21.61,;10.03,-20.85,;11.38,-23.14,;19.4,-32.3,;20.73,-33.06,;21.05,-34.56,;20.02,-35.71,;21.28,-37.96,;19.95,-37.19,;25.2,-38.72,;26.1,-39.97,;25.62,-41.44,;27.56,-39.5,;27.56,-37.96,;28.81,-37.05,;26.1,-37.48,;25.62,-36.01,)|
COc1cc(F)c2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCOCC5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-4.1,-10.42,;-4.1,-11.96,;-2.77,-12.73,;-2.77,-14.28,;-1.43,-15.05,;-1.43,-16.58,;-.1,-14.27,;1.37,-14.74,;2.27,-13.49,;1.37,-12.24,;1.96,-10.82,;1.2,-9.49,;1.82,-8.08,;.67,-7.06,;.67,-5.53,;-.65,-4.75,;-1.98,-5.53,;-3.32,-4.77,;-3.33,-3.22,;-2,-2.45,;-4.67,-2.46,;-4.68,-.93,;-3.35,-.16,;-3.36,1.37,;-4.7,2.13,;-6.02,1.35,;-6.01,-.18,;-4.71,3.67,;-3.39,4.45,;-6.04,4.42,;-6.05,5.96,;-7.38,6.72,;-8.71,5.95,;-8.7,4.41,;-7.36,3.65,;-1.98,-7.07,;-.65,-7.82,;-.33,-9.33,;-1.36,-10.48,;-.1,-12.73,;-1.44,-11.96,;3.81,-13.49,;4.72,-14.74,;4.24,-16.21,;6.18,-14.27,;6.18,-12.73,;7.43,-11.82,;4.71,-12.24,;4.24,-10.78,)|
COc1cc(F)c2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N(C)CCN(C)C)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(16.64,-8.95,;16.64,-10.49,;17.98,-11.27,;17.98,-12.81,;19.32,-13.58,;19.32,-15.12,;20.65,-12.81,;22.12,-13.28,;23.02,-12.03,;22.12,-10.78,;22.71,-9.36,;21.95,-8.02,;22.57,-6.62,;21.42,-5.6,;21.42,-4.06,;20.1,-3.29,;18.76,-4.07,;17.42,-3.3,;17.42,-1.76,;18.75,-.99,;16.08,-1,;16.07,.53,;17.4,1.31,;17.39,2.84,;16.05,3.6,;14.73,2.81,;14.74,1.29,;16.04,5.13,;17.36,5.91,;14.71,5.89,;14.69,7.42,;13.38,5.11,;12.05,5.87,;10.73,5.09,;9.39,5.85,;10.74,3.56,;18.77,-5.6,;20.1,-6.36,;20.42,-7.87,;19.38,-9.02,;20.65,-11.26,;19.31,-10.49,;24.56,-12.03,;25.46,-13.28,;24.99,-14.74,;26.93,-12.8,;26.93,-11.26,;28.18,-10.35,;25.46,-10.78,;24.99,-9.32,)|
COc1ccc2[nH]cc(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCN(C)CC5)cc4C3=O)c2c1
CNC(=O)Nc1ccc2O\C(=C\c3c([nH]c4ccc(OC)cc34)-c3c(C)nn(C)c3C)C(=O)c2c1 |(-6.21,5.21,;-4.89,5.98,;-3.55,5.22,;-2.22,5.99,;-3.55,3.68,;-2.21,2.91,;-.87,3.69,;.45,2.92,;.45,1.39,;1.6,.37,;.97,-1.04,;1.74,-2.37,;1.14,-3.79,;2.05,-5.04,;1.14,-6.29,;-.32,-5.82,;-1.66,-6.59,;-2.99,-5.82,;-2.99,-4.28,;-4.33,-3.51,;-4.33,-1.97,;-1.66,-3.51,;-.32,-4.27,;3.59,-5.04,;4.49,-6.29,;4.01,-7.75,;5.95,-5.81,;5.95,-4.27,;7.2,-3.36,;4.49,-3.79,;4.01,-2.33,;-.56,-.88,;-1.59,-2.03,;-.87,.63,;-2.2,1.38,)|
Cc1ccccc1N2C(=Nc3cccc(c3C2=O)C)Cn4cnc5c4ncnc5N
COc1ccccc1-n1c(CSc2ncnc3nc[nH]c23)nc2cccc(Cl)c2c1=O |(19.17,3.9,;19.17,2.36,;20.51,1.59,;21.84,2.36,;23.18,1.61,;23.18,.05,;21.86,-.72,;20.52,.04,;19.19,-.72,;19.2,-2.28,;20.54,-3.05,;20.54,-4.59,;21.87,-5.36,;21.86,-6.89,;23.22,-7.65,;24.55,-6.88,;24.53,-5.33,;25.67,-4.3,;25.02,-2.9,;23.5,-3.07,;23.19,-4.57,;17.86,-3.06,;16.53,-2.29,;15.19,-3.06,;13.86,-2.29,;13.85,-.75,;15.18,.02,;15.18,1.56,;16.52,-.75,;17.85,.03,;17.85,1.57,)|
Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O |(2.13,-14.38,;2.12,-12.84,;3.46,-12.06,;3.45,-10.52,;2.1,-9.75,;.77,-10.55,;.79,-12.08,;-.54,-12.85,;-.54,-14.41,;.81,-15.18,;.81,-16.72,;-.43,-17.63,;.05,-19.1,;-.74,-20.41,;-2.27,-20.38,;-3.06,-21.69,;-4.6,-21.66,;-2.32,-23.04,;-.78,-23.06,;-.03,-24.4,;.01,-21.74,;1.59,-19.09,;2.62,-20.22,;2.15,-21.69,;4.12,-19.9,;4.59,-18.43,;3.56,-17.3,;2.07,-17.63,;-1.87,-15.18,;-3.21,-14.41,;-4.55,-15.19,;-5.88,-14.42,;-5.87,-12.87,;-4.55,-12.1,;-4.56,-10.56,;-3.21,-12.87,;-1.88,-12.1,;-1.89,-10.56,)|
Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O |(16.77,-15.65,;16.76,-14.1,;18.09,-13.33,;18.08,-11.78,;16.73,-11.01,;15.41,-11.8,;15.41,-13.33,;14.09,-14.11,;14.1,-15.66,;15.44,-16.43,;15.44,-17.98,;14.2,-18.89,;14.68,-20.37,;13.89,-21.68,;14.64,-23.01,;13.86,-24.33,;12.31,-24.31,;11.52,-25.62,;11.57,-22.96,;10.03,-22.93,;12.36,-21.64,;16.22,-20.35,;17.26,-21.49,;16.78,-22.96,;18.76,-21.17,;19.22,-19.7,;18.19,-18.56,;16.7,-18.89,;12.76,-16.44,;11.42,-15.67,;10.08,-16.46,;8.75,-15.68,;8.75,-14.13,;10.08,-13.36,;10.07,-11.82,;11.42,-14.12,;12.75,-13.35,;12.74,-11.81,)|
Cc1ccccc1N2C(=Nc3cccc(c3C2=O)C)Cn4c5c(c(n4)C#CCO)c(ncn5)N
CN1CCN(CC1)c1nc2ccccc2cc1Cn1nc(-c2ccc3nc(NC(C)=O)sc3c2)c2c(N)ncnc12
CN1CCN(CC1)c1nc2ccccc2cc1Cn1nc(-c2ccc3nc(N)sc3c2)c2c(N)ncnc12
CC(C)n1c2c(c(n1)C#Cc3cccnc3)c(ncn2)N
CC(C)n1c2c(c(n1)C#Cc3cccc(c3)O)c(ncn2)N
COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(F)cc2)cc(OC)c1
COc1ccccc1N2C(=O)C3=C(CCCC3)N=C2SCC(=O)Nc4ccc5c(c4)nccn5
CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
O=C(Nc1ccc(cc1)C#N)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
COc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1OC
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
OCCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN(C)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN(C)CCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3C4CCC3COC4)cc2)CC1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1cccnc1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
Clc1cc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)ccn1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1ccc(nc1)-c1cccnc1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1cncnc1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1ccnnc1
O[C@H]1CC2COCC1N2c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1 |r,TLB:0:1:8:5.4.6|
COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCC(O)CC2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)N2CC(C)OC(C)C2)c1
Cn1c2c(cn1)c(nc(n2)N3CCS(=O)(=O)CC3)Nc4cccc(c4)OC
COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCCCC2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc(OC)c2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc(c2)S(C)(=O)=O)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc(c2)C(N)=O)c1
CNC(=O)c1cccc(c1)-c1nc(Nc2cccc(OC)c2)c2cnn(C)c2n1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc(NC(C)=O)c2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccnc2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cnc(N)nc2)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc3[nH]ncc23)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc3[nH]nc(N)c23)c1
COc1cccc(Nc2nc(nc3n(C)ncc23)-c2cccc3onc(C)c23)c1
Cn1c2c(cn1)c(nc(n2)c3cccc4c3c[nH]n4)NCCCS(=O)(=O)C
Cn1ncc2c(NCC(C)(C)CO)nc(nc12)-c1cccc2[nH]ncc12
CN1CCC(CC1)Nc1nc(nc2n(C)ncc12)-c1cccc2[nH]ncc12
Cn1ncc2c(Nc3ccc(cc3)S(C)(=O)=O)nc(nc12)-c1cccc2[nH]ncc12
Cn1ncc2c(Oc3ccc(cc3)S(C)(=O)=O)nc(nc12)-c1cccc2[nH]ncc12
Cn1ncc2c(nc(nc12)-c1cccc2[nH]ncc12)-c1ccc(cc1)S(C)(=O)=O
OC(=O)N1CCN(CC1)c1ccc(Nc2ccnc3ccc(cc23)-c2cnc3ccccc3c2)cc1C(F)(F)F
COCCC(=O)N1CCN(CC1)c1ccc(Nc2ccnc3ccc(cc23)-c2cnc3ccccc3c2)cc1C(F)(F)F
CN(C)CCC(=O)N1CCN(CC1)c1ccc(Nc2ccnc3ccc(cc23)-c2cnc3ccccc3c2)cc1C(F)(F)F
CC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Oc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
Oc1ccccc1-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
Oc1ccc(cc1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
C1CN(CCO1)c1nc(Nc2ccc3[nH]ncc3c2)cc(n1)-c1ccccc1
Fc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
Clc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
COc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
N#Cc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
COC(=O)c1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
OCCOc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1ccnc(n1)N1CCOCC1
CNc1cc(nc(n1)N1CCOCC1)-c1cccc(O)c1
Oc1cccc(c1)-c1cc(Nc2ccccc2)nc(n1)N1CCOCC1
COc1ccc(Nc2cc(nc(n2)N2CCOCC2)-c2cccc(O)c2)cc1
Oc1cccc(c1)-c1cc(Nc2cccnc2)nc(n1)N1CCOCC1
COc1ccc(Nc2cc(nc(n2)N2CCOCC2)-c2cccc(O)c2)cn1
Oc1cccc(c1)-c1cc(Oc2cccnc2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(NCc2cccnc2)nc(n1)N1CCOCC1
OC1CCC(CC1)Nc1cc(nc(n1)N1CCOCC1)-c1cccc(O)c1 |(29.43,-18.98,;28.1,-19.75,;26.75,-18.99,;25.43,-19.77,;25.44,-21.3,;26.77,-22.07,;28.1,-21.29,;24.1,-22.07,;24.11,-23.61,;22.78,-24.39,;22.78,-25.93,;24.11,-26.7,;25.45,-25.93,;25.45,-24.38,;26.78,-26.7,;26.78,-28.24,;28.11,-29.01,;29.45,-28.24,;29.45,-26.7,;28.11,-25.92,;21.45,-26.7,;20.11,-25.93,;18.78,-26.69,;18.77,-28.24,;20.12,-29.01,;20.12,-30.55,;21.45,-28.24,)|
CC(=O)N1CCN(CC1)c1cc(nc(n1)N1CCOCC1)-c1cccc(O)c1
Oc1cccc(c1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Oc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCSCC1
Oc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCS(=O)CC1
Oc1cccc(c1)-c1cc(Nc2ccc3[nH]ncc3c2)nc(n1)N1CCNCC1
COCCNc1nc(Nc2ccc3[nH]ncc3c2)cc(n1)-c1cccc(O)c1
C[C@H]1CN(C[C@@H](C)O1)c1nc(Nc2ccc3[nH]ncc3c2)cc(n1)-c1cccc(O)c1 |r|
C[C@@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)c2c1oc1c(C=O)c(O)c(O)cc21 |r|
C[C@@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)C2=C3CC(=O)C(=O)C(Br)=C3OC12O |r,c:14,22|
C[C@H]1CCC2([C@H](C)CCCC2(C)C)c2c1oc1c(Br)c(O)c(O)cc21 |r|
COc1ccc2c3c(oc2c1Br)[C@H](C)CC[C@H]1C(C)(C)CCC[C@]31C |r|
C[C@@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)c2c1oc1c(Br)c(O)ccc21 |r|
C[C@@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)c2c1oc1ccc(O)cc21 |r|
C[C@@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)c2c1oc1cc(O)ccc21 |r|
C[C@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)c2c1oc1cc(O)ccc21 |r|
CC1(C)CCC[C@@]2(C)[C@H]1CCC1(O)OC3=CC(=O)C(=O)CC3=C21 |r,t:15,23|
COc1cc2c3c(CC[C@H]4C(C)(C)CCC[C@]34C)oc2c(C=O)c1OC |r|
CC1(C)CCC[C@@]2(C)[C@H]1CCc1oc3c(C=O)c(O)c(O)cc3c21 |r|
COc1cc2c3c(CC[C@H]4C(C)(C)CCC[C@]34C)oc2c(C=O)c1O |r|
CC1(C)CCC[C@@]2(C)[C@H]1CCc1oc3c(C(N)=O)c(O)c(O)cc3c21 |r|
c1cncc(c1)C#Cc1n[nH]c2ncccc12
c1cnc2[nH]nc(C#Cc3ccncc3)c2c1
N#Cc1ccc(cc1)C#Cc1n[nH]c2ccccc12
c1cc(cs1)C#Cc1n[nH]c2ccccc12
FC(F)(F)c1cc(cc(c1)C(F)(F)F)C#Cc1n[nH]c2ccccc12
Nc1ccccc1C#Cc1n[nH]c2ccccc12
C1CC1C#Cc1n[nH]c2ccccc12
C1CCC(C1)C#Cc1n[nH]c2ccccc12
Nc1cccc(c1)C#Cc1n[nH]c2ccccc12
c1ccc(nc1)C#Cc1n[nH]c2ccccc12
CN(C)CC#Cc1n[nH]c2ccccc12
c1ccc2c(n[nH]c2c1)C#Cc1ccncc1
c1ccc2c(n[nH]c2c1)C#Cc1cccnc1
Fc1cc(F)cc(c1)C#Cc1n[nH]c2ccccc12
c1ccc(cc1)C#Cc1n[nH]c2ccccc12
Nc1ccc(cc1)C#Cc1n[nH]c2ccccc12
c1cc2cc(cnc2[nH]1)-c1ccncc1
Nc1ncnc2sc(nc12)-c1ccncc1
O=c1[nH]cc(cc1C#N)-c1ccncc1
Oc1ccc2oc(nc2c1)-c1ccncc1
Nc1nc2nc(ccn2n1)-c1ccncc1
Nc1ccc2oc(nc2c1)-c1ccncc1
O=c1[nH]cnc2cc(ccc12)N1CCOCC1
C1CN(CCO1)c1ccnc2[nH]ncc12
Cc1nc(sc1C(O)=O)N1CCOCC1
Nc1ncnc2nc(ncc12)N1CCOCC1
Nc1nc2cc(ccc2s1)-c1ccncc1
Nc1nc2ccc(cc2s1)-c1cccc(O)c1
CS(=O)(=O)Nc1cccc(c1)-c1cc(NCCc2ccncc2)nc(n1)N1CCOCC1
C(Cc1ccccn1)Nc1cc(nc(n1)N1CCOCC1)-c1cccc2[nH]ncc12
C(Cc1cccnc1)Nc1cc(nc(n1)N1CCOCC1)-c1cccc2[nH]ncc12
C(Cc1ccncc1)Nc1cc(nc(n1)N1CCOCC1)-c1cccc2[nH]ncc12
C(Oc1cc(nc(n1)N1CCOCC1)-c1ccc2cc[nH]c2c1)c1ccccn1
CS(=O)(=O)Nc1ccc(cc1)-c1cc(OCc2ccccn2)nc(n1)N1CCOCC1
C(Oc1cc(nc(n1)N1CCOCC1)-c1cccc2[nH]ncc12)c1ccccn1
C(Cc1ccccn1)Nc1nc(cc(n1)-c1cccc(c1)-c1ccc2cc[nH]c2c1)N1CCOCC1
C(Cc1cccnc1)Nc1nc(cc(n1)-c1ccc2cc[nH]c2c1)N1CCOCC1
C(Cc1ccncc1)Nc1nc(cc(n1)-c1ccc2cc[nH]c2c1)N1CCOCC1
CS(=O)(=O)Nc1cccc(c1)-c1cc(nc(NCCc2ccccn2)n1)N1CCOCC1
CS(=O)(=O)Nc1cccc(c1)-c1cc(nc(NCCc2cccnc2)n1)N1CCOCC1
CS(=O)(=O)Nc1cccc(c1)-c1cc(nc(NCCc2ccncc2)n1)N1CCOCC1
C(Cc1ccccn1)Nc1nc(cc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
C(Cc1cccnc1)Nc1nc(cc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
C(Cc1ccncc1)Nc1nc(cc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
C(Oc1nc(cc(n1)-c1ccc2cc[nH]c2c1)N1CCOCC1)c1ccccn1
CS(=O)(=O)Nc1ccc(cc1)-c1cc(nc(OCc2ccccn2)n1)N1CCOCC1
C(Oc1nc(cc(n1)-c1cccc2[nH]ncc12)N1CCOCC1)c1ccccn1
C(Oc1cccc(c1)-c1nc(cc(n1)-c1ccccn1)N1CCOCC1)c1ccccc1
C(Oc1cccc(c1)-c1nc(cc(n1)-c1cccnc1)N1CCOCC1)c1ccccc1
C(Oc1cccc(c1)-c1nc(cc(n1)-c1ccncc1)N1CCOCC1)c1ccccc1
Clc1ccc(cc1)-c1cc(nc(n1)-c1cccc(OCc2ccccc2)c1)N1CCOCC1
Clc1ccc(cc1Cl)-c1cc(nc(n1)-c1cccc(OCc2ccccc2)c1)N1CCOCC1
Oc1cccc(c1)-c1nc(cc(n1)-c1ccccn1)N1CCOCC1
Oc1cccc(c1)-c1nc(cc(n1)-c1cccnc1)N1CCOCC1
Oc1cccc(c1)-c1nc(cc(n1)-c1ccncc1)N1CCOCC1
Oc1cccc(c1)-c1nc(cc(n1)-c1ccc(Cl)cc1)N1CCOCC1
Oc1cccc(c1)-c1nc(cc(n1)-c1ccc(Cl)c(Cl)c1)N1CCOCC1
Oc1cccc(c1)-c1cc(NCc2ccccn2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(NCc2ccncc2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(NCCc2ccccn2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(NCCc2cccnc2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(NCCc2ccncc2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(NCc2ccccn2)n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(NCc2cccnc2)n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(NCc2ccncc2)n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(NCCc2ccccn2)n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(NCCc2cccnc2)n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(NCCc2ccncc2)n1)N1CCOCC1
Oc1cccc(c1)-c1cc(OCc2ccccn2)nc(n1)N1CCOCC1
Oc1cccc(c1)-c1cc(nc(OCc2ccccn2)n1)N1CCOCC1
C(Cc1ccccn1)Nc1cc(nc(n1)N1CCOCC1)-c1ccc2cc[nH]c2c1
C(Cc1cccnc1)Nc1cc(nc(n1)N1CCOCC1)-c1ccc2cc[nH]c2c1
C(Cc1ccncc1)Nc1cc(nc(n1)N1CCOCC1)-c1ccc2cc[nH]c2c1
CS(=O)(=O)Nc1cccc(c1)-c1cc(NCCc2ccccn2)nc(n1)N1CCOCC1
CS(=O)(=O)Nc1cccc(c1)-c1cc(NCCc2cccnc2)nc(n1)N1CCOCC1
O=C(CN1CCOCC1)Nc1ccc(cc1OCC1CC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
CC1(COc2cc(ccc2NC(=O)CN2CCOCC2)-c2cccc3c2oc(cc3=O)N2CCOCC2)COC1
COc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
Oc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
CCOc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
CC(C)Oc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
CC(C)COc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
C=CCOc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
NC(=O)COc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
COCCOc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
O=C(CN1CCOCC1)Nc1ccc(cc1OCCN1CCCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
O=C(CN1CCOCC1)Nc1ccc(cc1OCC1CCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
O=C(CN1CCOCC1)Nc1ccc(cc1OCCC1CC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
CC1(COc2cc(ccc2NC(=O)CN2CCOCC2)-c2cccc3c2oc(cc3=O)N2CCOCC2)CCC1
OCCOc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
NCCOc1cc(ccc1NC(=O)CN1CCOCC1)-c1cccc2c1oc(cc2=O)N1CCOCC1
Cc1cc(C(=O)Nc2ccn[nH]2)c2nc(C)nc(N)c2c1
Cc1ccc(NC(=O)c2cccc3c(N)nc(C)nc23)cn1
Cc1cc(C(=O)Nc2ccc(C)nc2)c2nc(C)nc(N)c2c1
Cc1cc(C(=O)Nc2cnc3[nH]ccc3c2)c2nc(C)nc(N)c2c1
Cc1cc(C(=O)Nc2cn[nH]c2)c2nc(C)nc(N)c2c1
COc1ccc(NC(=O)c2c(C)ccc3c(N)nc(C)nc23)cn1
COc1ccc(NC(=O)c2cc(C)cc3c(N)nc(C)nc23)cn1
Cc1nc(N)c2ccc(C)c(C(=O)Nc3ccn[nH]3)c2n1
Cc1nc(N)c2cc(CN3CCOCC3)cc(C(=O)Nc3ccn[nH]3)c2n1
CN(C)Cc1cc(C(=O)Nc2ccn[nH]2)c2nc(C)nc(N)c2c1
Cc1ccc(NC(=O)c2c(C)ccc3c(N)nc(C)nc23)cn1
CN(C)c1ccc(NC(=O)c2cccc3c(N)nc(C)nc23)cn1
CN(C)c1ccc(NC(=O)c2c(C)ccc3c(N)nc(C)nc23)cn1
CN(C)c1ccc(NC(=O)c2cc(C)cc3c(N)nc(C)nc23)cn1
Cc1nc(N)c2cccc(C(=O)Nc3cnc4[nH]ccc4c3)c2n1
Cc1nc(N)c2ccc(C)c(C(=O)Nc3cnc4[nH]ccc4c3)c2n1
Cc1nc(N)c2cccc(C(=O)Nc3cn[nH]c3)c2n1
Cc1nc(N)c2ccc(C)c(C(=O)Nc3cn[nH]c3)c2n1
Oc1cccc(c1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
C1CN(CCO1)c1nc(Nc2cnc3ccccc3c2)cc(n1)-c1cccnc1
Nc1ccc(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
C1CN(CCO1)c1nc(Nc2cnc3ccccc3c2)cc(n1)-c1cnc2n[nH]cc2c1
O=c1cc(cc[nH]1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
C1CN(CCO1)c1nc(Nc2cnc3ccccc3c2)cc(n1)-c1cnccn1
Nc1cnc(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
C1CN(CCO1)c1nc(Nc2cnc3ccccc3c2)cc(n1)-c1cncnc1
O=c1ncc(c[nH]1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
CNc1ncc(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
CN(C)c1ncc(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
Nc1ncc(Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)cn1
Nc1ncc(cn1)-c1cc(NC2CCOCC2)nc(n1)N1CCOCC1
Nc1ncc(cn1)-c1ccnc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(Nc2ccc(Oc3ccccc3)nc2)nc(n1)N1CCOCC1
CN1CCC(CC1)Oc1ccc(Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)cn1
COc1ccc(Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)cn1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1ccc2nc[nH]c2c1)N1CCOCC1
CS(=O)(=O)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc2N(CCc12)c1cccnc1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1cccnc1)N1CCOCC1
Nc1n[nH]c2cc(ccc12)-c1ccnc(N)n1
Cc1nc(N=C(N)NC(=O)c2ccccc2N)nc2ccccc12 |w:4.3|
Cc1ccc(OCC(=O)Nc2ccc(cc2)-c2nnc(o2)-c2ccco2)cc1
CCOc1ccc2nc3cc(ccc3c(N)c2c1)\N=C\c1ccco1
Cc1cccc(NC(=O)c2ccc(Cn3cnc4ccccc4c3=O)o2)n1
Cc1nc(N)nc(n1)-n1c(Nc2cccc(c2)C(N)=O)nc2ccccc12
CNC(=O)Nc1ccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)cc1
CC(=O)Nc1ccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)cc1
CC(=O)Nc1cccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)c1
Cc1nc(N)nc(n1)-n1c(Nc2ccc3cc[nH]c3c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccc3cn[nH]c3c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn(C)n2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn(n2)C(F)F)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccon2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2n[nH]c3ccccc23)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2cn[nH]c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccnn2C)nc2ccccc12
CNC(=O)c1ccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)o1
Cc1nc(N)nc(n1)-n1c(NC2CCOCC2)nc2ccccc12
CNc1nc(C)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(NCC#N)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(NCCC#N)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(NCC#C)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn[nH]2)nc2cc(F)c(F)cc12
Cc1nc(N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccccc2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2cc(O)cc(O)c2)nc2ccccc12
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(NCC#N)n2)c1
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(Nc3ccccc3)n2)c1
CNc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(NCC(F)(F)F)n2)c1
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(NCc3ccccn3)n2)c1
Nc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Oc1cccc(Nc2nc3ccccc3n2-c2ncncn2)c1
COc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Nc1cc(ncn1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nc(NCC#N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
CCc1nc(N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
CCCc1nc(N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nc(N)cc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nccc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
COc1nc(NCC#N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4cccc(c4)C(F)(F)F)c3c2c1
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(c4)C(F)(F)F)c3c2c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(Cl)c4)c3c2c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(F)c4)c3c2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(nc1)C#N
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc(N)nc1
Fc1ccc(c(c1)C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 |(-4.38,-16.19,;-3.05,-16.97,;-3.06,-18.52,;-1.74,-19.3,;-.4,-18.55,;-.38,-17,;-1.7,-16.22,;.96,-16.25,;.98,-14.71,;2.5,-16.24,;2.05,-15.15,;.92,-19.33,;.9,-20.86,;2.22,-21.65,;3.56,-20.9,;3.59,-19.37,;2.26,-18.58,;2.28,-17.04,;2.21,-23.2,;.85,-23.95,;-.47,-23.16,;-1.82,-23.9,;-3.14,-23.1,;-3.1,-21.56,;-1.76,-20.82,;-.44,-21.61,;-4.42,-20.77,;-4.38,-19.22,;-5.7,-18.42,;-7.05,-19.17,;-8.36,-18.37,;-9.72,-19.12,;-9.74,-20.67,;-8.42,-21.46,;-7.08,-20.71,;-5.76,-21.51,)|
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)cc4C(F)(F)F)c3c2c1 |(7.5,-18.43,;7.9,-19.92,;9.34,-20.46,;9.27,-22,;7.78,-22.4,;6.94,-21.12,;10.59,-22.79,;10.55,-24.33,;11.87,-25.13,;13.22,-24.39,;14.54,-25.19,;15.9,-24.44,;15.92,-22.88,;17.26,-22.14,;17.28,-20.6,;15.95,-19.81,;15.97,-18.27,;14.62,-20.56,;13.29,-19.78,;11.95,-20.53,;10.63,-19.75,;10.64,-18.2,;9.32,-17.42,;11.99,-17.45,;13.31,-18.23,;14.66,-17.48,;14.68,-15.94,;16.19,-17.48,;15.74,-16.38,;14.6,-22.09,;13.25,-22.84,;11.93,-22.05,)|
Fc1ccc(c(c1)C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1 |(23.22,-16.91,;24.55,-17.69,;24.53,-19.24,;25.86,-20.02,;27.19,-19.26,;27.22,-17.72,;25.89,-16.93,;28.56,-16.97,;28.58,-15.43,;30.09,-16.96,;29.64,-15.86,;28.52,-20.05,;28.5,-21.58,;29.82,-22.37,;31.16,-21.62,;31.18,-20.09,;29.86,-19.3,;29.87,-17.76,;29.8,-23.92,;28.45,-24.67,;27.12,-23.88,;25.77,-24.62,;24.46,-23.82,;24.49,-22.28,;25.84,-21.54,;27.15,-22.33,;23.18,-21.48,;21.69,-21.89,;20.85,-20.6,;21.81,-19.41,;23.24,-19.95,)|
Nc1ncc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(c4)C(F)(F)F)c3c2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc2[nH]ncc2c1
Fc1ccc(cc1Cl)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
Fc1ccc(cc1Cl)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
Nc1ncc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(Cl)c4)c3c2c1
Fc1ccc(cc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(c4)C(F)(F)F)c3c2c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnn(C)c1
COc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(C)c4)c3c2c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(Cl)c4)c3c2c1
O=S(=O)(Nc1cncc(c1)-c1ccc2nccn2c1)c1ccccc1
CC(=O)c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(C#N)n2c1)c1ccccc1
CCOC(=O)c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
Cc1nc(no1)-c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(-c3cc[nH]n3)n2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(-c3nnn[nH]3)n2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(N3CCOCC3)n2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(-c3ccccc3)n2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(-c3cccc(c3)C#N)n2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(-c3cccnc3)n2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1ccc2ncc(-c3ccncc3)n2c1)c1ccccc1
Nc1ncc(cc1S(=O)(=O)N1CCOCC1)-c1ccc2ncc(C#N)n2c1
Nc1ncc(cc1S(=O)(=O)N1CCOCC1)-c1ccc2ncc(N3CCOCC3)n2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cncc(c1)-c1ccc2ncc(C#N)n2c1
Cc1nc(no1)-c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2ccc(F)cc2F)c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cncc(c1)-c1ccc2ncc(-c3nnn[nH]3)n2c1
Cc1nc(no1)-c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2cc(F)cc(F)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(SCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Oc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Nc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Cc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(CCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccccc2F)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccccc2C)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2cccc(C)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccc(C)cc2)n1
COc1ccccc1Sc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1cccc(Sc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)c1
COc1ccc(Sc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2cccc(C)c2)n1
COc1cccc(COc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccc(C)cc2)n1
COc1ccc(COc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccncc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCc2ccncc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCc2cccnc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCN2CCOCC2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCN2CCOCC2)n1
COCCCOc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NC(C)(C)c2ccccc2)n1
COc1ccc(cc1)C(=O)Nc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)N(C)c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
CCN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccc(OC)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccccc2F)n1
CN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccccc1F
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccc(C)cc2)n1
CN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccc(C)cc1
COc1ccc(cc1)S(=O)(=O)Nc1cc(ccn1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cncc(c1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cncc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C#N)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(F)c2)c1
CN(C(=O)c1cc2COc3ccccc3-c2s1)c1cccc(F)c1
CN(C(=O)c1cc2COc3ccccc3-c2s1)c1ccc(F)cc1
CN(C(=O)c1cc2COc3ccccc3-c2s1)c1ccccc1C
COc1ccccc1N(C)C(=O)c1cc2COc3ccccc3-c2s1
CN(C(=O)c1cc2COc3ccccc3-c2s1)c1ccccc1Cl
CN(C(=O)c1cc2COc3ccccc3-c2s1)c1ccccn1
CC(C)N(C)C(=O)c1cc2COc3ccccc3-c2s1
CC(C)CN(C)C(=O)c1cc2COc3ccccc3-c2s1
CN(C(=O)c1cc2CCCOc3ccccc3-c2s1)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(NC(C)=O)ccc3-c2s1)c1ccccc1Cl
COC(=O)Nc1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)C(N)=O)c1ccccc1Cl
CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)C(=O)N1CCOCC1)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)-c1cn[nH]c1)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3ccccc3-c2s1)c1ccncc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)-c1cn[nH]c1)c1ccncc1Cl
CNC(=O)c1ccc(N(C)C(=O)c2cc3CCOc4cc(ccc4-c3s2)C(=O)NC)c(Cl)c1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN(C)CCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(O[C@H]3CCOC3)nc(n2)N2CCOCC2)cc1 |r|
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN2CCCCC2)cc1)N1CCOCC1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)CCN(C)C)cc1)N1CCOCC1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CNCCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(OC)nc(n2)N2CCOCC2)cc1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCNC(C)(C)C2)cc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(OC3COC3)nc(n2)N2CCOCC2)cc1
CC(C)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
CC(C)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)CCN(C)C)cc1)N1CCOCC1
CC(C)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(O[C@H]3CCOC3)nc(n2)N2CCOCC2)cc1 |r|
O=C(Nc1ccc(cc1)C(=O)NCCN1CCCCC1)Nc1ccc(cc1)-c1nc(O[C@H]2CCOC2)nc(n1)N1CCOCC1 |r|
O=C(Nc1ccc(cc1)C(=O)NCCN1CCCC1)Nc1ccc(cc1)-c1nc(O[C@H]2CCOC2)nc(n1)N1CCOCC1 |r|
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(O[C@H]3CCOC3)nc(n2)N2CCOCC2)cc1 |r|
CN1C2CCC1CC(C2)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc([nH]c(=O)n2)N2CCOCC2)cc1
CC(=O)Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2n1
CC(=O)Nc1cn2cc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1cn2cc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1
CC(=O)Nc1nc2ccc(cc2[nH]1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1nc2ccc(cc2[nH]1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nc[nH]c2c1
CC(=O)Nc1nc2ccc(cc2o1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1nc2ccc(cc2o1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncoc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nncn2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2sncc2c1
CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl
COc1cc(Nc2nc3ccccc3nc2S(=O)(=O)c2ccccc2)cc(OC)c1
Oc1cccc(Nc2nc3ccccc3nc2S(=O)(=O)c2ccccc2)c1
Cc1ccc(cc1)S(=O)(=O)c1nc2ccccc2nc1Nc1cccc(O)c1
COc1ccc(cc1)S(=O)(=O)c1nc2ccccc2nc1Nc1cccc(O)c1
Oc1cccc(Nc2nc3ccccc3nc2S(=O)(=O)c2ccc(Br)cc2)c1
C[C@H]1CN(C[C@@H](C)N1c1cccc(c1)-c1cc(-c2ccnn2C2CCOCC2)c2c(N)ncnn12)C(C)=O |r|
CC(=O)Nc1cn2cc(C=C3SC(O)=NC3=O)ccc2n1 |w:9.8,c:13|
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ncccc2c1
Cc1nc2nc(Sc3ccccc3)cnc2cc1NC(=O)Nc1ccccc1
FC(F)(F)c1cc(ccc1Cl)C(=O)Nc1cccc(c1)C1=Nc2cnn(Cc3ccccc3)c2NC(=O)C1 |t:22|
Cc1c(CN2CCN(CC2)C(=O)CN)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
C[C@H](N)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)-c2cnc(N)nc2)N2CCOCC2)CC1 |r|
Cc1c(CN2CCN(CC2)C(=O)C(C)(C)N)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)C(C)(C)O)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cncc(NS(=O)(=O)c2ccc3ccccc3c2)c1
CN(\N=C\c1cnn2ccccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2cc(Br)ccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2cccc(Br)c12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(Br)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2c(C)cccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2cc(C)ccc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2cccc(C)c12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(C)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CCc1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2c1
CN(\N=C\c1cnn2ccc(cc12)C(F)(F)F)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)-c1ccccc1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(I)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(Cl)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C1CC1)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(C=C)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#C)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
COC(=O)c1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2c1
CN(\N=C\c1cnn2ccc(cc12)C(N)=O)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CNC(=O)c1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2c1
CN(C)C(=O)c1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2c1
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2cc(F)c(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
COc1ccn2ncc(\C=N\N(C)S(=O)(=O)c3cc(ccc3C)[N+]([O-])=O)c2c1
CN(\N=C\c1cnn2ccc(O)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(OC(C)=O)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)NN=Cc1cnn2ccc(cc12)C#N)[N+]([O-])=O |w:12.13|
CC(=NNS(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnn2ccc(cc12)C#N |w:2.2|
CCC(=NNS(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnn2ccc(cc12)C#N |w:3.3|
CCCC(=NNS(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnn2ccc(cc12)C#N |w:4.4|
CC(=NNS(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnn2ccc(Br)cc12 |w:2.2|
CN(N=C(C)c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O |w:2.1|
CCC(=NN(C)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnn2ccc(cc12)C#N |w:3.3|
CCC\C(=N/N(C)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O)c1cnn2ccc(cc12)C#N
CN(N=C(C)c1cnn2ccc(Br)cc12)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O |w:2.1|
Cc1ccc(cc1S(=O)(=O)N(Cc1ccccc1)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CN(C)CCN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
CCN(CC)CCN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)N(CCN1CCOCC1)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)N(CCN1CCCCC1)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)N(CCO)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1ccccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cccc(c1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1ccc(cc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1c(C)cccc1[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(NC(C)=O)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(NC(=O)C(F)(F)F)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(N)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)C(O)=O
COC(=O)c1ccc(C)c(c1)S(=O)(=O)N(C)\N=C\c1cnn2ccc(cc12)C#N
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)C#N
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)S(C)(=O)=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)C(F)(F)F
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(C)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(F)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(Cl)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(Br)ccc1C
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cccc(c1)[N+]([O-])=O
CCc1ccc(cc1S(=O)(=O)N(C)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CC(C)c1ccc(cc1S(=O)(=O)N(C)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1F)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1Cl)[N+]([O-])=O
COc1ccc(cc1S(=O)(=O)N(C)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CN(C)c1ccc(cc1S(=O)(=O)N(C)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)C(=O)c1cc(ccc1C)[N+]([O-])=O
CN(\N=C\c1cnn2ccc(cc12)C#N)C(=O)c1cccc(c1)[N+]([O-])=O
CN(Cc1cc(ccc1C)[N+]([O-])=O)\N=C\c1cnn2ccc(cc12)C#N
CCN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1
CC(=O)Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1
CCC(=O)Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1
CCCC(=O)Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1
CCCC(CCC)C(=O)Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1
C=CC(=O)Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1
O=C(Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1)c1ccco1
O=C(Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc3ncccc3n2n1)c1ccncc1
CC(C)n1cc(C(=O)c2cncc(n2)N(C)[C@@H]2CCC[C@@H]2c2ccc(F)cc2)c2c(N)ncnc12 |r|
CC(C)n1cc(c2c1ncnc2N)C(=O)c3cncc(n3)NCCc4cccnc4
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3COC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCO[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CNC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN(C=O)[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN([C@@H]3c3ccc(F)cc3)C(C)=O)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN([C@@H]3c3ccccc3)C(C)=O)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCC[C@@H]3c3ccccc3)n2)c2c(N)ncnc12 |r|
Clc1cccc(Nc2nc(nc(n2)-n2cccn2)N2CCOCC2)c1
Cc1nccn1-c1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
Cc1nccn1-c1nc(nc(n1)-c1cnc(N)nc1)N1CCOCC1
CCc1nccn1-c1nc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CCc1cc(nn1-c1nc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1)C(F)(F)F
Cc1nccn1-c1nc(nc(n1)-c1ccc(C)c2[nH]ccc12)N1CCOCC1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1nnc[nH]1
OCc1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
OC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
NC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
CC(C)(O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1cn[nH]c1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2[nH]ncc2c1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2nc[nH]c2c1
CNc1nc2ccc(cc2[nH]1)-c1cnc2[nH]c(=O)n(CC3CCOCC3)c2n1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc2[nH]ccc2c1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2[nH]ccc2c1
Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nc3s2)-c2cccc3[nH]ncc23)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3o2)-c2cccc3[nH]ncc23)CC1
CS(=O)(=O)N1CCC(Cc2cc3c(nc(nc3s2)-c2cnc(N)nc2)N2CCOCC2)CC1
CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1cc(ccc1Cl)C(=O)N(C)C
CN(C)CCn1cc(cn1)-c1ccn2c(cnc2c1)-c1ccc(C(N)=O)c(OCc2cccc(F)c2)c1
Fc1ccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)cc1
Fc1ccccc1Cn1ccn2c1nc(cc2=O)N1CCOCC1
Fc1cccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)c1
Clc1ccccc1Cn1ccn2c1nc(cc2=O)N1CCOCC1
Clc1cccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)c1
Clc1ccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)cc1
Cc1ccccc1Cn1ccn2c1nc(cc2=O)N1CCOCC1
Cc1cccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)c1
FC(F)(F)c1cccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)c1
Clc1ccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)cc1Cl
Fc1ccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)cc1Cl
Clc1cccc(Cn2ccn3c2nc(cc3=O)N2CCOCC2)c1Cl
O=c1cc(nc2n(Cc3cccc4ccccc34)ccn12)N1CCOCC1
Cc1c(Cn2ccn3c2nc(cc3=O)N2CCOCC2)cccc1C(F)(F)F
Cc1cn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(Cl)c1Cl
Cc1cn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(c1C)C(F)(F)F
CCc1cn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(c1C)C(F)(F)F
Clc1cccc(Cn2c3ccccc3n3c2nc(cc3=O)N2CCOCC2)c1Cl
Cc1c(C)n2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(Cl)c1Cl
Cc1c(C)n2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(c1C)C(F)(F)F
O=c1cc(nc2n(Cc3cccc4ccccc34)c3ccccc3n12)N1CCOCC1
Cc1c(Cn2c3ccccc3n3c2nc(cc3=O)N2CCOCC2)cccc1C(F)(F)F
Fc1c(nc2n(Cc3cccc(Cl)c3Cl)ccn2c1=O)N1CCOCC1
Clc1cccc(Cn2ccn3c2cc(nc3=O)N2CCOCC2)c1Cl
Cc1c(Cn2ccn3c2cc(nc3=O)N2CCOCC2)cccc1C(F)(F)F
CC1CN(CCO1)c1cc(=O)n2ccn(Cc3cccc(Cl)c3Cl)c2n1
CC1(C)CN(CCO1)c1cc(=O)n2ccn(Cc3cccc(Cl)c3Cl)c2n1
CC1CN(CCO1)c1cc(=O)n2ccn(Cc3cccc(c3C)C(F)(F)F)c2n1
C[C@H]1CN(CCO1)c1cc(=O)n2ccn(Cc3cccc(c3C)C(F)(F)F)c2n1 |r|
C[C@@H]1CN(CCO1)c1cc(=O)n2ccn(Cc3cccc(c3C)C(F)(F)F)c2n1 |r|
OCC1CN(CCO1)c1cc(=O)n2ccn(Cc3cccc(Cl)c3Cl)c2n1
Cc1c(Cn2ccn3c2nc(cc3=O)C2=CCOCC2)cccc1C(F)(F)F |t:16|
Cc1c(Cn2ccn3c2nc(cc3=O)C2CCOCC2)cccc1C(F)(F)F
Clc1cccc(Cn2ccn3c2nc(cc3=O)N2CCSCC2)c1Cl
CN(C)C(=O)c1cc([C@H]2CCCN2c2ccc(F)cc2)c2oc(cc(=O)c2c1)N1CCOCC1 |r|
Fc1cc(F)cc(c1)N1CCC[C@@H]1c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1 |r|
Fc1cccc(c1)N1CCC[C@@H]1c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1 |r|
CC(=O)N1CCN(C(=O)C1(C)C)c1cccc(c1)-c1cc(-c2ccnn2C2CCOCC2)c2c(N)ncnn12
CC(=O)N1CCN(C(=O)C1(C)C)c1cc(ccc1C#N)-c1cc(c2c(N)ncnn12)C(F)(F)F
C[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)(F)F
Nc1ncnn2c(cc(-c3ccnn3CC(F)(F)F)c12)-c1cccc(c1)N1CCOCC1=O
Nc1ncnn2c(cc(Cl)c12)-c1cccc(c1)N1CCOCC1=O
Nc1ncnn2c(cc(c12)C(F)(F)F)-c1cccc(c1)N1CCOCC1=O
CC1(C)OCCN(C1=O)c1cccc(c1)-c1cc(Cl)c2c(N)ncnn12
CC1(C)OCCN(C1=O)c1cccc(c1)-c1cc(c2c(N)ncnn12)C(F)(F)F
COc1ccc(cc1N1CCOC(C)(C)C1=O)-c1cc(-c2ccnn2CC(F)(F)F)c2c(N)ncnn12
COc1ccc(cc1N1CCOC(C)(C)C1=O)-c1cc(c2c(N)ncnn12)C(F)(F)F
CC1(C)OCCN(C1=O)c1cc(ccc1C#N)-c1cc(-c2ccnn2CC(F)(F)F)c2c(N)ncnn12
CC1(C)OCCN(C1=O)c1cc(ccc1C#N)-c1cc(c2c(N)ncnn12)C(F)(F)F
CC1(C)OCCN(C1=O)c1cccc(c1)-c1cc(-c2ccnn2CC(F)(F)F)c2c(N)ncnn12
COc1ccc(cc1N1CCOC(C)(C)C1=O)-c1cc(Cl)c2c(N)ncnn12
CC1(C)OCCN(C1=O)c1cc(ccc1C#N)-c1cc(Cl)c2c(N)ncnn12
Cc1ccc(cc1)C(N1CCCC1=O)c1c(O)ccc2ccccc12
Oc1ccc2ccccc2c1C(N1CCCC1=O)c1ccc(Cl)cc1Cl
Oc1ccc2ccccc2c1C(N1CCCC1=O)c1cccc2ccccc12
Oc1ccc2ccccc2c1C(N1CCCC1=O)c1ccc(Cl)cc1
CNC(=O)c1nc(-c2nc(cnc2N)-c2cnc3ccccn23)n(C)n1
CNC(=O)c1nc(-c2nc(-c3cnc4ccccn34)c(C)nc2N)n(C)n1
CN1CCC(CC1)n1ncc(n1)-c1nc(-c2cnc3ccccn23)c(C)nc1N
CNC(=O)c1nc(-c2nc(-c3cnn4ccccc34)c(C)nc2N)n(C)n1
CN1CCC(CC1)c1nc(-c2nc(-c3cnc4ccccn34)c(C)nc2N)n(C)n1
COCCOCCNC(=O)CCCC#Cc1cccc2nc(Cn3nc(-c4cccc(O)c4)c4c(N)ncnc34)n(Cc3ccccc3Cl)c(=O)c12
CC[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(C#CCCCC(=O)N3CCCC3)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(C#CCCCC(=O)N3CCOCC3)c2c(=O)n1-c1ccccc1 |r|
Cc1nc(N)nc(N2CCC[C@H]2c2nc3cccc(C#CCCCC(=O)N4CCCC4)c3c(=O)n2-c2ccccc2)c1C#N |r|
Nc1ncnc(N2CCC[C@H]2c2nc3cccc(C#CCCCC(=O)N4CCOCC4)c3c(=O)n2-c2ccccc2)c1C#N |r|
C1CN(CCO1)c1nc(nc2c3cccnc3oc12)-c1ccccc1
Nc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Oc1ccccc1-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C(CN1CCOCC1)Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C1CN(CCO1)c1nc(nc2c3ccccc3sc12)-c1ccccc1
OC(=O)COc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C1CN(CCO1)c1ncnc2c3ccccc3sc12
COc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C1CN(CCO1)c1nc(nc2c3cccnc3sc12)-c1ccccc1
C1CN(CCO1)c1ncnc2c3cccnc3sc12
C(CN1CCSCC1)Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C1CN(CCO1)c1ncnc2c3cccnc3oc12
Oc1ccc(cc1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C1CN(CCO1)c1ncnc2c3cccnc3[nH]c12
C(CN1CCCCC1)Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1
CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0|
COc1ccc2c(Sc3ccc(cc3)[N+]([O-])=O)c3ccoc3nc2c1
Cc1cc(F)ccc1OCc1cc(cc(n1)N1CCOCC1)C(N)=O
Cc1cc(F)ccc1OCc1cc(cc(n1)N1CCOCC1)C(O)=O
Cc1cc(F)ccc1NCc1cc(CO)cc(n1)N1CCOCC1
Cc1cc(F)ccc1NCc1cc(C=O)cc(n1)N1CCOCC1
Cc1cc(F)ccc1NCc1cc(cc(n1)N1CCOCC1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)N1CCNCC1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)N1CCC(O)C1)C(O)=O
CN(CCO)c1cc(cc(CNc2ccc(F)cc2C)n1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(NCCO)n1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)N(CCO)CCO)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)-c1ccncc1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)-c1cccnc1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)-c1ccc(O)cc1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)-c1cccc(O)c1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(n1)-c1ccccc1O)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(Cl)n1)C(O)=O
Cc1cc(F)ccc1NCc1cc(cc(NCCO)n1)C(=O)NCCO
Cc1cc(F)ccc1NCc1cc(cc(n1)N1CCC(O)C1)C(=O)N1CCC(O)C1
OC(=O)c1ccnc(c1)N1CCOCC1
CCOC(=O)c1ccnc(c1)N1CCOCC1
COc1cc2CCN(C(=O)CN(C)C)c2cc1Nc1nc(Nc2cccc3CNC(=O)c23)c2cc[nH]c2n1
CC(C)(O)C1CCN(Cc2ccc3nc(nc(N4CCOCC4)c3n2)-c2c(F)ccc3[nH]ccc23)CC1
Cc1nncn1C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc(O)c2)CC1
Cc1nncn1C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
Cc1nncn1C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2sc(CN3CCC(CC3)n3cnnc3C(F)(F)F)cc2n1
FC(F)(F)c1nncn1C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
FC(F)(F)c1nncn1C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
[H][C@]12CCc3nnc(n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ncc13)C2)C(F)(F)F |r|
[H][C@]12CCc3nnc(n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc(O)c1)C2)C(F)(F)F |r|
[H][C@]12CCc3nnc(C)n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ncc13)C2 |r|
[H][C@]12CCc3nnc(n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ccc13)C2)C(F)(F)F |r|
[H][C@]12CCc3nnc(C)n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ccc13)C2 |r|
[H][C@@]12CCc3nnc(n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ncc13)C2)C(F)(F)F |r|
[H][C@@]12CCc3nnc(n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc(O)c1)C2)C(F)(F)F |r|
[H][C@@]12CCc3nnc(C)n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ncc13)C2 |r|
[H][C@@]12CCc3nnc(n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ccc13)C2)C(F)(F)F |r|
[H][C@@]12CCc3nnc(C)n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc3[nH]ccc13)C2 |r|
[H][C@@]12CCc3nnc(C)n3[C@@]1([H])CCN(Cc1cc3nc(nc(N4CCOCC4)c3s1)-c1cccc(O)c1)C2 |r|
CCCn1cnc2c(cc(nc12)-c1ccc(NC(=O)NCC)cc1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1cc(N2CCOC[C@@H]2C)c2nc(C)n(CC)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)C1COC1 |r|
C[C@H]1CN(C[C@@H](C)N1)C(=O)c1cc(C2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1 |r|
C[C@@H](Nc1cccc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCO |r|
C[C@H](Nc1cccc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCO |r|
CC(Nc1cc(F)cc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCN(C)C
C[C@@H](Nc1cc(F)cc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCN(C)C |r|
C[C@H](Nc1cc(F)cc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCN(C)C |r|
CNCCNC(=O)c1cc(C(C)Nc2cccc(F)c2)c2nc(cnc2c1)N1CCOCC1
CN(C)CCNC(=O)c1cc(CNc2cccc(F)c2C)c2nc(cnc2c1)N1CCOCC1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(F)c1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
OCCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
O=C(Nc1cccs1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)Nc1cccnc1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)Nc1ccnnc1
COC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
OC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN(C)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
O=C(Nc1ccc(cc1)C(=O)N1CCC(CC1)N1CCCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1ccc(cc1)C(=O)N1CCC(CC1)N1CCCCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(NN1CCCCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CN(C)CCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN(C)C(=O)c1cc([C@@H]2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1 |r|
CN(C)C(=O)c1cc(C2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1
CN(C)C(=O)c1cc([C@H]2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1 |r|
CS(=O)(=O)Nc1cccc(c1)-c1c[nH]c2ncc(cc12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
CC(=O)c1c[nH]c2ncc(cc12)-c1cnc(N)c(NS(=O)(=O)N2CCOCC2)c1
Nc1ncc(cc1NS(=O)(=O)N1CCOCC1)-c1cnc2[nH]cc(-c3cccc(c3)C#N)c2c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cnc(N)c(NS(=O)(=O)N2CCOCC2)c1
COc1ccc(cc1OC)-c1c[nH]c2ncc(cc12)-c1cnc(N)c(NS(=O)(=O)c2ccc(F)cc2F)c1
O=S(=O)(Nc1cncc(c1)-c1cnc2[nH]ccc2c1)c1ccccc1
CC(=O)c1c[nH]c2ncc(cc12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
O=S(=O)(Nc1cncc(c1)-c1cnc2[nH]cc(-c3cccc(c3)C#N)c2c1)c1ccccc1
O=S(=O)(Nc1cncc(c1)-c1cnc2[nH]cc(-c3cccnc3)c2c1)c1ccccc1
NC(=O)c1sc(N2CCOCC2)c(C#N)c1-c1ccc(Cl)cc1
Clc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1nnc[nH]1
Clc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1cc[nH]n1
Clc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1c[nH]nn1
OC(=O)c1sc(N2CCOCC2)c(C#N)c1-c1ccc(Cl)cc1
Clc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1cn[nH]c1
Cc1nnc(o1)-c1sc(N2CCOCC2)c(C#N)c1-c1ccc(Cl)cc1
Clc1ccc(-c2c(sc(N3CCOCC3)c2C#N)-c2nnc[nH]2)c(Cl)c1 |(13.97,-25.89,;13.2,-24.55,;13.97,-23.21,;13.2,-21.89,;11.67,-21.88,;10.91,-20.55,;11.39,-19.08,;10.14,-18.17,;8.88,-19.08,;7.54,-18.32,;7.53,-16.78,;6.2,-16.02,;4.87,-16.79,;4.88,-18.33,;6.21,-19.1,;9.36,-20.55,;8.46,-21.8,;7.56,-23.05,;12.84,-18.6,;14.09,-19.51,;15.33,-18.61,;14.86,-17.14,;13.32,-17.14,;10.89,-23.21,;9.36,-23.21,;11.66,-24.55,)|
Fc1cc(ccc1-c1c(sc(N2CCOCC2)c1C#N)-c1nnc[nH]1)C#N |(23.39,-23.59,;24.93,-23.6,;25.69,-24.93,;27.23,-24.94,;28,-23.6,;27.24,-22.27,;25.7,-22.27,;24.94,-20.94,;25.42,-19.47,;24.17,-18.56,;22.91,-19.47,;21.57,-18.7,;21.56,-17.16,;20.23,-16.4,;18.89,-17.18,;18.9,-18.72,;20.24,-19.48,;23.39,-20.94,;22.49,-22.19,;21.58,-23.43,;26.88,-18.99,;28.12,-19.89,;29.37,-18.99,;28.89,-17.52,;27.35,-17.52,;28,-26.27,;28.77,-27.6,)|
Nc1ncc(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(Cl)c(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
Nc1cc(C#N)c(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
Nc1cc(c(cn1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1)C(F)(F)F
Nc1ncc(c(N)n1)-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
Nc1ncc(-c2cc(Nc3cnc4ccccc4c3)nc(n2)N2CCOCC2)c(=O)[nH]1
Nc1ncc(-c2cc(Nc3cnc4ccccc4c3)nc(n2)N2CCOCC2)c(n1)C(F)(F)F
Cc1nc(N)ncc1-c1cc(Nc2cnc3ccccc3c2)nc(n1)N1CCOCC1
Nc1cc(Cl)c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(C#N)c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1ncc(c(N)n1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)c(=O)[nH]1
CC1CN(CCO1)c1cc(=O)n2nc(C)n(Cc3cccc(c3C)C(F)(F)F)c2n1
CC1CN(CCO1)c1cc(=O)n2nc(C)n(Cc3cccc(Cl)c3Cl)c2n1
CSc1nn2c(nc(cc2=O)-c2ccncc2)n1Cc1cccc(Cl)c1Cl
Cc1nn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(c1C)C(F)(F)F
CSc1nn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(c1C)C(F)(F)F
Cc1c(Cn2c(nn3c2nc(cc3=O)N2CCOCC2)C2CC2)cccc1C(F)(F)F
CSc1nn2c(nc(cc2=O)N2CCOC(C)C2)n1Cc1cccc(c1C)C(F)(F)F
Cc1nn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(Cl)c1Cl
CSc1nn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(Cl)c1Cl
Clc1cccc(Cn2c(nn3c2nc(cc3=O)N2CCOCC2)C2CC2)c1Cl
O=S(=O)(c1ccccc1)c1nc2ccccc2nc1N1CCOCC1
OC1CCN(CC1)c1nc2ccccc2nc1S(=O)(=O)c1ccccc1
OC1CCN(CC1)c1nc2ccccc2nc1S(=O)(=O)c1ccc(Br)cc1
O=S(=O)(c1ccccc1)c1nc2ccccc2nc1N1CCc2ccccc2C1
O=S(=O)(c1ccccc1)c1nc2ccccc2nc1N1CCCC1
COc1ccc(-c2nnc(SCc3ccc(F)cc3)o2)c(O)c1
COc1ccc(-c2nnc(SCc3cccc(c3)[N+]([O-])=O)o2)c(O)c1
COc1cccc(CSc2nnc(o2)-c2ccc(C)cc2O)c1
Cc1ccc(-c2nnc(SCc3ccc(cc3)[N+]([O-])=O)o2)c(O)c1
COc1ccc(-c2nnc(SCc3cccc(Cl)c3)o2)c(O)c1
COc1ccc(-c2nnc(SCc3ccccc3F)o2)c(O)c1
COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C(F)(F)F)c3)c2cc1OC
Cn1ccc2cc(ccc12)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(NC(=O)c2ccno2)n1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc(NS(C)(=O)=O)cc1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2[nH]ccc2c1)N1CC2CCC(C1)O2
C[C@@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc2[nH]ccc2c1 |r|
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc2[nH]ccc2c1 |r|
CS(=O)(=O)Cc1cc(nc(n1)-c1cnc2[nH]ccc2c1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2nc[nH]c2c1)N1CCOCC1
COCc1cccc(c1)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc(CO)c1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
O=S(=O)(CCc1cnccn1)Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1
CC(C)S(=O)(=O)Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccccc1)N1CCOCC1
CC(C)C[C@H]1CN(CCN1)c1ccc(c(n1)C(=O)c1cccnc1N)C(F)(F)F |r|
CC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(C)(=O)=O
CS(=O)(=O)c1cncc(c1)-c1ccc2nc(N)nn2c1
CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)N3CCOCC3)nn2c1
CN(C)CCNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCN3CCOCC3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCc3ccccc3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCc3ccccc3)nn2c1
Cc1noc(C)c1CCNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCn3cccn3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCc3cnccn3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCc3nnc(o3)C3CC3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCn3nnc(n3)C3CC3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCCCn3nnc(n3)C3CC3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCC(=O)N3CCCC3)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)NCC(=O)N3CCOCC3)nn2c1
CN1CCN(CC1)C(=O)CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C
CN(C)C(=O)CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(N)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(NC(=O)Nc3ccccc3)nn2c1
Cc1nc(CCNC(=O)Nc2nc3ccc(cn3n2)-c2cncc(c2)S(=O)(=O)NC(C)(C)C)cs1
CNC(=O)CNC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NC(C)(C)C
Cc1nc(N)nc2n(N3CCCC3)c(=O)c(cc12)-c1cn[nH]c1
CC(C)CNn1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O
CCN(CC)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3c[nH]nc3)C4CCCC4
Oc1ccc(cc1)C1=NN2C(S1)=NC(=O)\C(=C\c1ccc(O)c(O)c1)C2=N |c:13,t:8|
Oc1ccc(cc1)C1=NN2C(S1)=NC(=O)\C(=C\c1coc3ccccc3c1=O)C2=N |c:13,t:8|
OCCNc1ncnc2oc(c(-c3ccccc3)c12)-c1ccccc1
OC(=O)c1cccc(c1)N1C(=S)S\C(=C\c2cnc3ccccc3n2)C1=O
COCCNC(=O)c1nc2c(nc(cn2c1C)-c1cnc(N)nc1)N1CCOCC1
COCCNC(=O)c1cn2c(Cl)c(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
Nc1ncc(cn1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(=O)NC1CCOCC1
Nc1ncc(cn1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(=O)NCCN1CCOCC1
Nc1ncc(cn1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:28.32,wD:25.28,(-9.8,-30.99,;-8.46,-30.22,;-8.46,-28.68,;-7.13,-27.91,;-5.8,-28.69,;-5.8,-30.22,;-7.12,-31,;-4.47,-27.92,;-3.13,-28.69,;-1.8,-27.92,;-.33,-28.39,;.57,-27.14,;-.33,-25.9,;-1.8,-26.38,;-3.13,-25.61,;-4.47,-26.32,;-3.13,-24.07,;-4.46,-23.31,;-4.46,-21.77,;-3.13,-20.99,;-1.8,-21.77,;-1.8,-23.31,;2.11,-27.14,;2.88,-25.8,;2.89,-28.47,;2.12,-29.81,;.58,-29.81,;-.19,-31.13,;.58,-32.47,;-.2,-33.8,;2.12,-32.47,;2.89,-31.13,)|
COCCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
COCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
CN(C)CCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
CN(C)CCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
NC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
CN(C)CCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cccc2[nH]ncc12
Cc1cccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc12
Cc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
CC1=CN2C(=O)C=C(N=C2C(=C1)[C@@H](C)Nc3ccccc3)N4CCOCC4
Cc1cc(F)ccc1Oc1cccc2c(O)cc(nc12)N1CCOCC1
Cc1cc2c(c(c1)[C@H](C)Nc3ccccc3)OC(=CC2=O)N4CCOCC4
Fc1ccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1-c1ccccc1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2ccncc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2cccnc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2ccccn2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2cccs2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3cccc(-c4ccccc4)c3o2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2ccccc2)[nH]1)N1CCOCC1
Brc1cccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc12
Cc1cccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc12
Cc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc2c1
Cc1ccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1
Cn1c(Cc2nc3ccccc3o2)nc(cc1=O)N1CCOCC1
Fc1cccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc12
Fc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc2c1
Fc1ccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1
Fc1cccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc12
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2ccc(cc12)-c1ccccc1
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cc(ccc12)-c1ccccc1
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cccc(-c3ccccc3)c12
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2c(cccc12)-c1ccccc1
O=c1cc(nc(Cc2nc3c(cccc3[nH]2)-c2ccccc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3n2Cc2ccccc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3n2-c2ccccc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3n2C2CCCCC2)[nH]1)N1CCOCC1
COCCn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cc(F)ccc12
Fc1ccc2n(C3CC3)c(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1
CCn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2ccccc12
FC(F)(F)c1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
COc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Clc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Brc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2ccc(F)cc12
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cc(F)ccc12
Cn1c(Cc2nc3ccc(F)cc3[nH]2)nc(cc1=O)N1CCOCC1
Fc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Cn1c2ccccc2nc1CC3=NC(=CC(=O)N3)N4CCOCC4
O=c1cc(nc(Cc2nc3ccccc3[nH]2)[nH]1)N1CCOCC1
c1ccc(cc1)NC(=O)CC2=NC(=CC(=O)N2)N3CCOCC3
O=c1cc(nc(Cc2nc3ccccc3o2)[nH]1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCCS(=O)(=O)c2c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1C[C@@H]2CC[C@H](C1)O2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1CCOC[C@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOC[C@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOC[C@@H]1C |r|
COc1ccccc1-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1sc(C)nc1C
Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NCC1CC1
CC(=O)Nc1nc2ccc(cn2n1)-c1cc(C)c(O)c(C)c1
COc1cccc(c1)-c1ccc2nc(NC(C)=O)nn2c1
COc1ccc(cc1)-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1cccc(c1)S(C)(=O)=O
CC(=O)Nc1nc2ccc(cn2n1)-c1cccc(NS(C)(=O)=O)c1
CNS(=O)(=O)c1cccc(c1)-c1ccc2nc(NC(C)=O)nn2c1
CNC(=O)c1cccc(c1)-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1ccc(cc1)S(C)(=O)=O
CCCCNS(=O)(=O)c1cccc(c1)-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1cccc(c1)S(=O)(=O)NCc1ccccc1
CC(=O)Nc1nc2ccc(cn2n1)-c1cccc(c1)-c1ccccc1
COc1ccc(cc1S(=O)(=O)NCc1ccccc1)-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1cccnc1
CC(=O)Nc1nc2ccc(cn2n1)-c1cncc2ccccc12
CC(=O)Nc1nc2ccc(cn2n1)-c1ccncc1
CC(=O)Nc1nc2ccc(cn2n1)-c1cnn(C)c1
CC(=O)Nc1nc2ccc(cn2n1)-c1ccsc1
COc1cncc(c1)-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NCc1ccccc1
CC(=O)Nc1nc2ccc(cn2n1)-c1cncc(CS(N)(=O)=O)c1
CS(=O)(=O)Nc1cccc(c1)-c1ccc2nc(NC(=O)C3CCCCC3)nn2c1
CN(C(C)=O)c1nc2ccc(cn2n1)-c1cccc(c1)S(C)(=O)=O
CNc1nc2ccc(cn2n1)-c1cncc(c1)S(C)(=O)=O
CS(=O)(=O)Nc1nc2ccc(cn2n1)-c1cncc(c1)S(C)(=O)=O
Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)Nc1cccc2ccccc12
Nc1nc2ccc(cn2n1)-c1cncc(NS(=O)(=O)c2ccc(Cl)cc2)c1
Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)Nc1ccc(Cl)cc1
Nc1nc2ccc(cn2n1)-c1cncc(c1)S(=O)(=O)NCc1ccccc1
CC(C)NS(=O)(=O)c1cncc(c1)-c1ccc2nc(N)nn2c1
CC(C)(C)S(=O)(=O)c1cncc(c1)-c1ccc2nc(N)nn2c1
CC(=O)Nc1nc2c(C)cc(cn2n1)-c1cncc(c1)S(C)(=O)=O
CC(=O)Nc1nc2cc(C)c(cn2n1)-c1cncc(c1)S(C)(=O)=O
CC(=O)Nc1nc2ccc(-c3cncc(c3)S(C)(=O)=O)c(C)n2n1
CS(=O)(=O)c1cncc(c1)-c1cc(Cl)c2nc(N)nn2c1
CC(=O)Nc1nc2c(F)cc(cn2n1)-c1cncc(c1)S(C)(=O)=O
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1cc(F)c2nc(N)nn2c1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1cn2nc(N)nc2cc1F
COc1ccc(cc1OC)-c1ccc2nc(NC(C)=O)nn2c1
CNS(=O)(=O)c1ccc(cc1)-c1ccc2nc(NC(C)=O)nn2c1
CC(=O)Nc1nc2ccc(cn2n1)-c1cncnc1
CN(C)c1nc2ccc(cn2n1)-c1cncc(c1)S(C)(=O)=O
CS(=O)(=O)c1cncc(c1)-c1cc(c2nc(N)nn2c1)C(F)(F)F
NC(=O)[C@@H]1CCCN1C(=O)Nc1nc2ccc(cc2s1)-c1cnc(N)c(c1)C(F)(F)F |r|
CC(=O)Nc1nc(C)c(s1)-c1ccc(cc1)S(N)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1ccc(cc1)S(C)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1ccc(c(Cl)c1)S(C)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1ccc(c(F)c1)S(C)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1ccc(c(c1)C#N)S(C)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1ccc(c(c1)C(F)(F)F)S(C)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1ccc(cc1)-n1cccn1
CC(=O)Nc1nc(C)c(s1)-c1ccc(cc1)C(C)=O
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc(cc1)S(C)(=O)=O |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc(c(F)c1)S(C)(=O)=O |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc(c(c1)C(F)(F)F)S(C)(=O)=O |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc(cc1)-n1cccn1 |r|
Cc1cc(NC(=O)CCNC(=O)Nc2nc(C)c(s2)-c2ccc(c(F)c2)S(C)(=O)=O)no1
Cc1cc(NC(=O)CCNC(=O)Nc2nc(C)c(s2)-c2ccc(cc2)-n2cccn2)no1
Cc1nc(NC(=O)NCCC(=O)OC(C)(C)C)sc1-c1ccc(c(F)c1)S(C)(=O)=O
Cc1c(sc(n1)NC(=O)NCCC(=O)NC(C)(C)C)c2ccc(cc2)C(=O)C
CCn1nnc(CCNC(=O)Nc2nc(C)c(s2)-c2ccc(c(F)c2)S(C)(=O)=O)n1
CC(=O)Nc1nc(C)c(s1)-c1ccc(c(Br)c1)S(C)(=O)=O
Cc1n[nH]c(=O)c2n(Cc3ccc(cc3)[N+]([O-])=O)c3ccc(Br)cc3c12
Cc1n[nH]c(=O)c2n(Cc3cccc(c3)[N+]([O-])=O)c3ccc(Br)cc3c12
Cc1n[nH]c(=O)c2n(Cc3ccc(cc3)C#N)c3ccc(Br)cc3c12
Cc1n[nH]c(=O)c2n(Cc3cccc(c3)C#N)c3ccc(Br)cc3c12
COc1ccc(Cn2c3ccc(Br)cc3c3c(C)n[nH]c(=O)c23)cc1
COc1cccc(Cn2c3ccc(Br)cc3c3c(C)n[nH]c(=O)c23)c1
C[C@@H](C1CC1)N1Cc2cc(cc(NS(C)(=O)=O)c2C1=O)-c1sc(NC(C)=O)nc1C |r|
CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1sc(NC(C)=O)nc1C |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(NC(C)=O)nc1C |r|
Nc1cccc(c1)-c1cnc2[nH]cc(-c3ccncc3)c2c1
Nc1cccc(c1)-c1cnc2[nH]cc(-c3cccnc3)c2c1
Nc1cccc(c1)-c1c[nH]c2ncc(cc12)-c1cccc(c1)C#N
Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Clc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
COC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
[O-][N+](=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Cn1c(CC(=O)Nc2ccccc2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)cc2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(F)c2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(Br)c2)nc(cc1=O)N1CCOCC1
COc1cc(NC(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)ccc1F
Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Fc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Cc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
COc1ccc(cc1)-c1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nccnc1-c1ccc(OC)cc1
CNC(=O)c1nc(cnc1N)-c1cccc(c1)-c1nnn[nH]1
COc1ccc(cc1)-c1nccnc1N1CCN(CC1)S(=O)(=O)c1cccc(c1)-c1cnc(N)nc1
CC(C)c1ccc(cc1)-c1nccnc1N1CCN(CC1)S(=O)(=O)c1cccc(c1)-c1cnc(N)nc1
CC(C)c1ccc(cc1)-c1ncccc1N1CCN(CC1)S(=O)(=O)c1cccc(c1)-c1cnc(N)nc1
CNC(=O)c1nc(cnc1N)-c1cccc(c1)C(F)(F)F
CNC(=O)c1nc(cnc1N)-c1cccc(c1)S(=O)(=O)Nc1ccccc1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccccc1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)NC
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(N)(=O)=O
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)NCC(F)(F)F
CNC(=O)c1nc(cnc1N)-c1ccc(OC)c(c1)S(=O)(=O)Nc1ccccc1
CNC(=O)c1nc(cnc1N)-c1ccc(F)c(c1)S(=O)(=O)Nc1ccccc1
CNC(=O)c1nc(cnc1N)-c1cnc(N)c(c1)S(=O)(=O)Nc1ccccc1
CNC(=O)c1nc(cnc1N)-c1cccc(NS(=O)(=O)c2ccccc2)c1
CNC(=O)c1nc(cnc1N)-c1cccc(NS(=O)(=O)c2cccc(Cl)c2)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(C)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(OC)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(c1)C(F)(F)F
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(Cl)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccccc1Cl
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(Cl)cc1
CNC(=O)c1nc(cnc1N)-c1cccc(c1)S(=O)(=O)Nc1cccc(Cl)c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(F)cc1Cl
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1Cl
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(Cl)cc1Cl
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(Cl)c1Cl
CNC(=O)c1nc(cnc1N)-c1cccc(c1)S(=O)(=O)Nc1cccc(F)c1F
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1C
Nc1cnc(cn1)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
Nc1ncc(cn1)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
COc1nc(N)ncc1-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
Nc1ncc(-c2ccc(Cl)c(c2)S(=O)(=O)Nc2cccc(F)c2F)c(OCC(F)(F)F)n1
O=c1nc(cc(NCc2cccc3ccccc23)[nH]1)N1CCOCC1
C(Nc1cc(ncn1)N1CCOCC1)c1ccccc1
NCc1nc(NCc2ccccc2)cc(n1)N1CCOCC1
Nc1nc(NCc2ccccc2)cc(n1)N1CCOCC1
O=c1nc(cc(NCc2ccccc2)[nH]1)N1CCOCC1
O=c1cc(NCc2ccccc2)nc([nH]1)N1CCOCC1
COC(=O)c1cc(NCc2ccccc2)nc(c1)N1CCOCC1
C[C@@H](Nc1cc(nc(=O)[nH]1)N1CCOCC1)c1cccc2ccccc12 |r|
Oc1cc(NCc2ccccc2)nc(c1)N1CCOCC1
OCc1cc(NCc2ccccc2)nc(c1)N1CCOCC1
Clc1cccc(CNc2cc(nc(=O)[nH]2)N2CCOCC2)c1Cl
C[C@H](Nc1cc(nc(=O)[nH]1)N1CCOCC1)c1cccc2ccccc12 |r|
N#Cc1nc(NCc2ccccc2)cc(n1)N1CCOCC1
O=c1cc(nc(NCc2ccccc2)[nH]1)N1CCOCC1
Clc1cccc(CNc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Clc1ccccc1CNc1nc(cc(=O)[nH]1)N1CCOCC1
Clc1ccc(Cl)c(CNc2nc(cc(=O)[nH]2)N2CCOCC2)c1
O=c1cc(nc(NCc2cccc3ccccc23)[nH]1)N1CCOCC1
Clc1cccc(Cl)c1CNc1nc(cc(=O)[nH]1)N1CCOCC1
Clc1cccc(CNc2nc(cc(=O)[nH]2)N2CCOCC2)c1Cl
CCN(CC)S(=O)(=O)c1cc(ccc1Cl)Nc2nccc(n2)c3ccnc(c3)c4ccc(cc4)NC(=O)NC
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2cccc(c2)S(=O)(=O)NC)n1
CCN(CC)S(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)-c2ccc(NC(=O)NC)cc2)c1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(C)c(c2)S(=O)(=O)N(C)C)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2cccc(c2)S(N)(=O)=O)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(C)c(c2)S(=O)(=O)NC)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(Cl)c(c2)S(=O)(=O)N(C)C)n1
CCN(CC)S(=O)(=O)c1cc(Nc2nccc(n2)-c2ccnc(c2)-c2ccc(NC(=O)NC)cc2)ccc1C
COc1ccc(Nc2ncc(CN3CCS(=O)(=O)CC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cn1
COC(=O)N1CCN(Cc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc(N)n2)CC1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)N2CCN(C)CC2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)N2CCOCC2)cn1
COCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2cccnc2-c2nc(C)nc(N)n2)cn1
Cc1cc(nc(N)n1)-c1cccnc1Nc1cccc(O)c1
COc1ccc(cn1)N(C)c1ncccc1-c1nc(C)nc(N)n1
Cc1cc(nc(N)n1)-c1cccnc1Oc1cccc2[nH]ccc12
Cc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
C[C@@H]1CN(CCO1)c1cc([nH]c(=O)n1)N(CCO)Cc1cccc2ccccc12 |r|
C[C@H]1CN(CCO1)c1cc([nH]c(=O)n1)N(CCO)Cc1cccc2ccccc12 |r|
CN(C)CCCN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
CN(C)CCN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
CC(C)(CO)CN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
OC(CN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1)C(F)(F)F
CCC(O)CN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
CC(O)CN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
OCCCCN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
OCCCN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
OCCN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
O=c1nc(cc([nH]1)N(Cc1cccc2ccccc12)C1CC1)N1CCOCC1
CCN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
CN(Cc1cccc2ccccc12)c1cc(nc(=O)[nH]1)N1CCOCC1
O=c1cc(nc(NCc2cccc3ccccc23)[nH]1)-c1cn[nH]c1
Cc1cc(ccn1)-c1cc(=O)[nH]c(NCc2cccc3ccccc23)n1
OC1CCN(CC1)c1cc(=O)[nH]c(NCc2cccc3ccccc23)n1
COC1CN(C1)c1cc(=O)[nH]c(NCc2cccc3ccccc23)n1
CC1CN(CCO1)c1cc(=O)[nH]c(NCc2cccc3ccccc23)n1
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2ccc(cn12)-c1cnco1
CC(C)n1cc(cn1)-c1ccc2nc(Nc3ccn(C)n3)c(-c3cc(NC(C)=O)nc(C)n3)n2c1
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2ccc(cn12)-c1cccnc1C
Cc1cc(on1)-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cnn(c1)C1CC1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cncn1C
CC(=O)Nc1cccc(c1)-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cncnc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cncnc1
Cc1cc(ccn1)-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
COc1ncccc1-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cnccc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1ccccc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cccnc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cccnc1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1ccncc1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cccc(F)c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1ccccc1F
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccccn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2ccccn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn[nH]2)nc2ccccn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2cccnn12
COc1cnnc(Nc2cc(nc(C)n2)-c2c(Nc3ccn[nH]3)nc3cccnn23)c1
Cc1nc(Nc2cnn(c2)C2CCOC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2ccc(nn2)N2CCOCC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2cccnn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2cccnc2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2cnccn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nccc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
CNc1cc(nc(C)n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(N)cc(n1)-c1c(Nc2ccn[nH]2)nc2ccccn12
Cc1nc(N)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(N)nc(n1)-c1c(Nc2ccn(C)n2)nc2ccc(cn12)-c1cncnc1
Cc1csc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
C1CN(CCO1)c1nc(nc2ccsc12)-c1cccc2[nH]ncc12
CS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
Nc1nc2cc(ccn2n1)-c1cncc(c1)S(=O)(=O)Nc1ccccc1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1cc(F)n2nc(N)nc2c1
CCN(CC)S(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
Nc1nc2cc(ccn2n1)-c1cncc(c1)S(=O)(=O)NCC(F)(F)F
Nc1nc2cc(ccn2n1)-c1cncc(c1)S(=O)(=O)NCc1ccccc1
CC(C)(NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1)C(F)(F)F
CC1(C)CCN1S(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
CC(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
CCCNS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
CNS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
Nc1nc2cc(ccn2n1)-c1cncc(c1)S(N)(=O)=O
CN(c1cc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cnc1Cl)S(C)(=O)=O
CN(C)S(=O)(=O)Nc1cc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cnc1Cl
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cnc(Cl)c(NS(=O)(=O)N2CCOCC2)c1
COCCN(C)S(=O)(=O)Nc1cc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cnc1Cl
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cnc(Cl)c(NS(=O)(=O)c2cccnc2)c1
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
CN(C)S(=O)(=O)Nc1cc(Nc2ncccc2-c2nc(C)nc(N)n2)cnc1Cl
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
Nc1ccc(c(F)c1)-c1cccc2c1oc(nc2=O)N1CCOCC1
Cc1c(OCc2cccnc2)ccc2c1oc(nc2=O)N1CCOCC1
O=c1nc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
CC(=O)Nc1nc(C)c(s1)-c1cnc(o1)S(C)(=O)=O
CC(=O)Nc1nc(C)c(s1)-c1cnc(o1)C(C)(C)C
CC(=O)Nc1nc(C)c(s1)-c1cnc(CC(F)(F)F)o1
CC(=O)Nc1nc(C)c(s1)-c1cnc(o1)-c1cccnc1
CC(=O)Nc1nc(C)c(s1)-c1cnc(Sc2cccnc2)o1
CC(=O)Nc1nc(C)c(s1)-c1cnc(Nc2cccnc2)o1
CC(=O)Nc1nc(C)c(s1)-c1cnc(Nc2cccc(c2)C(O)=O)o1
OC1=NC(=O)C(S1)=Cc1ccc2OC(F)(F)Oc2c1 |w:7.8,t:1|
COc1ccc(cn1)N1CCc2ncnc(-c3cccc(c3)C(=O)N3CCN(CC3)C(C)=O)c2C1
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2CCN(Cc12)c1ccc(OC)nc1 |r|
COc1ccc(cn1)N1CCc2ncnc(-c3cccc(OC4CCN(CC4)C(C)=O)c3)c2C1
Oc1ccc(cc1)-c1ccc2c(NC(=O)C3CC3)n[nH]c2c1
O=C(Nc1cc(cc2[nH]ncc12)-c1cccc2[nH]ccc12)c1ccccn1
O=C(Nc1cc(cc2[nH]ncc12)-c1ccccc1)C1CC1
Oc1cccc(c1)-c1cc(NC(=O)C2CC2)c2cn[nH]c2c1
Oc1ccc(cc1)-c1cc(NC(=O)C2CC2)c2cn[nH]c2c1
Oc1ccc(cc1)-c1cc(NC(=O)c2ccccn2)c2cn[nH]c2c1
Oc1cccc(c1)-c1cc(NC(=O)c2ccccn2)c2cn[nH]c2c1
O=C(Nc1cc(cc2[nH]ncc12)-c1cccc2[nH]ccc12)C1CC1
O=C(Nc1cc(cc2[nH]ncc12)-c1ccc2cc[nH]c2c1)c1ccccn1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CN3CCN(CC3=O)C(=O)C3CCC3)n(C)c2n1
COc1ccc(cc1)C(=O)NNC(=O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
COc1ccc(cn1)-c1nc(N2CCOCC2)c2sc(CN(C)c3ccc(cc3)C(=O)NO)cc2n1
COc1ncc(cc1F)-c1cc(OCCCCCCC(=O)NO)c2ncnc(C)c2c1
Fc1cccc2-c3c(CS(=O)(=O)c12)c(nn3-c1ccc(CN2CCOCC2)cc1)C(=O)N1CCOCC1
Nc1ncc(-c2nc(nc(n2)N2CCN(CC2)C(=O)CNC(=O)C2CCN(CC2)C(=O)C=C)N2CCOCC2)c(n1)C(F)F
CN(CC(=O)N1CCN(CC1)c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1)C(=O)C1CCN(CC1)C(=O)C=C
Cc1nc2c(cc(cc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cncc(c1)-c1cnc2[nH]cc(-c3cccc(c3)C#N)c2c1
Cc1c(CN2CCN(CC2)C(=O)CO)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nc3s2)-c2cnc(N)nc2)N2CCOCC2)CC1
C1CN(CCO1)c1nc(nc2sccc12)-c1cccc2[nH]ncc12
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccsc2n1
CN1CCN(Cc2cc3c(nc(nc3s2)-c2cnc(N)nc2)N2CCOCC2)CC1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cc(CC3CCN(CC(F)(F)F)CC3)sc2n1
CS(=O)(=O)C1CCN(Cc2cc3c(nc(nc3s2)-c2cnc(N)nc2)N2CCOCC2)CC1
CN(C)C(=O)N1CCN(Cc2cc3c(nc(nc3s2)-c2cnc(N)nc2)N2CCOCC2)CC1
CS(=O)(=O)c1cccc(c1)-c1cc2c(nc(nc2s1)-c1cnc(N)nc1)N1CCOCC1
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)-c1cc[nH]n1)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)C#N)c1ccccc1Cl
CCNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccccc1Cl
CNCc1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)C(=O)NCCN)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)-c1cccc(CC(O)=O)c1)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3cc(ccc3-c2s1)-c1cccc(CN)c1)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3ccc(cc3-c2s1)C(N)=O)c1ccccc1Cl
CCNC(=O)c1ccc2OCCc3cc(sc3-c2c1)C(=O)N(C)c1ccccc1Cl
CN(C(=O)c1cc2CCOc3ccc(cc3-c2s1)C#N)c1ccccc1Cl
CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccc(cc1Cl)C(=O)N1CCN(C)CC1
CN(Cc1cc2c(nc(nc2s1)-c1cnc(N)nc1)N1CCOCC1)S(C)(=O)=O
CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1cc(ccc1Cl)C(=O)N1CCN(C)CC1
Cc1c(Cl)cccc1Cn1c(N)nc(=O)c2sc(nc12)N1CCOCC1
Cc1c(Cl)cccc1Cn1c(SCC(O)=O)nc(=O)c2sc(nc12)N1CCOCC1
CSc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Cc1c(Cl)cccc1Cn1c2nc(sc2c(=O)[nH]c1=S)N1CCOCC1
Cc1c(Cl)cccc1Cn1c2nc(sc2c(=O)[nH]c1=O)N1CCOCC1
Cc1c(Cl)cccc1Cn1c(CO)nc(=O)c2sc(nc12)N1CCOCC1
Cc1c(Cn2c(CN)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cn2c(CO)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cn2c(Cc3ccccc3)nc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cn2c(nc(=O)c3sc(nc23)N2CCOCC2)-c2ccccc2)cccc1C(F)(F)F
Cc1c(Cn2c(nc(=O)c3sc(nc23)N2CCOCC2)C2CC2)cccc1C(F)(F)F
CCc1nc(=O)c2sc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Cc1nc(=O)c2sc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1c(Cl)cccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
Cc1c(Cn2cnc(=O)c3sc(nc23)N2CCOCC2)cccc1C(F)(F)F
Clc1cccc(Cn2cnc(=O)c3sc(nc23)N2CCOCC2)c1Cl
Clc1cccc(Cn2cnc(=O)c3sc(nc23)N2CCOCC2)c1
Clc1sccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
Clc1ccccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
O=c1ncn(CCc2ccccc2)c2nc(sc12)N1CCOCC1
CC(c1ccccc1)n1cnc(=O)c2sc(nc12)N1CCOCC1
O=c1ncn(Cc2ccccc2)c2nc(sc12)N1CCOCC1
COc1nc(=O)c2sc(nc2n1Cc1cccc(Cl)c1C)N1CCOCC1
Cc1ccccc1Cn1cnc(=O)c2sc(nc12)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2C(F)(F)F)CC1
C[C@H]1CN(C[C@@H](C)N1Cc1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1)S(C)(=O)=O |r|
C[C@H]1CN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CCN1S(C)(=O)=O |r|
CN(C)CC(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
CCS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
Cc1c(CN2CCN(CC2)S(C)(=O)=O)nc2c(nc(cn12)-c1cnc(N)nc1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2cn3c(Cl)c(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2nc3c(nc(cn3c2Br)-c2cnc(N)nc2)N2CCOCC2)CC1
CCS(=O)(=O)Nc1cc(cnc1OC)-c1ccc2ncnc(Nc3cccc(c3)C(=O)OC)c2c1
CCS(=O)(=O)Nc1cc(cnc1OC)-c1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1
Nc1ccc(cn1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
Nc1ccc(nc1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
C1Cc2c(nc(nc2-c2cncnc2)N2CCOCC2)N1c1ccncc1
C1Cc2c(nc(nc2-c2cccnc2)N2CCOCC2)N1c1ccncc1
C1Cc2c(nc(nc2-c2ccncc2)N2CCOCC2)N1c1ccncc1
C1Cc2c(nc(nc2-c2cccc3cn[nH]c23)N2CCOCC2)N1c1ccncc1
C1Cc2c(nc(nc2-c2cccc3[nH]ncc23)N2CCOCC2)N1c1ccncc1
Nc1n[nH]c2cc(ccc12)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
C1Cc2c(nc(nc2-c2ccc3[nH]ncc3c2)N2CCOCC2)N1c1ccncc1
C1Cc2c(nc(nc2-c2ccc3cn[nH]c3c2)N2CCOCC2)N1c1ccncc1
C1Cc2c(nc(nc2-c2ccc3nc[nH]c3c2)N2CCOCC2)N1c1ccncc1
CNS(=O)(=O)c1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
CNC(=O)c1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
NC(=O)c1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
OC(=O)c1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
Nc1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
Cc1c(O)cccc1-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
Cc1ccc(cc1O)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
COc1cccc(c1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
Cn1ccc(n1)N1CCc2c1nc(nc2-c1cccc(O)c1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1nccs1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1ccc2ncccc2c1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1cc[nH]c(=O)c1)N1CCOCC1
Cc1cc(ccn1)N1CCc2c1nc(nc2-c1cccc(O)c1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1ccccc1)N1CCOCC1
Oc1cccc(c1)-c1nc(nc2N(CCc12)c1ccccn1)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc2N(CCc12)c1ccncc1)N1CCOCC1
CN(C)CC(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
CN[C@@H](C)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
NCCC(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
NCCCC[C@H](N)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)[C@@H]1CCCN1)N1CCOCC1 |r|
N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
CC[C@H](C)[C@H](N)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
N[C@H](Cc1ccccc1)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
N[C@@H](Cc1ccccc1)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
C[C@@H](N)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
C[C@H](N)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
CC(=O)NCC(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
NCC(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
CN(C1CCCCC1)C(=O)c1cc2CCOc3ccccc3-c2s1
CC(C)N(C)C(=O)c1cc2CCOc3ccccc3-c2s1
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1ncnn1C1CCC1
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1ncnn1CC(F)(F)F
CC(C)(O)Cn1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O
CC(C)Cn1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O
CC(C)n1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O
CN(C)CCn1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O
CN(C(=O)c1cc2CCOc3ccccc3-c2s1)c1ccc(F)cc1F
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1ncnn1CCO
Clc1ccccc1-c1ocnc1-c1cc2CCOc3cccnc3-c2s1
Clc1ccccc1-n1cnnc1-c1cc2CCOc3ccccc3-c2s1
CN(C(=O)c1cc2CCOc3cccnc3-c2s1)c1ccccc1Cl
Clc1ccccc1-n1c(n[nH]c1=O)-c1cc2CCOc3ccccc3-c2s1 |(28.43,-36.51,;27.72,-35.15,;26.18,-35.08,;25.47,-33.71,;26.3,-32.41,;27.84,-32.48,;28.54,-33.85,;30.08,-33.92,;31.14,-32.81,;32.52,-33.45,;32.33,-34.98,;30.82,-35.27,;30.04,-36.59,;30.85,-31.29,;31.88,-30.19,;31.16,-28.86,;31.94,-27.42,;31.31,-25.97,;29.76,-25.57,;28.48,-26.58,;27.14,-25.81,;25.81,-26.58,;25.81,-28.13,;27.14,-28.9,;28.49,-28.13,;29.67,-29.15,;29.48,-30.65,)|
Fc1ccc(c(F)c1)-n1ncnc1-c1cc2CCOc3ccccc3-c2s1
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1n[nH]cc1-c1ccccc1Cl
NC(=O)c1cnc2-c3sc(cc3CCOc2c1)-c1[nH]nnc1-c1ccc(F)cc1F
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1nncn1-c1ccccc1Cl
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1nnnn1-c1ccccc1Cl
CC(=O)Nc1nc(c([nH]1)-c1cc2CCOc3cccnc3-c2s1)-c1ccccc1Cl
Nc1nc(-c2cc3CCOc4ccccc4-c3s2)c(s1)-c1ccccc1Cl
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1n[nH]c(=O)n1-c1ccccc1Cl |(29.44,-23.44,;30.77,-22.67,;30.77,-21.13,;32.1,-23.43,;32.1,-24.98,;33.44,-25.75,;34.78,-24.98,;35.96,-26,;35.77,-27.5,;37.14,-28.14,;38.18,-27.04,;37.45,-25.71,;38.23,-24.27,;37.6,-22.82,;36.06,-22.42,;34.77,-23.43,;33.43,-22.66,;37.43,-29.66,;38.81,-30.3,;38.63,-31.83,;37.11,-32.12,;36.33,-33.45,;36.37,-30.77,;34.83,-30.7,;34.13,-29.33,;32.59,-29.26,;31.76,-30.56,;32.47,-31.93,;34.01,-32,;34.72,-33.36,)|
NC(=O)c1ccc2-c3sc(cc3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F
COc1ccc2n(c(nc2c1)C(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1ccc2n(c(nc2c1)C(C)C)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1ccc2n(c(C)nc2c1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1ccc2nc(C(C)C)n(-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)c2c1
COc1ccc2nc(C)n(-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)c2c1
CC(C)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1ccc2nc(C(F)F)n(-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)c2c1
CS(=O)(=O)C1(CCNCC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CCOCC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CC(C)(c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1)S(C)(=O)=O
CN1CCN(CC1)c1ncc(cn1)-c1csc2c1oc(cc2=O)N1CCOCC1
S=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
O=C(Nc1ccccn1)c1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=C(Nc1ccncc1)c1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=C(Nc1ccccn1)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=C(Nc1ccncc1)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=C(Nc1cccnc1)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=C(Nc1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1)c1ccncc1
O=C(Nc1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1)c1cccnc1
O=C(Nc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1)c1cccnc1
CNc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
CC(=O)Nc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
COc1ccc(cc1)C#Cc1csc2c1oc(cc2=O)N1CCOCC1
FC(F)(F)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
Clc1ccc(cc1Cl)-c1csc2c1oc(cc2=O)N1CCOCC1
Clc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccc(cc1)C#N)N1CCOCC1
O=c1cc(oc2c(Cc3ccccc3)csc12)N1CCOCC1
COc1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccoc1)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccsc1)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccc2[nH]ccc2c1)N1CCOCC1
Cc1cccc(c1)-c1csc2c1oc(cc2=O)N1CCOCC1
Cc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=c1cc(oc2c(csc12)-c1cccs1)N1CCOCC1
CS(=O)(=O)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=c1cc(oc2c(csc12)-c1cc2ccccc2[nH]1)N1CCOCC1
CN(C)c1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
COc1ccc(cc1)-c1csc2c1oc(cc2=O)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccc2OCOc2c1)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccco1)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccncc1)N1CCOCC1
O=c1cc(oc2c(csc12)-c1cccnc1)N1CCOCC1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C)CC4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
C1COc2ccc(cc2CN1)-c1cnc2ccccc2c1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccccc2C1
CCc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1)S(C)(=O)=O
CCNc1cc(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1)S(C)(=O)=O
CCCc1cc(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1)S(C)(=O)=O
CCc1cc(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1)S(C)(=O)=O
Cc1cc(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1
CC(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2cnn(C)c2c1
Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1)S(C)(=O)=O
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccccc1
CCS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
CC(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2cn[nH]c2c1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2ccccc2c1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1cccnc1
FC(F)(F)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
CNS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1cn[nH]c1
NS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
CS(=O)(=O)c1ccc(C(=O)N2CCOc3ccc(cc3C2)-c2ccc3nc[nH]c3c2)c(Cl)c1
CS(=O)(=O)c1ccc(C(=O)N2CCOc3ccc(cc3C2)-c2ccc3nc[nH]c3c2)c(Br)c1
CS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
Cc1cc(ccc1S(C)(=O)=O)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1cnc2ccccc2c1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2cn[nH]c2c1
CC(=O)Nc1cccc(c1)-c1ccc2OCCN(Cc2c1)C(=O)c1ccc(cc1)C(=O)C(F)(F)F
O=C(N1CCOc2ccc(cc2C1)-c1cnc2ccccc2c1)c1ccccc1
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2[nH]ncc2c1
Cc1nc2ccc(cc2[nH]1)-c1ccc2OCCN(Cc2c1)C(=O)c1ccc(cc1)C(=O)C(F)(F)F
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1
CC(C)(O)c1ccc(cn1)-c1cnc2[nH]c(=O)n(CC3CCOCC3)c2n1
O=c1[nH]c2ncc(nc2n1CCC1CCOCC1)-c1ccc(cc1)-c1nnc[nH]1
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wD:8.7,11.14,(55.51,-1.14,;55.51,-2.68,;54.18,-3.45,;54.18,-5,;52.85,-5.77,;55.52,-5.77,;56.85,-5,;58.18,-5.78,;58.18,-7.31,;59.51,-8.08,;59.5,-9.63,;58.16,-10.39,;56.83,-9.61,;56.84,-8.08,;58.15,-11.93,;56.81,-12.69,;55.48,-11.91,;59.53,-5.01,;60.86,-5.78,;59.53,-3.45,;58.19,-2.67,;56.85,-3.45,;60.87,-2.69,;62.26,-3.33,;63.3,-2.2,;62.55,-.86,;61.04,-1.17,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:19.20,22.27,(52.42,-2.69,;51.08,-1.92,;49.75,-2.69,;49.75,-4.23,;48.41,-4.99,;47.08,-4.21,;47.08,-2.68,;48.41,-1.91,;45.74,-4.97,;44.39,-4.19,;43.06,-4.97,;41.72,-4.21,;41.72,-2.67,;40.39,-4.98,;40.39,-6.52,;39.06,-7.29,;41.72,-7.29,;43.05,-6.52,;44.39,-7.3,;44.38,-8.84,;45.71,-9.6,;45.7,-11.15,;44.36,-11.91,;43.04,-11.13,;43.04,-9.6,;44.35,-13.45,;43.01,-14.21,;41.69,-13.43,;45.74,-6.53,;47.07,-7.3,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:20.21,23.28,(38.17,-2.19,;36.84,-1.42,;35.5,-2.19,;35.5,-3.73,;34.16,-4.49,;32.83,-3.72,;32.83,-2.18,;34.16,-1.41,;34.16,.14,;31.49,-4.48,;30.15,-3.69,;28.81,-4.47,;27.47,-3.71,;27.47,-2.17,;26.14,-4.48,;26.14,-6.02,;24.81,-6.79,;27.48,-6.79,;28.8,-6.03,;30.14,-6.8,;30.13,-8.34,;31.46,-9.11,;31.45,-10.65,;30.11,-11.42,;28.79,-10.63,;28.8,-9.1,;30.1,-12.95,;28.77,-13.72,;27.44,-12.94,;31.49,-6.03,;32.82,-6.8,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(O)=O)c1=O |r,wU:22.27,wD:19.20,(12.89,-1.02,;11.56,-.25,;10.23,-1.01,;8.89,-.24,;7.56,-1.01,;7.56,-2.54,;8.89,-3.32,;10.22,-2.55,;6.22,-3.3,;4.87,-2.52,;3.53,-3.3,;2.2,-2.53,;2.19,-.99,;.87,-3.3,;.87,-4.85,;-.48,-5.62,;2.2,-5.62,;3.53,-4.85,;4.87,-5.63,;4.86,-7.16,;3.52,-7.93,;3.51,-9.46,;4.84,-10.24,;6.18,-9.48,;6.19,-7.93,;4.83,-11.78,;3.49,-12.54,;2.16,-11.76,;2.16,-10.22,;.82,-12.52,;6.22,-4.86,;7.55,-5.63,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:19.20,22.27,(23.9,-1.62,;22.57,-.85,;21.24,-1.62,;19.89,-.85,;18.57,-1.62,;18.56,-3.15,;19.9,-3.93,;21.23,-3.16,;17.23,-3.91,;15.88,-3.12,;14.54,-3.9,;13.21,-3.14,;13.2,-1.6,;11.88,-3.91,;11.87,-5.45,;10.54,-6.22,;13.21,-6.22,;14.54,-5.46,;15.88,-6.23,;15.87,-7.77,;17.2,-8.54,;17.19,-10.08,;15.85,-10.85,;14.52,-10.07,;14.53,-8.53,;15.84,-12.39,;14.5,-13.15,;13.17,-12.37,;17.22,-5.46,;18.56,-6.24,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:11.14,wD:8.7,(44.02,-44.59,;44.03,-46.13,;42.7,-46.9,;42.69,-48.44,;41.36,-49.21,;44.03,-49.21,;45.36,-48.45,;46.7,-49.22,;46.69,-50.76,;45.35,-51.52,;45.34,-53.06,;46.67,-53.84,;48.01,-53.07,;48.02,-51.53,;46.66,-55.38,;45.32,-56.14,;43.99,-55.36,;42.65,-56.12,;44,-53.82,;48.05,-48.45,;49.38,-49.23,;48.05,-46.9,;46.7,-46.11,;45.36,-46.89,;49.39,-46.14,;50.78,-46.78,;51.82,-45.64,;51.06,-44.31,;49.55,-44.61,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wD:8.7,11.14,(43.18,-30.37,;43.19,-31.91,;41.86,-32.68,;41.85,-34.23,;40.52,-34.99,;43.19,-35,;44.52,-34.23,;45.86,-35.01,;45.85,-36.54,;47.18,-37.31,;47.17,-38.86,;45.83,-39.62,;44.5,-38.84,;44.51,-37.31,;45.82,-41.16,;44.48,-41.92,;43.15,-41.14,;41.81,-41.9,;43.16,-39.6,;47.21,-34.23,;48.54,-35.01,;47.21,-32.68,;45.86,-31.89,;44.52,-32.67,;48.55,-31.92,;49.94,-32.56,;50.98,-31.43,;50.22,-30.09,;48.71,-30.4,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:11.14,wD:8.7,(65.77,-15.8,;65.77,-17.34,;64.44,-18.11,;64.44,-19.65,;63.11,-20.42,;65.77,-20.42,;67.1,-19.65,;68.44,-20.43,;68.43,-21.96,;67.09,-22.73,;67.09,-24.26,;68.41,-25.04,;69.75,-24.28,;69.76,-22.73,;68.4,-26.58,;67.07,-27.34,;65.74,-26.56,;69.79,-19.66,;71.12,-20.43,;69.79,-18.1,;68.45,-17.32,;67.11,-18.1,;71.13,-17.34,;72.46,-18.12,;73.8,-17.36,;73.79,-15.82,;75.12,-15.05,;75.13,-13.51,;73.79,-12.74,;72.46,-13.51,;72.46,-15.04,;71.13,-15.81,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:11.14,wD:8.7,(54.37,-15.83,;54.38,-17.37,;53.05,-18.15,;53.05,-19.69,;51.71,-20.46,;54.38,-20.46,;55.71,-19.69,;57.05,-20.47,;57.04,-22.01,;55.7,-22.77,;55.69,-24.3,;57.02,-25.08,;58.36,-24.32,;58.37,-22.78,;57.01,-26.62,;55.67,-27.39,;54.34,-26.61,;58.4,-19.7,;59.73,-20.47,;58.4,-18.14,;57.05,-17.36,;55.71,-18.14,;59.74,-17.38,;61.13,-18.03,;62.17,-16.89,;61.41,-15.55,;62.05,-14.15,;59.9,-15.86,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:11.14,wD:8.7,(43.23,-15.53,;43.23,-17.07,;41.9,-17.84,;41.9,-19.39,;40.57,-20.15,;43.23,-20.16,;44.56,-19.39,;45.9,-20.17,;45.89,-21.7,;44.56,-22.47,;44.55,-24,;45.88,-24.78,;47.21,-24.02,;47.23,-22.47,;45.87,-26.32,;44.53,-27.08,;43.2,-26.3,;47.25,-19.39,;48.58,-20.17,;47.25,-17.84,;45.91,-17.05,;44.57,-17.83,;48.59,-17.08,;49.98,-17.72,;51.02,-16.59,;50.26,-15.25,;48.76,-15.56,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCO)c1=O |r,wU:22.27,wD:19.20,(39.75,-16,;38.42,-15.23,;37.08,-15.99,;37.08,-17.53,;35.75,-18.3,;34.41,-17.52,;34.42,-15.99,;35.74,-15.22,;33.08,-18.28,;31.73,-17.5,;30.39,-18.28,;29.05,-17.51,;29.05,-15.97,;27.73,-18.28,;27.72,-19.83,;26.39,-20.6,;29.06,-20.6,;30.39,-19.83,;31.72,-20.61,;31.72,-22.14,;30.38,-22.91,;30.37,-24.44,;31.7,-25.22,;33.04,-24.46,;33.05,-22.91,;31.69,-26.76,;30.35,-27.52,;29.02,-26.74,;33.07,-19.84,;34.4,-20.61,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCO)c1=O |r,wU:23.28,wD:20.21,(26.25,-15.63,;24.91,-14.86,;23.58,-15.63,;23.58,-17.17,;22.24,-17.93,;20.91,-17.16,;20.91,-15.63,;22.24,-14.86,;22.24,-13.32,;19.57,-17.92,;18.23,-17.13,;16.89,-17.91,;15.55,-17.15,;15.55,-15.61,;14.22,-17.92,;14.22,-19.46,;12.89,-20.23,;15.55,-20.23,;16.88,-19.47,;18.22,-20.24,;18.21,-21.78,;16.88,-22.54,;16.87,-24.07,;18.19,-24.86,;19.53,-24.09,;19.54,-22.55,;18.18,-26.39,;16.85,-27.16,;15.52,-26.38,;19.57,-19.47,;20.9,-20.24,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wD:8.7,11.14,(3.1,-15.67,;3.11,-17.2,;1.78,-17.98,;1.78,-19.52,;.44,-20.29,;3.11,-20.29,;4.44,-19.52,;5.78,-20.3,;5.77,-21.84,;7.1,-22.6,;7.09,-24.15,;5.75,-24.91,;4.42,-24.13,;4.43,-22.6,;5.74,-26.45,;4.4,-27.21,;3.07,-26.43,;7.12,-19.53,;8.46,-20.3,;7.13,-17.97,;5.78,-17.19,;4.44,-17.97,;8.47,-17.21,;9.8,-17.99,;11.13,-17.23,;11.13,-15.69,;12.46,-14.92,;12.47,-13.38,;11.12,-12.61,;9.8,-13.38,;9.8,-14.91,;8.47,-15.68,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wD:8.7,11.14,(66.3,-1.69,;66.31,-3.23,;64.98,-4,;64.98,-5.54,;63.64,-6.31,;66.31,-6.31,;67.64,-5.55,;68.98,-6.32,;68.97,-7.86,;70.3,-8.63,;70.29,-10.17,;68.95,-10.94,;67.62,-10.16,;67.63,-8.62,;68.94,-12.48,;67.6,-13.24,;66.27,-12.46,;70.33,-5.55,;71.66,-6.32,;70.33,-3.99,;68.98,-3.21,;67.64,-3.99,;71.67,-3.24,;73.06,-3.88,;74.1,-2.74,;73.34,-1.4,;73.98,-0,;71.83,-1.71,)|
CC(C)(O)Cn1cc(cn1)-c1ccc2-c3nc(sc3CCOc2c1)-c1ncnn1CC(F)(F)F
CC(C)n1c(n[nH]c1=O)-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CC(C)(C)O)c2)s1
CC(C)n1nc(N)nc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CC(C)(C)O)c2)s1
CC(C)n1nc(N)nc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CCO)c2)s1
CC(C)n1nc(C)nc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CCO)c2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(c2)C(C)(C)C(N)=O)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CCN)c2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CS(C)(=O)=O)c2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CC(C)(C)O)c2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CN(C2)C(C)(C)C(N)=O)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CN(C2)C(=O)C(C)(C)N)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CN(C2)C(=O)CO)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CN(CC(C)(C)O)C2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CN(C[C@H](O)CO)C2)s1 |r|
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CN(CCO)C2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2ccc(N)nc2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2ccc[nH]c2=O)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cn(C)cn2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2ncc[nH]2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CCNCC2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CCCN2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CCNC2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(CNCCO)ccc-23)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(CNC(C)=O)ccc-23)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C(O)CO)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(CO)ccc-23)s1
CNC(=O)c1ccc2-c3cc(nn3CCOc2c1)-c1ncnn1C(C)C
CNC(=O)c1ccc2-c3sc(nc3CCOc2c1)-c1ncnn1C(C)C
CC(C)n1ncnc1-c1nc2-c3ccc(Cl)cc3OCCn2n1
CC(C)n1ncnc1-c1nc2CCOc3ccccc3-n2n1
CC(C)n1ncnc1-n1cc2CCOc3ccccc3-c2n1
CC(C)n1ncnc1-c1cn2CCOc3ccccc3-c2n1
CNC(=O)c1ccc2-c3nc(cn3CCOc2c1)-c1ncnn1C(C)C
CC(C)n1ncnc1-c1nc-2c(CCOc3ccccc-23)s1
CNC(=O)c1ccc2-c3nc(sc3CCOc2c1)-c1ncnn1C(C)C
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C(N)=O)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cn[nH]c2)s1
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)C2CNC2)s1
Cc1nc(-c2cn3CCOc4cc(ccc4-c3n2)-c2cnn(CCO)c2)n(C)n1
Cc1nnc([nH]1)-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(CCO)c1
CC(C)n1ncnc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cn[nH]c1
Cc1nc(NC(=O)N2CCC[C@@H]2C(N)=O)sc1-c1ccnc(c1)C(C)(C)C |r|
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2sc(C(=O)N3CCN(CC3)C(C)(C)C(N)=O)c(C)c2n1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(C(=O)N3CCN(CC3)C(C)(C)C(N)=O)n(C)c2n1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CN3CCN(CC3)C(C)(C)C(N)=O)n(C)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2ncn(C)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2nc(n(C)c2n1)C(C)(C)O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2nc(n(CCO)c2n1)C(C)(C)O |r|
CC(C)(O)c1nc2c(nc(nc2n1CCO)-c1cnc(N)nc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@@H]3C[C@H]2CO3)c2n(C)ncc2n1 |r,THB:14:15:20.21:18|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)nc(C)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)ncc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)ncc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)ccc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)ccc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCCOCC2)c2n(C)cnc2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@H]2C)c2n(C)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(CC)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2ncn(CC)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)c(nc2n1)C(C)(C)O |r|
COc1cc(cnc1N)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(N)c(C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(N)cc1C(F)(F)F
CC(=O)Nc1nc2ccc(cc2n1C)-c1cnc(N)c(c1)C(F)(F)F
CC(=O)Nc1cn2cc(cnc2n1)-c1cnc(N)c(c1)C(F)(F)F
CC(=O)Nc1ncc2cc(ccc2n1)-c1cnc(N)c(c1)C(F)(F)F
CC(=O)Nc1nc2ccc(cc2o1)-c1cnc(N)c(c1)C(F)(F)F
CC(=O)Nc1cn2cc(ncc2n1)-c1cnc(N)c(c1)C(F)(F)F
Nc1ncc(cc1C(F)(F)F)-c1ccc2nc(NC(=O)CCCN3CCOCC3)sc2c1
Nc1ncc(cc1C(F)(F)F)-c1ccc2nc(NC(=O)CCCN3CCCCC3)sc2c1
Nc1ccc(cn1)-c1ccc2nc(NC(=O)CCCN3CCCCC3)sc2c1
Nc1ccc(cn1)-c1ccc2nc(NC(=O)CN3CCCCC3)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(N)c(c1)C(F)(F)F
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(N)nc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccc(N)nc1
CC(=O)Nc1nc2ccc(cc2s1)-c1cccnc1
CC(=O)Nc1nc2ccc(cc2s1)C(=O)OC
CCN1CCN(CC(=O)Nc2ccc(-c3cccc4c3oc(cc4=O)N3CCOCC3)c3sc4ccccc4c23)CC1
COc1c(OCCCCCC(=O)NO)ccc2C3=NCCN3C(NC(=O)c3ccccc3)=Nc12 |c:33,t:17|
Oc1cc(cc(c1)C(F)(F)F)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Cc1cc(O)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Oc1cc(cc(c1)[N+]([O-])=O)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Oc1cc(Br)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Oc1cc(Cl)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Oc1cc(F)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Nc1cc(O)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Oc1cc(O)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
C[C@H]1COCCN1c1nc(cc(n1)C1(CC1)S(C)(=O)=O)-c1cnc(N)cc1F |r|
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1 |r|
C[C@H]1Cc2ccccc2N1C(=O)CC3=NC(=CC(=O)N3)N4CCOCC4
CC1(C)CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12
CC1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12
CC1(C)Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CCc3ccccc23)nc(cc1=O)N1CCOCC1
CN1CCN(Cc2cccc3N(CCc23)C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)CC1
CN1CCN(CC1)c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1ccncc1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1cccnc1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1ccccn1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1ccccc1
FC(F)(F)Oc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
FC(F)(F)c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
COc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Brc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Clc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Clc1ccc2N(CCc2c1)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc2N(CCc2c1)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2ccccc12
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nc(N)nc(C)c2c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n1[C@H]1CC[C@@H](CC1)OCCO |r,wU:22.28,wD:19.21,(34.08,-10.67,;33.31,-9.34,;31.77,-9.34,;31,-10.68,;29.46,-10.68,;28.69,-9.34,;29.46,-8.01,;30.99,-8.01,;27.16,-9.35,;26.24,-8.09,;24.77,-8.57,;23.44,-7.81,;23.43,-6.27,;22.11,-8.58,;22.11,-10.12,;20.77,-10.89,;23.44,-10.89,;24.77,-10.12,;26.25,-10.6,;27.01,-11.93,;26.24,-13.26,;27,-14.59,;28.54,-14.61,;29.32,-13.27,;28.55,-11.93,;29.3,-15.94,;28.52,-17.27,;26.98,-17.26,;26.2,-18.59,)|
COc1ccc(cn1)-c1cn([C@H]2CC[C@@H](CC2)OCCO)c2nc(N)nc(C)c12 |r,wU:14.18,wD:11.11,(14.58,-4.93,;13.04,-4.99,;12.32,-6.35,;13.14,-7.66,;12.42,-9.02,;10.88,-9.07,;10.06,-7.77,;10.78,-6.41,;10.15,-10.43,;11.07,-11.68,;10.16,-12.93,;10.92,-14.27,;10.15,-15.6,;10.91,-16.93,;12.45,-16.94,;13.23,-15.61,;12.46,-14.27,;13.21,-18.28,;12.43,-19.61,;10.89,-19.6,;10.11,-20.93,;8.68,-12.45,;7.35,-13.23,;6.01,-12.46,;4.68,-13.22,;6.02,-10.91,;7.35,-10.14,;7.34,-8.6,;8.68,-10.9,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C(C)C)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C2CC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C2CCOCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:34.37,wD:31.33,(17.7,-35.44,;16.37,-34.67,;15.04,-35.44,;13.76,-34.69,;12.37,-35.44,;12.37,-36.94,;13.76,-37.79,;15.03,-36.93,;16.39,-37.65,;16.44,-39.19,;14.9,-39.18,;15.66,-40.51,;17.8,-39.91,;19.09,-39.1,;20.45,-39.81,;20.51,-41.36,;21.87,-42.08,;19.2,-42.17,;17.85,-41.45,;16.54,-42.26,;11.09,-37.79,;9.7,-36.94,;8.42,-37.79,;7.03,-36.94,;7.03,-35.44,;5.75,-37.79,;5.75,-39.28,;4.36,-40.03,;7.03,-40.03,;8.42,-39.28,;9.7,-40.03,;9.7,-41.63,;8.31,-42.43,;8.3,-44.03,;9.69,-44.84,;9.69,-46.38,;11.09,-44.04,;11.09,-42.43,;11.09,-39.28,;12.37,-40.03,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccccc1F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1cccc(F)c1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1OC)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(C)(=O)=O)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:34.40,wD:31.33,(42.88,-5.02,;41.55,-4.24,;40.21,-5.01,;38.93,-4.26,;37.54,-5.01,;37.54,-6.51,;38.93,-7.37,;40.21,-6.5,;41.57,-7.23,;41.62,-8.77,;40.08,-8.76,;40.84,-10.09,;42.98,-9.49,;44.28,-8.68,;45.63,-9.39,;45.69,-10.94,;47.05,-11.66,;44.38,-11.75,;43.02,-11.03,;41.72,-11.84,;36.26,-7.37,;34.87,-6.51,;33.59,-7.37,;32.19,-6.51,;32.19,-5.01,;30.91,-7.37,;30.91,-8.86,;29.52,-9.61,;32.19,-9.61,;33.59,-8.86,;34.87,-9.61,;34.84,-11.14,;33.49,-11.88,;33.46,-13.42,;34.78,-14.22,;36.13,-13.47,;36.16,-11.93,;34.74,-15.76,;33.39,-16.5,;32.08,-15.7,;30.73,-16.44,;36.26,-8.86,;37.54,-9.61,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]ncc2c1
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]cnc2c1
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2n(C)ccc2c1
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
COc1ncc(cc1F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cn1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)cc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:22.27,wD:19.20,(19.19,-4.99,;17.85,-4.23,;16.53,-5,;16.53,-6.64,;15.1,-7.41,;13.79,-6.64,;13.79,-5,;15.1,-4.23,;12.36,-7.41,;11.03,-6.64,;9.6,-7.41,;8.29,-6.64,;8.29,-5,;6.86,-7.41,;6.86,-8.95,;5.54,-9.72,;8.29,-9.72,;9.6,-8.95,;11.03,-9.72,;11.03,-11.38,;9.6,-12.15,;9.6,-13.68,;11.03,-14.56,;12.36,-13.68,;12.36,-12.15,;11.03,-16.1,;9.6,-16.87,;8.29,-16.1,;6.97,-16.87,;12.36,-8.95,;13.79,-9.72,)|
CC1Cc2cc(F)ccc2N1C(=O)Cc1nc(sc1C(N)=O)N1CCOCC1
CC1Cc2c(cccc2Cl)N1C(=O)Cc1nc(sc1C(N)=O)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2cc(Br)ccc12)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2cc(Cl)ccc12)N1CCOCC1
CC1CN(C(=O)Cc2nc(sc2C(N)=O)N2CCOCC2)c2ccccc12
CC1Cc2ccccc2N1C(=O)Cc1nc(sc1C(N)=O)N1CCOCC1
OC(=O)c1sc(nc1CC(=O)N1CCc2cc(Br)ccc12)N1CCOCC1
CC1Cc2cc(F)ccc2N1C(=O)Cc1nc(sc1C(O)=O)N1CCOCC1
OC(=O)c1sc(nc1CC(=O)N1CCc2cc(F)ccc12)N1CCOCC1
CC1Cc2c(cccc2Cl)N1C(=O)Cc1nc(sc1C(O)=O)N1CCOCC1
CC1Cc2ccccc2N1C(=O)Cc1nc(sc1C(O)=O)N1CCOCC1
OC(=O)c1sc(nc1CC(=O)N1CCc2ccccc12)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)Nc1ccc(F)c(Cl)c1)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2c1cccc2F)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2cc(F)ccc12)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2c1cccc2Cl)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2ccccc12)N1CCOCC1
CC1Cc2c(cccc2Br)N1C(=O)Cc1nc(sc1C(O)=O)N1CCOCC1
OC(=O)c1sc(nc1CC(=O)N1CCc2c1cccc2Cl)N1CCOCC1
NC(=O)c1sc(nc1CC(=O)N1CCc2c1cccc2Br)N1CCOCC1
CC1Cc2c(cccc2Br)N1C(=O)Cc1nc(sc1C(N)=O)N1CCOCC1
OC(=O)c1sc(nc1CC(=O)N1CCc2c1cccc2Br)N1CCOCC1
CNC(=O)c1nnc2ccc(cc2c1N[C@@H](C)C1CCOCC1)-c1ccc(OCCCN(C)C)nc1 |r|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN(C)C)nc1)C(N)=O)C1CCOCC1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OC2CCOCC2)c2nc(NC(C)=O)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC)c2nc(N)nc(C)c2c1
CNc1nc(C)c2cc(cc(OC3CCOC(C)(C)C3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCC2)c2nc(N)nc(C)c2c1
CNc1nc(C)c2cc(cc(O[C@@H]3CCOC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1 |r|
CNc1nc(C)c2cc(cc(OCC3CCOCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC(C)C)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(O[C@@H]2CCOC2)c2nc(N)nc(C)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOC(C)(C)C2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(nc(C)c2c1)N(C)C
CNc1nc(C)c2cc(cc(OCC3CCOC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CNc1nc(C)c2cc(cc(OC3CCCCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCC2CCOC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCN(C)CC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCN2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1F)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
Cc1nc(N)nc2c(OC3CCOCC3)cc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
CNc1nc(C)c2cc(cc(OC3CCOCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCCCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCC(F)(F)CC2)c2nc(N)nc(C)c2c1
COCCOc1cc(cc2c(C)nc(N)nc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCC2CC2)c2nc(N)nc(C)c2c1
CNc1nc(C)c2cc(cc(O[C@H]3CCOC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1 |r|
CNc1nc(C)c2cc(cc(OC3CCCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CCNc1nc(C)c2cc(cc(OC3CCOCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(NCC3CC3)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(NC(C)=O)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(O[C@H]2CCOC2)c2nc(N)nc(C)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:34.40,wD:31.33,(28.85,-30.23,;28.85,-28.69,;27.51,-27.92,;26.18,-28.69,;24.84,-27.92,;24.84,-26.38,;26.17,-25.61,;27.51,-26.37,;28.84,-25.6,;30.18,-26.38,;30.96,-27.71,;29.1,-27.48,;31.51,-25.6,;31.5,-24.06,;32.83,-23.28,;34.16,-24.05,;35.5,-23.27,;34.17,-25.59,;32.85,-26.36,;32.86,-27.9,;23.5,-25.61,;22.17,-26.39,;20.84,-25.62,;19.51,-26.4,;19.51,-27.93,;18.17,-25.63,;18.17,-24.09,;16.83,-23.32,;19.5,-23.31,;20.84,-24.08,;22.17,-23.31,;22.16,-21.77,;23.5,-20.99,;23.49,-19.45,;22.16,-18.69,;20.83,-19.46,;20.83,-21,;22.15,-17.15,;20.82,-16.38,;20.82,-14.84,;19.48,-14.07,;23.5,-24.08,;24.84,-23.31,)|
COc1ccc(cn1)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
CNc1nc(C)c2cc(cc(OC3CCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCC2CCCO2)c2nc(N)nc(C)c2c1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(Cc2cn(CCCCCC(=O)Nc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)nn2)CC1)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)CCC(=O)NCCCCCC(=O)Nc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)CCC(=O)NCCCC(=O)Nc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CCCCCC(=O)Nc2cccc3C(=O)N(C4CCC(=O)NC4=O)C(=O)c23)CC1)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(Cc2cn(CCCC(=O)Nc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)nn2)CC1)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)CCCCCNC(=O)CCC(=O)NCCCC(=O)Nc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)N1CCOCC1
Cc1nc(NC(=O)CN)sc1-c1cncc(NS(=O)(=O)c2ccccc2)c1
Cc1nc(NC(=O)CN)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2C)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2Cl)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1 |r|
CCC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(C)c2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(C)C)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(F)(F)F)c1 |r|
Cc1nc(NC(=O)[C@@H](N)Cc2ccccc2)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
CC(C)C[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
Cc1nc(NC(=O)C(N)C2CC2)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(C)[C@@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
CC[C@@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
CC[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
C[C@@H](O)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
Cc1nc(NC(=O)[C@@H](N)CO)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1 |r|
Cc1nc(NC(=O)C2(N)CC2)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
Cc1nc(NC(=O)C(C)(C)N)sc1-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
C[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cncc(NS(=O)(=O)c2ccccc2)c1 |r|
C[C@@H](N)C(=O)Nc1nc(C)c(s1)-c1cncc(NS(=O)(=O)c2ccccc2)c1 |r|
Cc1nc(NC(=O)CN)sc1-c1ccc(Cl)c(NS(=O)(=O)c2ccccc2)c1
Cc1nc(NC(=O)CN)sc1-c1cnc(C)c(NS(=O)(=O)c2ccccc2)c1
Cc1nc(NC(=O)CN)sc1-c1cnc(O)c(NS(=O)(=O)c2ccccc2)c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1sc(NC(=O)CN)nc1C
CCC(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2c(F)cccc2F)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(C)cc2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1 |r|
CC(C)[C@H](N)C(=O)Nc1nc(C)c(s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)nc2n(C)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1
COc1ncc(cc1NS(C)(=O)=O)-c1cc2c(C)nc(N)nc2s1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)nc2[nH]c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(C)nc(N)nc2n(C)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1cc2c(C)nc(N)nc2s1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc2c(C)nc(N)nc2s1
Cc1nc(N)nc2sc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)nc2s1
CCCC(=O)Nc1nc(C)c2cc(sc2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CNc1nc(C)c2cc(sc2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc2c(C)nc(NC(C)=O)nc2s1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)nc2s1
COc1ncc(cc1NS(C)(=O)=O)-c1cc2c(C)nc(NC(C)=O)nc2s1
CCC(=O)Nc1nc(C)c2cc(sc2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1cc2c(C)nc(N)nc2s1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(=O)C3CC3)nc2s1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1cc2c(C)nc(N)nc2s1
Cc1ccccc1-n1c(Cn2cc(nn2)-c2ccccc2)nc2cccc(C)c2c1=O |(24.56,-20.94,;25.89,-20.17,;25.89,-18.63,;27.22,-17.86,;28.56,-18.63,;28.56,-20.17,;27.22,-20.94,;27.22,-22.48,;25.89,-23.25,;24.56,-22.48,;23.22,-23.25,;21.82,-22.62,;20.79,-23.77,;21.56,-25.1,;23.06,-24.78,;19.25,-23.74,;18.45,-25.05,;16.91,-25.02,;16.17,-23.68,;16.96,-22.36,;18.5,-22.39,;25.89,-24.79,;27.22,-25.56,;27.22,-27.1,;28.56,-27.87,;29.89,-27.1,;29.89,-25.56,;31.23,-24.79,;28.56,-24.79,;28.56,-23.25,;29.89,-22.48,)|
COc1ccc(-c2cn(Cc3nc4cccc(C)c4c(=O)n3-c3ccccc3C)nn2)c(C)c1 |(27.62,-21.79,;28.98,-21.07,;30.29,-21.88,;31.65,-21.16,;32.95,-21.98,;32.89,-23.52,;34.2,-24.34,;35.44,-23.43,;36.69,-24.32,;38.15,-23.84,;39.47,-24.63,;39.44,-26.17,;40.76,-26.97,;40.73,-28.51,;42.05,-29.3,;43.4,-28.56,;43.43,-27.02,;44.77,-26.28,;42.11,-26.22,;42.14,-24.69,;43.49,-23.94,;40.82,-23.89,;40.8,-22.35,;42.13,-21.56,;42.11,-20.02,;40.76,-19.27,;39.44,-20.06,;39.46,-21.6,;38.13,-22.38,;36.23,-25.79,;34.69,-25.8,;31.53,-24.24,;31.48,-25.78,;30.23,-23.42,)|
COc1ncc(cc1C#N)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2c1 |r|
COc1ccc(cn1)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C3CC3)c2c1 |r|
COc1ncc(cc1[N+]([O-])=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2c1 |r|
CC(C)Nc1ccc2cnn(c2c1)c3cncc(n3)c4ccc(cc4)C(=O)O
Cc1cccc(C)c1-n1c(Cn2nc(-c3ccc4[nH]ccc4c3)c3c(N)ncnc23)nc2cccc(F)c2c1=O |(68.26,-24.08,;68.25,-22.54,;69.58,-21.77,;69.57,-20.23,;68.23,-19.46,;66.9,-20.24,;65.56,-19.49,;66.92,-21.78,;65.59,-22.55,;65.6,-24.1,;66.93,-24.86,;66.95,-26.4,;67.86,-27.64,;66.96,-28.89,;67.72,-30.24,;66.93,-31.55,;67.68,-32.89,;69.22,-32.91,;70.24,-34.07,;71.67,-33.46,;71.53,-31.92,;70.01,-31.57,;69.25,-30.24,;65.49,-28.43,;64.15,-29.21,;64.15,-30.75,;62.81,-28.43,;62.82,-26.89,;64.15,-26.12,;65.48,-26.88,;64.27,-24.88,;62.93,-24.11,;61.61,-24.88,;60.28,-24.13,;60.27,-22.59,;61.59,-21.81,;61.59,-20.27,;62.93,-22.57,;64.26,-21.79,;64.25,-20.25,)|
COc1ccc(cc1OC)-c1nn(Cc2nc3cccc(F)c3c(=O)n2-c2c(C)cccc2C)c2ncnc(N)c12 |(83.53,-33.5,;81.99,-33.48,;81.23,-32.14,;79.69,-32.13,;78.94,-30.79,;79.73,-29.47,;81.26,-29.48,;82.03,-30.81,;83.57,-30.82,;84.33,-32.16,;78.97,-28.13,;79.87,-26.88,;78.96,-25.64,;78.95,-24.09,;77.61,-23.33,;76.29,-24.11,;74.95,-23.35,;73.63,-24.12,;72.3,-23.37,;72.28,-21.82,;73.61,-21.05,;73.6,-19.51,;74.94,-21.81,;76.27,-21.03,;76.26,-19.49,;77.6,-21.79,;78.93,-21.01,;80.27,-21.78,;80.27,-23.32,;81.6,-21.01,;81.59,-19.46,;80.24,-18.7,;78.92,-19.48,;77.58,-18.72,;77.5,-26.12,;76.16,-25.36,;74.83,-26.13,;74.83,-27.67,;76.16,-28.44,;76.16,-29.98,;77.5,-27.66,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2OCC(=O)N(CCCN3CCOCC3)c2c1
COc1ccc(cc1CO)-c1ccc2c(nc(CS(C)(=O)=O)nc2n1)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C1CCOCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C1=CCOCC1)N1CCOC[C@@H]1C |r,t:23|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(N)=O)N1CCOCC1
COC(Cc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1)OC |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(C)(C)C)N1CCOC[C@@H]1C |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)C(C)(C)C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C#N)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(CN)nc2n1)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(CO)CO)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(CC#N)nc2n1)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(C)C)N1CCOC[C@@H]1C |r|
COc1ncc(cc1NS(=O)(=O)c1cc(F)ccc1F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1cccc(F)c1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1cc(F)cc(F)c1)-c1ccc2nccc(=O)n2c1
Fc1ccccc1S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C)c(=O)n2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(=O)n2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1OC)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(Cl)c(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)cc1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1C)-c1ccc2nccc(=O)n2c1
Oc1ccc(C(=O)Cc2ccc(F)cc2)c(O)c1O
Oc1ccc(C(=O)Cc2ccc(Cl)cc2)c(O)c1
Oc1ccc(C(=O)Cc2ccc(F)c(Cl)c2)c(O)c1O
Oc1ccc2c(occ(-c3ccccc3F)c2=O)c1O
Oc1ccc(-c2n[nH]cc2-c2ccc(Cl)cc2)c(O)c1O
Oc1ccc(-c2n[nH]cc2-c2ccc(Cl)c(Cl)c2)c(O)c1O
Oc1cccc(C(=O)Cc2ccc(Cl)cc2)c1O
COc1ccc(cc1OC)-c1coc2c(O)c(O)ccc2c1=O
Oc1ccc(-c2n[nH]cc2-c2ccccc2Cl)c(O)c1O
Oc1ccc(C(=O)Cc2ccccc2Cl)c(O)c1O
Oc1ccc(C(=O)Cc2ccccc2F)c(O)c1O
Oc1ccc(C(=O)Cc2ccc(cc2)C(F)(F)F)c(O)c1O
Oc1ccc(C(=O)Cc2cccc(Cl)c2)c(O)c1O
Oc1ccc(C(=O)Cc2ccc(Cl)cc2)c(O)c1O
Oc1cc(O)c(C(=O)Cc2ccc(Cl)cc2)c(O)c1
COc1ccc(CC(=O)c2ccc(O)c(O)c2O)cc1OC
Oc1ccc2c(occ(-c3ccc(cc3)C(F)(F)F)c2=O)c1O
Oc1ccc(C(=O)Cc2ccc(Cl)c(Cl)c2)c(O)c1O
Oc1ccc(C(=O)Cc2cccnc2)c(O)c1O
Oc1ccc(-c2n[nH]cc2-c2ccccc2F)c(O)c1O
Oc1ccc2c(occ(-c3ccccc3Cl)c2=O)c1O
Oc1ccc(C(=O)Cc2ccncc2)c(O)c1O
Oc1ccc2c(occ(-c3ccc(Cl)cc3)c2=O)c1O
Oc1ccc2c(occ(-c3ccc(F)cc3)c2=O)c1O
Oc1ccc2c(occ(-c3ccc(Cl)c(Cl)c3)c2=O)c1O
Oc1ccc2c(occ(-c3ccc(F)c(Cl)c3)c2=O)c1O
Oc1ccc(-c2n[nH]cc2-c2cccc(Cl)c2)c(O)c1O
Oc1ccc(-c2n[nH]cc2-c2ccc(F)cc2)c(O)c1O
COc1ccc(cc1OC)-c1c[nH]nc1-c1ccc(O)c(O)c1O
Oc1ccc(-c2n[nH]cc2-c2ccc(cc2)C(F)(F)F)c(O)c1O
Oc1ccc(-c2n[nH]cc2-c2ccc(F)c(Cl)c2)c(O)c1O
Oc1ccc2c(occ(-c3cccc(Cl)c3)c2=O)c1O
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1cc(nc(n1)-n1c(N)nc2ccccc12)C1(CC1)S(C)(=O)=O |r|
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-n1c(N)nc2ccccc12)N1CCOCC1
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)[S@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cncc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CO\C=C\C(=O)c1cc2C=Nc3c(N)cc(NC(=O)C(C)C)c(n1)c23 |c:9|
C[C@H]1COC[C@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@@H]1C |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2
[H][C@@]12CN(c3nc(nc(n3)-c3cnc(N)cc3C(F)F)N3C[C@@]4([H])C[C@]3([H])CO4)[C@@]([H])(CO1)C2 |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CC1COC2)N1C2CC1COC2
CC[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1CC |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1C[C@H](C)O[C@H](C)C1 |r|
CC1(C)CN(CCO1)c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC(C)(C)C1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCCC1COC2)N1C2CCCC1COC2 |THB:14:16:22.23.24:18.19.20|
Nc1cc(c(cn1)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2)C(F)(F)F
Nc1cc(C(F)F)c(cn1)-c1cc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
Nc1cc(c(cn1)-c1nc(cc(n1)N1C2CCC1COC2)N1C2CCC1COC2)C(F)(F)F
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
CCC(CC)n1cnc2c(nc(nc12)N1CC2CCC(C1)O2)-c1cnc(N)cn1
[H][C@]12CN(c3nc(nc(n3)-c3cnc(N)cc3C(F)F)N3C[C@]4([H])C[C@@]3([H])CO4)[C@]([H])(CO1)C2 |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC11CCC1)N1CCOCC11CCC1
Nc1cc(C(F)F)c(cn1)-c1nc(cc(n1)N1C2CCC1COC2)N1C2CCC1COC2
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(CO)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COC(OC)c1cc(N)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
C[C@@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@H](C)COC[C@H]1C |r|
Nc1cc(C(F)F)c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
COc1cc(N)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CCOCC1
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@H]1C |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2COCC1COC2)N1C2COCC1COC2 |THB:14:16:22.23.24:18.19.20|
Nc1cc(C(F)F)c(cn1)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
Nc1cc(CF)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CCCCOCc1ncnc2sc3CCN(Cc3c12)C(=O)c1cc(C(C)C)c(O)cc1O
Cc1nn2c(NC(N)=O)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
COc1cc(nc2c(Cc3cccc(c3C)C(F)(F)F)cnn12)N1CCOCC1
Cc1nn2c(O)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nn2c(N)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1c(Cc2cnn3c(O)cc(nc23)N2CCOCC2)cccc1C(F)(F)F
Oc1cc(nc2c(Cc3cccc(Cl)c3Cl)c(nn12)C(F)(F)F)-c1ccncc1
CC(=O)Nc1cc(nc2c(Cc3cccc(c3C)C(F)(F)F)c(C)nn12)N1CCOCC1
Cc1nn2c(NO)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)C1CCOCC1
Cc1nn2c(cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
Cc1nn2ccc(nc2c1Cc1cccc(c1C)C(F)(F)F)C1CCOCC1
Cc1c(Cc2cnn3c(Cl)cc(nc23)N2CCOCC2)cccc1C(F)(F)F
COc1nn2c(O)cc(nc2c1Cc1cccc(Cl)c1Cl)-c1ccncc1
Cc1c(Cc2cnn3c(O)cc(nc23)-c2ccncc2)cccc1C(F)(F)F
CC1CN(CCO1)c1cc(O)n2nc(C)c(Cc3cccc(c3C)C(F)(F)F)c2n1
Cc1nn2c(O)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1=O
Cc1nn2c(O)cc(nc2c1Cc1cccc2ccccc12)N1CCOCC1
Oc1cc(nc2c(Cc3cccc(Cl)c3Cl)c(nn12)C(F)(F)F)N1CCOCC1
Cc1nn2c(cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(N)=O
CCc1nn2c(O)cc(nc2c1Cc1cccc(Cl)c1Cl)C1CCOCC1
CCc1nn2c(O)cc(nc2c1Cc1cccc(Cl)c1Cl)-c1ccncc1
Cc1nn2c(cc(nc2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C#N
Nc1nn2c(O)cc(nc2c1Cc1cccc(Cl)c1Cl)C1CCOCC1
Oc1cc(nc2c(Cc3cccc(Cl)c3Cl)c(nn12)C(F)(F)F)C1CCOCC1
Cc1nn2c(O)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)C1CCOCC1
CNc1cc(nc2c(Cc3cccc(c3C)C(F)(F)F)c(C)nn12)N1CCOCC1
Cc1nn2c(NCCO)cc(nc2c1Cc1cccc(c1C)C(F)(F)F)C1CCOCC1
Cc1c(Cc2c3[nH]c(cc(=O)n3[nH]c2=O)C2CCOCC2)cccc1C(F)(F)F
Oc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2cccnc2n1
CC(=O)Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ncccc2n1
C1CN(CCO1)c1nc(nc2cccnc12)-c1cccnc1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncccc2n1
Oc1cccc(c1)-c1nc(nc2cccnc12)N1CCOCC1
OCc1ccc(NC(=O)Nc2cccc(c2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
Oc1cccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)c1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cccnc2n1
CC(=O)N(C(C)=O)c1ncc(cn1)-c1nc(N2CCOCC2)c2ncccc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ncccc2n1
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2ncccc2n1
C1CN(CCO1)c1nc(nc2cccnc12)-c1cccc2[nH]ncc12
Nc1cccc(c1)-c1nc(N2CCOCC2)c2ncccc2n1
COc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
Oc1ccccc1-c1nc(N2CCOCC2)c2ncccc2n1
Oc1cccc(c1)-c1nc(N2CCC(F)(F)CC2)c2ncccc2n1
Oc1cccc(c1)-c1nc(N2CCS(=O)(=O)CC2)c2ncccc2n1
OCc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1)Nc1cccnc1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
CN1CCN(CC1)c1nc(nc2cccnc12)-c1cccc(O)c1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncccc2n1
C[C@H]1CN(C[C@@H](C)O1)c1nc(nc2cccnc12)-c1cccc(O)c1 |r|
Oc1cccc(c1)-c1nc(N2CCSCC2)c2ncccc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccnc2n1
C1CN(CCO1)c1nc(nc2cccnc12)-c1ccc2cn[nH]c2c1
Oc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
OCc1cccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)c1
COc1cccc(c1)-c1nc(N2CCOCC2)c2ncccc2n1
Cc1nc(NC(=O)N2C[C@H](O)C[C@H]2C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CC[C@@H](O)[C@H]2C(N)=O)sc1-c1csc(n1)C1(CC1)C(F)(F)F |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)-c1cccnc1 |r|
CC(C)c1nc(cs1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2C[C@@H](O)C[C@H]2C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)C1(CC1)C(F)(F)F |r|
C[C@@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc(C)c(s1)-c1csc(n1)C1(CC1)C(F)(F)F |r|
C[C@H]1CCN([C@@H]1C(N)=O)C(=O)Nc1nc(C)c(s1)-c1csc(n1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
CN(C)Cc1nc(cs1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)C1(C)CC1 |r|
CCC(CC)c1nc(cs1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(CC2CC2)n1 |r|
CN(C)[C@H]1C[C@H](N(C1)C(=O)Nc1nc(C)c(s1)-c1csc(n1)C(C)(C)C)C(N)=O |r|
CN(C)[C@@H]1C[C@H](N(C1)C(=O)Nc1nc(C)c(s1)-c1csc(n1)C1(C)CC1)C(N)=O |r|
CN(C)[C@@H]1C[C@H](N(C1)C(=O)Nc1nc(C)c(s1)-c1csc(n1)C(C)(C)C)C(N)=O |r|
Cc1nc(NC(=O)N2C[C@H](F)C[C@H]2C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
Cc1nc(NC(=O)N2CCC[C@@]2(C)C(N)=O)sc1-c1csc(n1)C1(CC1)C(F)(F)F |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)-c1ccccc1F |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)C1CCC1 |r|
[H][C@@]12C[C@@]1(N(CC2)C(=O)Nc1nc(C)c(s1)-c1csc(n1)C(C)(C)C)C(N)=O |r|
CN(C)c1nc(cs1)-c1sc(NC(=O)N2CCC[C@H]2C(N)=O)nc1C |r|
Cc1nc(NC(=O)N2CC[C@H](O)[C@H]2C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
CC(C)c1nc(cs1)-c1sc(NC(C)=O)nc1C
CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F
Nc1ncc(cn1)-c1nc(nc2N(CCc12)c1ccc(CN2CCOCC2)cc1F)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc2N(CCc12)c1ccc(cc1F)C(=O)N1CCOCC1)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc2N(CCc12)c1ccccc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1cccc(c1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc2N(CCc12)c1ccc(CN2CCOCC2)cc1)N1CCOCC1
CN1CCN(Cc2ccc(cc2)N2CCc3c2nc(nc3-c2cnc(N)nc2)N2CCOCC2)CC1
CN1CCN(CC1)C(=O)c1cc(ccn1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1ccc(cc1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1cncc(c1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1ccc(cn1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
CN(C)C(=O)c1cc(CN2CCOc3c(F)cc(F)cc23)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H]1CN(CCO1)c1cc(=O)c2cc(cc(CN3CCOc4c(F)cc(F)cc34)c2o1)C(=O)N(C)C |r|
CN(C)C(=O)c1cc(CN2CCOc3ccc(F)cc23)c2oc(cc(=O)c2c1)N1CCOCC1
CN(C)C(=O)c1cc(CN2CCOc3c(F)cccc23)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H]1CN(CCO1)c1cc(=O)c2cc(cc(CN3CCOc4c(F)cccc34)c2o1)C(=O)N(C)C |r|
C[C@@H]1CN(CCO1)c1cc(=O)c2cc(cc(CN3CCOc4ccc(F)cc34)c2o1)C(=O)N(C)C |r|
C[C@@H]1CN(CCO1)c1cc(=O)c2cc(cc(CN(C)c3cc(F)cc(F)c3)c2o1)C(=O)N(C)C |r|
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1ccc2ncnc(NCCN3CCOCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NC3CCN(CC3)C(=O)OC(C)(C)C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NCCN3CCOCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N(C)CCN(C)C)c2c1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1ccc2ncnc(NCCN3CCCCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2nccc(NCCN3CCOCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(C)=O)c2c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C(C)(C)C)c2c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C3CC3)c2c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCOCC3)c2c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NC3CCN(CC3)C(C)=O)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NC3CCN(CC3)C(=O)C3CCOCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NC3CCNCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NCCN(C)C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)OC(C)(C)C)c2c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(N[C@H]3CCN(C3)C(=O)C3CCCC3)c2c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NC3CCN(CC3)C(=O)C3CCCC3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncnc(NCCN3CCCCC3)c2c1
c1ccc(cc1)[C@H](CN2[C@@H](CCN3C2=NC(=CC3=O)N4CCOCC4)C(F)(F)F)O
c1c(cc(cc1F)F)N2[C@@H](CCN3C2=NC(=CC3=O)N4CCOCC4)C(F)(F)F
O[C@H](CN1[C@@H](CCn2c1nc(cc2=O)N1CCOCC1)C(F)(F)F)c1ccccc1 |r|
CC(C)OCCN1[C@@H](CCN2C1=NC(=CC2=O)N3CCOCC3)C(F)(F)F
C1CC1Nc1nc(Nc2ccc3ncccc3c2)nc2[nH]cnc12
C[C@@H]1COCCN1C2=CC(=O)N3CC[C@H](N(C3=N2)CC(=O)C(C)C)C(F)(F)F
COc1ncc(cc1F)-c1cc(OCCNc2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OCCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCCNc2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCNc2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCN(C(C)C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
CCN(CCOc1cc(cc2c(C)ncnc12)-c1cnc(OC)c(F)c1)c1ncc(cn1)C(=O)NO
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCC(=O)NO)c2ncnc(C)c2c1
CCN(CCOc1cc(cc2c(C)ncnc12)-c1ccc(OC)nc1)c1ncc(cn1)C(=O)NO
COc1ccc(cn1)-c1cc(OCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCN(C(C)C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1nc(N2CCOCC2)c2sc(CN(C)c3ncc(cn3)C(=O)NO)cc2n1
COc1ncc(cc1F)-c1cc(OCCCCCCCC(=O)NO)c2ncnc(C)c2c1
CCNC(=O)Nc1ccc(cc1)-c1nccc(n1)C12CC1COCC2
[H][C@@]12C[C@@]1(CCOC2)c1cc(nc(n1)-c1ccc(NC(=O)NCC)cc1)C(C)(C)S(C)(=O)=O |r|
C[C@H]1COCCN1c1ccnc(n1)-c1cccc(O)c1 |r|
Oc1cccc(c1)-c1nccc(n1)C1=CCOCC1 |t:15|
Oc1cccc(c1)-c1nccc(n1)C12CC1COCC2
[H][C@]12C[C@]1(CCOC2)c1ccnc(n1)-c1cccc(O)c1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nccc(n1)N1CCOCC1
[H][C@@]12C[C@@]1(CCOC2)c1ccnc(n1)-c1ccc(NC(=O)NCC)cc1 |r|
[H][C@]12C[C@]1(CCOC2)c1ccnc(n1)-c1ccc(NC(=O)NCC)cc1 |r|
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc(O)c1)C1=CCOCC1 |t:20|
[H][C@@]12C[C@@]1(CCOC2)c1cc(nc(n1)-c1cccc(O)c1)C(C)(C)S(C)(=O)=O |r|
[H][C@]12C[C@]1(CCOC2)c1cc(nc(n1)-c1cccc(O)c1)C(C)(C)S(C)(=O)=O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOC[C@@H]1C |r|
[H][C@]12C[C@]1(CCOC2)c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)NCC)cc1 |r|
[H][C@@]12C[C@@]1(CCOC2)c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)CNC)cc1 |r|
CNCC(=O)Nc1ccc(cc1)-c1nc(cc(n1)C(C)(C)S(C)(=O)=O)N1CCOC[C@@H]1C |r|
[H][C@]12C[C@]1(CCOC2)c1cc(nc(n1)-c1ccc(NC(=O)CNC)cc1)C(C)(C)S(C)(=O)=O |r|
[H][C@]12C[C@]1(CCOC2)c1cc(nc(n1)-c1ccc(NC(=S)NCCO)cc1)C(C)(C)S(C)(=O)=O |r|
Oc1cccc(c1)-c1nccc(n1)N1CCOCC1
[H][C@@]12C[C@@]1(CCOC2)c1ccnc(n1)-c1cccc(O)c1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nccc(n1)C1=CCOCC1 |t:20|
C[C@H]1COCCN1c1cc(nc(n1)-c1cccc(O)c1)C(C)(C)S(C)(=O)=O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(cc(n1)C(C)(C)S(C)(=O)=O)N1CCOC[C@@H]1C |r|
[H][C@]12C[C@]1(CCOC2)c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)CNC)cc1 |r|
CNCC(=O)Nc1ccc(cc1)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1cccc(O)c1 |r|
C[C@H]1COCCN1c1cc(nc(n1)-c1ccc(NC(=S)NCCO)cc1)C(C)(C)S(C)(=O)=O |r|
[H][C@]12C[C@]1(CCOC2)c1cc(nc(n1)-c1ccc(NC(=O)NCC)cc1)C(C)(C)S(C)(=O)=O |r|
[H][C@@]12C[C@@]1(CCOC2)c1cc(CS(C)(=O)=O)nc(n1)-c1cccc(O)c1 |r|
Oc1cccc(c1)-c1nccc(n1)C1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nccc(n1)N1CCOC[C@@H]1C |r|
[H][C@]12C[C@]1(CCOC2)c1cc(CS(C)(=O)=O)nc(n1)-c1cccc(O)c1 |r|
[H][C@@]12C[C@@]1(CCOC2)c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)NCC)cc1 |r|
[H][C@@]12C[C@@]1(CCOC2)c1cc(nc(n1)-c1ccc(NC(=O)CNC)cc1)C(C)(C)S(C)(=O)=O |r|
[H][C@@]12C[C@@]1(CCOC2)c1cc(nc(n1)-c1ccc(NC(=S)NCCO)cc1)C(C)(C)S(C)(=O)=O |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cn3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3ccc(N)nc3)N1CCOC2 |r|
COCCS(=O)(=O)Nc1cc(cnc1OC)-c1cc2COCc2c(OC[C@H]2CN(CCO2)C2COC2)c1 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(OCCN2CCC(CC2)C(C)(C)O)c1
C[C@H](Nc1ncnc2nc[nH]c12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
COc1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
Cc1ccc(C)c(c1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
O=c1oc2ccccc2c2nn(cc12)S(=O)(=O)c1ccccc1
CC(C)(C)c1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
Fc1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
[O-][N+](=O)c1ccccc1S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
[O-][N+](=O)c1cccc(c1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
Cc1cc(C)c(c(C)c1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
Cc1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
Brc1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
FC(F)(F)c1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
Clc1ccc(cc1)S(=O)(=O)n1cc2c(n1)c1ccccc1oc2=O
C[C@@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1[C@H](C)COC[C@H]1C |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOC[C@H]1C |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOC[C@@H]1C |r|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1[C@@H](C)COC[C@H]1C |r|
C[C@H]1COC[C@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1[C@@H](C)COC[C@@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)C(F)(F)F
Nc1cc(c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CCOCC1)C(F)(F)F
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(cc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)cc1C(F)F |r|
C[C@H]1COCCN1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)F |r|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2)C(F)(F)F
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
C[C@@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(cc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
C[C@H]1COC[C@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2)C(F)(F)F
[O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
CC(C)(C)c1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Fc1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Clc1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1ccccc1S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Brc1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
FC(F)(F)c1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
CNC(=O)Nc1ccc(cc1)-c1ncc2OCC3COCCN3c2n1
CNC(=O)Nc1ccc(cc1)-c1ncc2N(CC3CC3)C(=O)[C@]3(C)COCCN3c2n1 |r|
CC(F)(F)CN1C(=O)[C@]2(C)COCCN2c2nc(ncc12)-c1ccc(NC(=O)NC2CC2)cc1 |r|
CNC(=O)Nc1ccc(cc1)-c1ncc2NC(=O)C3COCCN3c2n1
C[C@@]12COCCN1c1nc(ncc1N(CC1CC1)C2=O)-c1ccc(NC(=O)NC2CC2)cc1 |r|
CNC(=O)Nc1ccc(cc1)-c1ncc2NC(=O)CC3COCCN3c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(C)c2nc3COCCn3c2n1
CNC(=O)Nc1ccc(cc1)-c1ncc2N(CC3CC3)C(=O)C3COCCN3c2n1
COc1ncc(cc1C)N1CCc2ncnc(c2C1)-c1ccc(NCC2CCOCC2)nc1
COc1ncc(cc1C)N1CCc2ncnc(c2C1)-c1ccnc(NCC2CCOCC2)c1
COc1ncc(cc1C)N1CCc2ncnc(-c3ccnc(NC4CCOCC4)c3)c2C1
COCC(=O)N1CCC(CC1)Nc1cc(ccn1)-c1ncnc2CCN(Cc12)c1cnc(OC)c(C)c1
COc1ncc(cc1C)N1CCc2ncnc(-c3ccnc(NC4CCN(C)CC4)c3)c2C1
COc1ncc(cc1C)N1CCc2ncnc(-c3ccnc(NC4CCNCC4)c3)c2C1
COc1ncc(cc1C)N1CCc2ncnc(-c3ccnc(NC4CCN(CC4)S(C)(=O)=O)c3)c2C1
COc1ncc(cc1C)N1CCc2ncnc(-c3cnn(c3)C3CCOCC3)c2C1
COc1ncc(cc1C)N1CCc2ncnc(-c3cnn(CC4CCOCC4)c3)c2C1
COc1ncc(cc1C)N1CCc2ncnc(-c3ccnc(N[C@H]4CC[C@H](O)CC4)c3)c2C1 |r,wU:23.23,wD:26.27,(26.67,-18.3,;26.68,-19.84,;28.01,-20.6,;29.35,-19.83,;30.68,-20.6,;30.68,-22.14,;29.36,-22.91,;28.02,-22.15,;26.7,-22.93,;32.02,-22.9,;32.02,-24.44,;33.35,-25.2,;34.67,-24.44,;36,-25.2,;37.33,-24.44,;37.33,-22.89,;36,-22.13,;35.99,-20.59,;34.65,-19.83,;34.64,-18.3,;35.97,-17.51,;37.31,-18.27,;38.64,-17.5,;39.98,-18.26,;41.3,-17.48,;42.64,-18.25,;42.64,-19.79,;43.98,-20.56,;41.31,-20.56,;39.98,-19.8,;37.32,-19.82,;34.67,-22.9,;33.35,-22.12,)|
CCN1CCC(CC1)Nc1cc(ccn1)-c1ncnc2CCN(Cc12)c1cnc(OC)c(C)c1
Clc1ccc(cc1Cl)C(=O)Nc1ccc2cc(ccc2c1)C(=O)Nc1nccs1
CCn1c2nc(N)nc(C)c2cc(-c2cc[nH]n2)c1=O
COc1ccc(Cl)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NC(=O)C(C)(C)N)c2)c1
Nc1ccc(cc1)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Nc1cc(ccc1F)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1nc(nc(n1)-c1cccc2[nH]ncc12)N1CCOCC1
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1nc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
Nc1cc(c(cn1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(F)(F)F
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCc2c(C1)nc(nc2N1CCOCC1)-c1cccc2[nH]ncc12
Nc1ncc(cn1)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1)C(F)(F)F
Nc1ccc(cn1)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2[nH]ccc2c1)N1CCOCC1
Nc1ncc(cc1C(F)(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Nc1ccc(cc1F)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Nc1ccc(cn1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F
Nc1ccc(c(F)c1)-c1nc(nc(n1)N1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCOCC1
Nc1ncc(cn1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCc2c(C1)nc(nc2N1CCOCC1)-c1cccc2[nH]ccc12
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2cn[nH]c2c1)N1CCOCC1
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ccncc2c1
Cc1nc(cn1Cc2ccccc2)S(=O)(=O)Nc3cc(cnc3OC)C4=CCOCC4
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccccc1
CS(=O)(=O)Nc1cc(cnc1Cl)-c1cnc(N)nc1
c1cc2c(cccc2[nH]1)-c1ccc2ccncc2c1
c1cc2c(cccc2[nH]1)-c1ccncc1
C(N1CCOCC1)c1nnc(o1)-c1cccc2[nH]ncc12
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2cn[nH]c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(-c2ncc(CN3C[C@H](C)O[C@H](C)C3)o2)c2cn[nH]c2c1 |r|
CC(C)N1CCN(CC1)Cc2cnc(o2)c3cc(cc4c3cn[nH]4)c5cccc6c5cc[nH]6
CS(=O)(=O)Nc1cc(cnc1Cl)C2=CCOCC2
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccncc1
c1cc2c(cccc2[nH]1)-c1ccc2cn[nH]c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)C1=CCOCC1 |t:19|
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2cn[nH]c2c1
COc1c(cc(cn1)C2=CCOCC2)NS(=O)(=O)c3ccccc3
Fc1ccc(cc1)C1=NN([C@H](C1)c1ccc(Cl)c(Cl)c1)c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOCC1 |r,t:8|
COc1ccc(cc1)-c1cc(ncn1)C(=O)Nc1ccc(cc1)-c1cn2ccnc2c(n1)N1CCOCC1
Cc1nc(cs1)C(=O)Nc1cc(cc2[nH]ncc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
COc1ncc(cc1C#N)-c1ccc2ncnc(N[C@H]3CCCN(C3)C(=O)C(C)N)c2c1 |r|
COc1ncc(cc1C#N)-c1ccc2ncnc(N[C@H]3CCCN(C3)C(=O)CN(C)C)c2c1 |r|
COc1ncc(cc1C#N)-c1ccc2ncnc(N[C@H]3CCCN(C3)C(=O)c3coc(c3)[N+]([O-])=O)c2c1 |r|
COc1ncc(cc1C#N)-c1ccc2ncnc(N[C@H]3CCCN(C3)C(=O)c3cccnc3)c2c1 |r|
Cc1cc2ncnn2cc1Nc3ncc4c(n3)N(C(=O)N4C)C5CCOCC5
C[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(CNc3ncc(cn3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(C)c1C#N)c1nc2cccc(NCCCCC(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(CNc3ncc(cn3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(CCCCCC(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(NCc3ccc(C(=O)NO)c(C)c3)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(NCc3ccc(cn3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(C)c1C#N)c1nc2cccc(CCCCCC(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(NCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc(N)c1C#N)c1nc2cccc(NCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(NCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(C)c1C#N)c1nc2cccc(NCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(CNC(=O)c3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(NCc3ccc(cc3)C(=O)N(C)O)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(C)c1C#N)c1nc2cccc(NCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(CCCCCC(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(CNC(=O)c3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CC[C@H](Nc1nc(N)nc(N)c1C#N)c1nc2cccc(CCc3ccc(cc3)C(=O)NO)c2c(=O)n1-c1ccccc1 |r|
CCOc1c(cc(Cl)c(F)c1[C@@H]1CNC(=O)C1)[C@H](C)n1nc(C)c2c(N)ncnc12 |r|
CCc1nc(N)nc2n(nc(-c3ccc4oc(N)nc4c3)c12)C(C)C
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc[nH]c2=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc(C)[nH]c2=O
CNc1nc2n(nc(-c3ccc4oc(N)nc4c3)c2c(=O)[nH]1)C(C)C
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc(N)[nH]c2=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2cnc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(nc(N)nc12)C(F)(F)F
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(Br)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(Cl)nc(N)nc12
COc1nc(N)nc2n(nc(-c3ccc4oc(N)nc4c3)c12)C(C)C
CCCCn1nc(-c2ccc3oc(N)nc3c2)c2c(C)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(F)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(CO)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc([nH]c2=O)N(C)C
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(nc(N)nc12)C#N
CCCCn1nc(-c2ccc3oc(N)nc3c2)c2c(Cl)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(C)nc(N)nc12
CN([C@@H]1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1)C(C)=O |r|
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1)C(C)=O
CC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
COCC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
COCC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1)C(C)=O
CN(C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1)C(C)=O
CC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
COCC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CNC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CS(=O)(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
COCC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CNC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CNC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CNC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CNC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CS(=O)(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CS(=O)(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1)S(C)(=O)=O
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1)C(C)=O
COCC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
CN(C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1)C(C)=O
CN(C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1)C(C)=O
CNC(=O)N(C)C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CN(C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1)S(C)(=O)=O
CC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1)S(C)(=O)=O
COCC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
CC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CNC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
CS(=O)(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
COCC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
COCC(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1)C(C)=O
COCC(=O)N(C)C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CN(C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1)S(C)(=O)=O
CS(=O)(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
COCC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CN([C@H]1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1)C(C)=O |r|
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1)S(C)(=O)=O
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1)S(C)(=O)=O
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1)S(C)(=O)=O
COCC(=O)N(C)C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CC(=O)N[C@@H]1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1 |r|
COCC(=O)N(C)C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CNC(=O)N(C)C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CN(C1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1)S(C)(=O)=O
COCC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
COCC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
CNC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1
CS(=O)(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)C1
CC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
CNC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
CS(=O)(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1)C(C)=O
CNC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CS(=O)(=O)NC1CCCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1)C(C)=O
COCC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
CN(C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1)S(C)(=O)=O
CC(=O)N[C@H]1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)C1 |r|
COCC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ccc23)CC1
CS(=O)(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
COCC(=O)N(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CNC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)C1
COCC(=O)NC1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
C=CC(=O)Nc1cccc(c1)-n1c2c(ccc1=O)oc1ccc(cc21)-c1cccnc1
C=CC(=O)Nc1ccc(cc1)-n1c2c(ccc1=O)oc1ccc(cc21)-c1cccnc1
COc1ccc(cn1)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1
CN1CCN(CC1)C(=O)c1cccc(c1)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
c1ccc2ncc(cc2c1)-c1ccc2ncncc2c1
c1ccc(cc1)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
COc1ccc(cc1OC)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
COc1ncc(cc1C#N)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1
COc1ncc(cc1C(F)(F)F)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1
COc1ccc(cn1)-c1ccc2ncnc(-c3cncc(c3)C(=O)N3CCN(C)CC3)c2c1
COc1ccc(cn1)-c1ccc2ncnc(N3CCC[C@@H](C3)C(=O)N3CCN(C)CC3)c2c1 |r|
CC(=O)N1CCN(CC1)C(=O)c1cccc(c1)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
COc1ccc(cc1OC)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(C)CC3)c2c1
COc1ncc(cc1C(F)(F)F)-c1ccc2ncnc(-c3cccc(c3)C(=O)N3CCN(CC3)C(C)=O)c2c1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)[C@H]1CCCN1)N1CCOCC1 |r|
C[C@H](NC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1)C(N)=O |r|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC(=O)[C@H]2CCCN2)CC1)N1CCOCC1 |r|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)C[C@@H]1CCCN1)N1CCOCC1 |r|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)[C@H]1CCCCN1)N1CCOCC1 |r|
N[C@H]1CC[C@H](CC1)C(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r,wU:4.7,1.0,(60.69,-22.06,;59.35,-22.83,;59.34,-24.37,;58.01,-25.13,;56.68,-24.35,;56.68,-22.81,;58.02,-22.05,;55.35,-25.12,;55.34,-26.66,;54.02,-24.34,;52.68,-25.11,;51.35,-24.34,;51.36,-22.8,;52.68,-22.02,;54.02,-22.8,;50.02,-22.03,;50.02,-20.48,;48.68,-19.72,;47.35,-20.49,;47.35,-22.03,;48.68,-22.8,;46.02,-22.8,;44.61,-22.18,;43.58,-23.32,;44.34,-24.65,;43.87,-26.11,;44.89,-27.26,;46.4,-26.93,;46.87,-25.47,;45.85,-24.34,;44.29,-20.67,;45.43,-19.64,;42.82,-20.2,;48.68,-18.18,;50,-17.41,;50,-15.88,;48.67,-15.1,;47.34,-15.87,;47.33,-17.42,)|
OC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
OC(=O)[C@@H]1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
NC(=O)[C@H](CO)NC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
CC(C)[C@H](NC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1)C(N)=O |r|
NC(=O)CNC(=O)[C@H]1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)[C@@H]1CCCCN1)N1CCOCC1 |r|
OC(=O)[C@H]1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
C[C@@H](NC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1)C(N)=O |r|
NC(=O)CNC(=O)[C@@H]1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1 |r|
NC(=O)CNC(=O)C1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
CC[C@@H](Nc1ncnc2nc[nH]c12)c1nc2cccc(F)c2c(=O)n1-c1ccccc1 |r|
COCc1ccc(cn1)-c1cc2c(N[C@@H](C)c3ccn(C)n3)c(cnc2cc1F)C(N)=O |r|
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)c1ccc(Cl)cc1 |r|
c1ccc2c(c1)Sc3cccc(c3S2)C4=CC(=O)C=C(O4)N5CCOCC5
O=c1cc(oc(c1)-c1cccc2Cc3ccccc3Sc12)N1CCOCC1
CCC(CC)CNc1c(cnc2ccc(cc12)C#N)C(N)=O
C[C@@H](Nc1c(cnc2ccc(cc12)C#N)C(N)=O)c1ccc(Cl)cc1 |r|
COCc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(N[C@@H](C)C3CCOCC3)c2c1 |r|
COc1cc2ncnc(-n3nc(nc3N)-c3ccccn3)c2cc1OC
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2COCc2c1
COc1ncc(cc1C#N)-c1ccc2ncnc(NCCN3CCOCC3)c2c1
COc1ncc(cc1[N+]([O-])=O)-c1ccc2ncnc(NCCN3CCCCC3)c2c1
COc1ncc(cc1C#N)-c1ccc2ncnc(NCCN(C)C)c2c1
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
CCOC(Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12)OCC
Nc1nc2cc(ccc2o1)-c1nn(CC2CCCC2)c2ncnc(N)c12
COc1ccc(cn1)-c1cc(N2CCOCC2)c2sc(CN(C)c3ncc(cn3)C(=O)NO)cc2c1
CN(C)Cc1ccc2c(c1)N(CCO2)c3cc(c(nc3)OC)NS(=O)(=O)C
CN1CCS(=O)(=O)Nc2cc(cnc2OC)N3CCOc4c3cc(cc4)C1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncc(NC(=O)N3CCC[C@H]3C(N)=O)c(=O)n2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(CCCC(N)=O)c(=O)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(N)=O)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(CC(F)(F)C(N)=O)c(=O)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(CCC(N)=O)c(=O)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(CC3(CC3)C(N)=O)c(=O)c2c1
CCNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NCC(F)(F)F)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC(C)C)c(=O)c2c1 |r|
CCC(CC)NC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NCCF)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NCCO)c(=O)c2c1 |r|
COCCNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NCC(C)C)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC3COC3)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC3CCC3)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC3CC3)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC3CC3(F)F)c(=O)c2c1 |r|
CCN(CC)C(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)N(C)C(C)C)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)N3CCOCC3)c(=O)c2c1 |r|
CCOc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC)c(=O)c2c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(C)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CCc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(C[C@@H](C)C(=O)NC)c(=O)c2c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(CO)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(COC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(N)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(N(C)C)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2c(C)noc2C)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2sccc2C)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2sc(C)nc2C)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2cccc(Cl)c2Cl)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 |r|
CNC(=O)[C@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CNC(=O)[C@@H](C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 |r|
CNC(=O)C(C)Cn1cnc2ccc(cc2c1=O)-c1cnc(OC(F)(F)F)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1
CNC(=O)C(C)Cn1cnc2ccc(cc2c1=O)-c1cnc(c(NS(=O)(=O)c2ccc(F)cc2Cl)c1)C(F)(F)F
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(CC(N)C(N)=O)c(=O)c2c1
CCC(Cn1cnc2ccc(cc2c1=O)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1)C(N)=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1Cl)-c1ccc2ncn(CC(C(C)C)C(N)=O)c(=O)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncnc(Nc3cnn(CCO)c3)c2c1
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)F
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
[H][C@]12CC[C@]([H])(COC1)N2c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
[H][C@]12CC[C@]([H])(CN(C1)c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1)O2 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCOC[C@@H]1C |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCOC[C@H]1C |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1C[C@H](C)O[C@H](C)C1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CC(C)OC(C)C1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCSCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCCCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCCC1
COC1CCN(CC1)c1ncnc2sc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COC1CN(C1)c1ncnc2sc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CC2CCCC2C1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CC2COCC2C1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCN(C)CC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)N1CCN(C)C(=O)C1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CCOC[C@@H]1C |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CCOC[C@H]1C |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CC(C)OC(C)C1
COC1CCN(CC1)c1ncnc2sc(nc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CCCCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CCCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1nc2c(ncnc2s1)N1CC2CCCC2C1
Cc1nc(NC(=O)NCCc2cn(CC(F)F)cn2)sc1C#Cc1cccnc1
CNC(=O)c1ccc(cc1)-c1cnc2cnc(cn12)C(=O)N(C)c1ccc(Cl)cc1
CNC(=O)c1cncc(c1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
C\C(=N/Nc1nc(cs1)-c1ccccc1)c1cc2ccccc2o1
CCOC(=O)Cc1csc(N\N=C(/C)c2cc3ccccc3o2)n1
C\C(=N/Nc1nc(C)cs1)c1cc2ccccc2o1
O=S(=O)(N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1)c1ccccc1
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Cc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Cc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
COc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
COc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Oc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Oc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
[O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
[O-][N+](=O)c1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Clc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Clc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Fc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
COc1ncc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccn(CCCCCCC(=O)NO)c2n1
CC(C)n1cnc2c(nc(nc12)N1CCOCC1)-c1cnc(N)nc1
CC(C)n1cnc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Cc1ccc(Nc2ncnc3ccc(cc23)-c2cnc3ccccc3c2)cc1NC(=O)C=C
CNS(=O)(=O)N1CC[C@@H](C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
CC(C)(C)OC(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
CC(=O)N1CC[C@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
CNC(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
COC(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
C[C@@]1(CCN(C1)S(C)(=O)=O)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
CNS(=O)(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
CC(C)C(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
CC(C)(O)C(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
CC(C)(N)C(=O)N1CC[C@@](C)(C1)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1 |r|
CC(C)(C)OC(=O)N1CC[C@@](C)(C1)Nc1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1 |r|
CC(C)(C)OC(=O)N1CC[C@@](CO)(C1)Nc1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1 |r|
CC(C)C(=O)N1CC[C@@](CO)(C1)Nc1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1 |r|
COC(=O)N1CC[C@@](CO)(C1)Nc1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1 |r|
CS(=O)(=O)N1CC[C@@](CO)(C1)Nc1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1 |r|
Nc1ncc(cn1)-c1cc(N[C@@]2(CO)CCN(C2)C(=O)OCC(F)F)nc(n1)N1CCOCC1 |r|
COC(=O)N1CC[C@@](CO)(C1)Nc1nc(nc(c1F)-c1cnc(N)nc1)N1CCOCC1 |r|
Nc1ncc(cn1)-c1nc(nc(N[C@@]2(CO)CCN(C2)C(=O)OCC(F)F)c1F)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1(C)C |r|
CC(C)NC(=O)CSc1nc(nc2cc(=O)[nH]n12)-c1ccc2OCOc2c1
Fc1ccc(CNC(=O)Cc2nnc(o2)-c2ccccn2)c(Cl)c1
Fc1ccc(CNC(=O)Cc2nnc(o2)-c2ccc3OCOc3c2)cc1
O=C(Cc1nnc(o1)-c1ccc2ncccc2c1)N1CCN(CC1)c1ccccc1
FC(F)(F)Oc1ccc(NC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)cc1
FC(F)(F)c1cccc(NC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)c1
Fc1ccc(NC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)cc1C#N
COc1ccc(NC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)cc1OC
COc1ccc(CNC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)cc1OC
COc1ccccc1CNC(=O)Cc1nnc(o1)-c1ccc2ncccc2c1
Clc1ccc(CCNC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)cc1
Fc1ccc(CNC(=O)Cc2nnc(o2)-c2ccc3ncccc3c2)c(Cl)c1
O=C(Cc1nnc(o1)-c1ccc2ncccc2c1)NCCc1ccccc1
Cc1nc(NC(=O)N2CCC[C@H]2C(O)=O)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
C[C@H](Nc1nc(N)nc(C)c1C#N)c1c(-c2ccc(F)cc2)c2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1c(-c2ccc(cc2)C(N)=O)c2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1c(-c2ccccc2)c2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1c(C2CC2)c2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1c(C)c2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1cc2ccc(F)cn2c(=O)c1-c1ccc(F)cc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1cc2ccc(F)cn2c(=O)c1-c1cccc(C)c1 |r|
C[C@H](Nc1nc(N)nc(C)c1C#N)c1cc2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1cc2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1ncnc2[nH]cnc12)c1cc2cccc(C)n2c(=O)c1-c1ccccc1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1c(-c2ccc(F)cc2)c2ccc(F)cn2c(=O)c1-c1ccccc1 |r|
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2sc(CN3CCN(C4CCCC4)C(=O)C3)cc2n1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3=O)C3CCCC3)cc2n1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2sc(CN3CCN(CC=C)CC3=O)cc2n1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3=O)C(=O)C3CC3)cc2n1
CCc1nc2ccccc2n1-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3=O)C(=O)C3CCC3)cc2n1
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3nc(N)ns3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3ccc(N)nn3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3nnc(N)s3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)s3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3C(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3C(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3C(F)(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3C(F)(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)c(c3)C(F)(F)F)N1CCOC2 |r|
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nn3c2)-c2ccc(NC(=O)Nc3ccc(F)cc3)cc2)N2CCOCC2)CC1
CN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cc(CN4CCN(CC4)S(C)(=O)=O)cn3n2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cc(CN4CCN(CC4)S(C)(=O)=O)cn3n2)cc1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cc(CN4CCN(CC4)S(C)(=O)=O)cn3n2)cc1
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nn3c2)-c2cnc(N)cc2C(F)(F)F)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nn3c2)-c2cnc(N)cc2C(F)(F)F)N2CC3CCC(C2)O3)CC1
C[C@H]1COCCN1c1nc(nn2cc(CN3CCN(CC3)S(C)(=O)=O)cc12)-c1cnc(N)cc1C(F)(F)F |r|
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nn3c2)-c2cnc(NC(=O)Nc3ccc(F)cc3)cc2C(F)(F)F)N2CCOCC2)CC1
CCNC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nn3c2)-c2cnc(NC(=O)C=C)cc2C(F)(F)F)N2CCOCC2)CC1
CNC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
CCOC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
COC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
CS(=O)(=O)N1CCN(Cc2cc3c(nc(nn3c2)-c2cnc(NC(=O)Oc3ccccc3)cc2C(F)(F)F)N2CCOCC2)CC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(CC1)c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc(N)nc1)N1CCOCC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(CC1)c1nc(nc(n1)-c1cnc(N)nc1)N1CCOCC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(CC1)c1nc(nc(n1)-c1cnc(NC(=O)CN2CCOCC2)cc1C(F)(F)F)N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C=C\C(=O)N3CCN(C)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N(C)CCO)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCOCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCN(C)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCC(O)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C/C(=O)N3CCOCC3)c2c1
c1cc(cnc1)N2C(=O)c3c(ccc(c3N=C2[C@H](C4CC4)Nc5c(c(nc(n5)N)N)C#N)F)Cl
OC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
CN(C)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)[C@@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r|
NC(=O)[C@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r|
NC(=O)C1CCCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)C1CCCN(C1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)C1(N)CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
C[C@H](NC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1)C(N)=O |r|
O=C(N1CCOCC1)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
CN1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
CS(=O)(=O)N1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
COC(=O)c1ccc2nc(NC(=O)N3CCC[C@H]3C(N)=O)[nH]c2c1 |r|
CN(C)C1CCN(CC1)C(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c1
O=S1(=O)CC2(OCCO2)c2cc3nccc(Nc4ccc5scnc5c4)c3cc12
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3o2)-c2cnc(N)nc2)CC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1ccc(F)c(N)c1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1ccc(N)c(F)c1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1ccc(N)nc1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1cccc2[nH]ncc12)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1ccc2cn[nH]c2c1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1cccc2[nH]ccc12)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3)C(=O)c3cc(Cc4n[nH]c(=O)c5ccccc45)ccc3F)cc2n1
Cc1c(CN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)sc2c(nc(nc12)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1
COc1ncc-2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cccc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCC1CCN(CC1)c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)N1CCc3ccc(cc3C1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(ccn1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(F)c(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1F)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1cnc3ccc-2nn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1cnc3ccc-2nn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1cnc3ccc-2cn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCC1CCN(CC1)c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1cnc3ccc-2cn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ccnc3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1cnn3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1cnn3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1cnn3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3sc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(Cc3cnc4sc-2nn34)c1
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3sc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(Cc3cnc4sc-2nn34)c1
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3[nH]c-2cc13
Oc1cccc(c1)-c1cc(NCCCc2ccccc2)cc2C(=O)NCc12
Oc1cccc(c1)-c1cc(NCCCN2CCOCC2)cc2C(=O)NCc12
Oc1cc(F)cc(c1)-c1cc(NCCCc2ccccc2)cc2C(=O)NCc12
Oc1cc(F)cc(c1)-c1cccc2C(=O)NCc12
Oc1cc(F)cc(c1)-c1cc(cc2C(=O)NCc12)-c1cccc(F)c1
C[C@H]1CN(C[C@@H](C)O1)c1cc(ccn1)-c1cc2C(=O)NCc2c(c1)-c1cc(O)cc(F)c1 |r|
C[C@H]1CN(Cc2nnc(o2)-c2cc3C(=O)NCc3c(c2)-c2cc(O)cc(F)c2)C[C@@H](C)O1 |r|
Oc1cc(F)cc(c1)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CCOCC2)cc2C(=O)NCc12 |r|
Oc1cc(F)cc(c1)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC(F)(F)C2)cc2C(=O)NCc12 |r|
Oc1cc(F)cc(c1)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC2)cc2C(=O)NCc12 |r|
COc1ccc(cn1)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC2)cc2C(=O)NCc12 |r|
Oc1cncc(c1)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC2)cc2C(=O)NCc12 |r|
Oc1cc(cnc1F)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC2)cc2C(=O)NCc12 |r|
Cc1ncc(cc1NS(C)(=O)=O)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC2)cc2C(=O)NCc12 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1cc(O[C@@H]2CCN(C2)C(=O)C2CC2)cc2C(=O)NCc12 |r|
COc1ncc(cc1NS(C)(=O)=O)-c1cccc2C(=O)NCc12
COc1cc2C(=O)NCc2c(c1)-c1cnc(OC)c(NS(C)(=O)=O)c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OC(C)C)cc2C(=O)NCc12
CCOc1cc2C(=O)NCc2c(c1)-c1cnc(OC)c(NS(C)(=O)=O)c1
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OC2CCC2)cc2C(=O)NCc12
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OCC2CCC2)cc2C(=O)NCc12
COc1ncc(cc1NS(C)(=O)=O)-c1cc(OC2CN(C2)C(=O)C2CC2)cc2C(=O)NCc12
COc1ncc(cc1NS(C)(=O)=O)-c1cc(cc2C(=O)NCc12)-c1ccc(nc1)C#C
COc1ncc(cc1NS(C)(=O)=O)-c1cc(cc2C(=O)NCc12)-c1ccnc(c1)N1C[C@H](C)O[C@H](C)C1 |r|
Cn1ncc2cc(cnc12)-c1cc(OC2CN(C2)C(=O)C2CC2)cc2C(=O)NCc12
FC(F)Oc1cc(cnc1Cl)-c1cc(OC2CN(C2)C(=O)C2CC2)cc2C(=O)NCc12
Nc1ncc(cc1C(F)(F)F)-c1cc(OC2CN(C2)C(=O)C2CC2)cc2C(=O)NCc12
FC(F)Oc1ccc(cn1)-c1cc(OC2CN(C2)C(=O)C2CC2)cc2C(=O)NCc12
CNc1ncc(cc1C(F)(F)F)-c1cc(OC2CN(C2)C(=O)C2C[C@H]2C)cc2C(=O)NCc12 |r|
C[C@H]1CN(C[C@@H](C)O1)c1cc(ccn1)-c1cc2C(=O)NCc2c(c1)-c1cnc(C)nc1 |r|
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(N3CCOCC3)c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(N3CCCC3)c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(N3CCCCC3)c2c1
CC1CCN(CC1)c1cnnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CCOc1cnnc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(-n3ccnc3)c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(-c3ccncc3)c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(-c3ccc(cc3)N3CCOCC3)c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(-c3cnc(nc3)N3CCOCC3)c2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nncc(-c3ccc(nc3)N3CCOCC3)c2c1
Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1
Cc1ncc(s1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:27.30,wD:24.26,(31.47,-5.01,;30,-5.48,;29.52,-6.95,;27.98,-6.95,;27.51,-5.48,;28.75,-4.58,;25.73,-4.57,;24.4,-5.34,;23.07,-4.56,;23.06,-3.03,;24.39,-2.26,;25.73,-3.03,;27.06,-2.25,;21.74,-5.34,;21.74,-6.87,;20.41,-7.64,;19.07,-6.88,;19.07,-5.35,;20.4,-4.57,;20.4,-3.03,;20.41,-9.18,;19.63,-10.51,;18.87,-9.17,;21.75,-9.95,;23.08,-9.18,;24.41,-9.94,;25.74,-9.18,;25.74,-7.64,;27.07,-6.87,;24.41,-6.86,;23.08,-7.64,)|
Cc1ncc(s1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCC(F)(F)CC1
Cc1ncc(s1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCCO
Cc1ncc(s1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1ncc(s1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCO
Cc1ncc(s1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(n1)-c1cnn(C)n1)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(n1)-n1cncn1)S(=O)(=O)NCC(C)(C)O
Cc1ccn(n1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1nn(C)cc1-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1nn(C)nc1-c1nc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-n1cncn1)S(=O)(=O)NCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cnn(c1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)NCC(C)(C)O
Cc1nn(C)cc1-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1c(cnn1C)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)c1)S(=O)(=O)NCC(C)(C)O
Cc1nnc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(n1)C(=O)C1CC1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(8.47,-3.48,;7.14,-4.25,;5.8,-3.49,;4.47,-4.26,;4.48,-5.79,;5.81,-6.57,;7.15,-5.79,;8.48,-6.56,;8.48,-8.1,;9.81,-8.87,;11.14,-8.09,;12.48,-8.86,;11.14,-6.54,;9.8,-5.78,;12.46,-5.77,;12.46,-4.23,;13.8,-6.53,;14.57,-7.86,;15.34,-6.52,;3.14,-6.56,;1.6,-6.56,;2.38,-5.23,;3.15,-8.11,;4.49,-8.87,;5.82,-8.1,;7.15,-8.87,;7.15,-10.41,;8.48,-11.19,;5.82,-11.18,;4.49,-10.41,)|
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1ccc(F)c(F)c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]ncc2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]cnc2c1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]ccc2n1
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(s1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(ccn1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(o1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1csc(c1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(cs1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1nc(cs1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1sc(cc1C)-c1ncnc3cc-2sc13
COc1ccc2cc1C(=O)NCc1ccc(s1)-c1ncnc3cc(sc13)-c1cnc(OC)c(NS2(=O)=O)c1
COc1ncc-2cc1NS(=O)(=O)c1ccc(F)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1ccc(Cl)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(s1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1ccc(F)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NC[C@@H]1CN(CCO1)c1ncnc3c(C)c-2sc13 |r|
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NC[C@@H]1CCN(C1)c1ncnc3c(C)c-2sc13 |r|
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NC[C@H]1CCN(C1)c1ncnc3c(C)c-2sc13 |r|
CNC(=O)c1cccc(c1)S(=O)(=O)Nc1cc(cnc1OC)-c1sc2c(ncnc2c1C)-c1cccs1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1sc2c(ncnc2c1C)-c1ccc(CNC=O)s1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1sc2c(ncnc2c1C)-c1cccs1
C[C@@H](C1CC1)N1Cc2cc-3cc(c2C1=O)S(=O)(=O)NCCCCCNC(=O)c1cccc(Nc2nc(C)c-3s2)n1 |r|
C[C@@H](C1CC1)N1Cc2cc-3cc(c2C1=O)S(=O)(=O)NCCN(C)CCNC(=O)c1cccc(Nc2nc(C)c-3s2)n1 |r|
C[C@@H](C1CC1)N1Cc2cc-3cc(c2C1=O)S(=O)(=O)NCCN(C)CCCNC(=O)c1cccc(Nc2nc(C)c-3s2)n1 |r|
C[C@@H](C1CC1)N1Cc2cc-3cc(c2C1=O)S(=O)(=O)NCCOCCNC(=O)c1cccc(Nc2nc(C)c-3s2)n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1sc(Nc2cccc(n2)N2CCCC2=O)nc1C |r|
COc1cc(CN(c2cc(cnc2OC)-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)S(=O)(=O)c2ccc(F)cc2F)c(cc1OC)[N+]([O-])=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2ncnc(C)c2c1
COCCN(CCOC)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
OCCN(CCO)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCNCC1
CC(=O)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
OCCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
OCCN(CCOCCOCCOCCONC(=O)c1ccc(F)c(F)c1Nc1ccc(I)cc1F)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
FC(F)c1nc2ccccc2n1-c1nc(NCCOCCOCCOCCONC(=O)c2ccc(F)c(F)c2Nc2ccc(I)cc2F)nc(n1)N1CCOCC1
CN(CCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1)C(C)=O
CC(=O)NCCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
NOCCOCCOCCOCCN(CCO)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
NOCCOCCOCCOCCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
CNCCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
NCCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
COCCN(CCO)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
CNC(=O)CCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
OC(=O)CCNc1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
CNCCN(CCO)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
NC(=O)[C@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
OC(=O)C1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
COC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
[H][C@@]12C[C@]1([H])N([C@@H](C2)C(N)=O)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)C1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
CN(C)[C@@H]1C[C@H](N(C1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1)C(N)=O |r|
CN(C)[C@H]1C[C@H](N(C1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1)C(N)=O |r|
NC(=O)[C@@H]1CC(O)CN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)C1CCCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)C1CCCN(C1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
C[C@@H](NC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1)C(N)=O |r|
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)[C@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)C1CCCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC[C@H]2C(N)=O)cc1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)C(N)=O)cc1)N1CCOCC1 |r|
C[C@H](NC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@@H]2C)N2CCOCC2)cc1)C(N)=O |r|
[H][C@]12CN(C[C@]1([H])OCCO2)c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1)N1CCOCC1 |r|
[H][C@]12CN(C[C@]1([H])OCCO2)c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC[C@H]2C(N)=O)cc1)N1CCOCC1 |r|
NC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(ncn2)N2CCOCC2)cc1 |r|
C[C@H]1COCCN1c1ccnc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC[C@H]2C(N)=O)cc1 |r|
CN(C)C1CCN(CC1)C(=O)c1cnc(Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)nc1
NC(=O)[C@@H]1CCCN1C(=O)c1cnc(Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)nc1 |r|
NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(cc1)-c1nccc(n1)N1CCOCC1 |r|
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1ccc(\C=N\N=c2/scc(-c3ccccc3)n2-c2ccccc2)cc1
FC(F)(F)COc1ccc(cc1)-c1nnc(Nc2ccccc2)s1
COC(=O)\C=C1/S\C(=N/N=C/c2ccc(OCC(F)(F)F)cc2)N(C1=O)c1ccccc1
Nc1ncc(cn1)-c1cn(Cc2ccc(cc2)C(=O)NO)c(=O)c(n1)N1CCOCC1
CCCn1cc(nc(N2CCOCC2)c1=O)-c1cnc(N)nc1
Nc1ncc(cn1)-c1cn(CCCCCC(=O)NO)c(=O)c(n1)N1CCOCC1
Nc1ncc(cn1)-c1cn(CCCCCCC(=O)NO)c(=O)c(n1)N1CCOCC1
Nc1ncc(cn1)-c1cn(CCCCCCCC(=O)NO)c(=O)c(n1)N1CCOCC1
CNc1ncc(cn1)-c1cn(Cc2ccc(cc2)C(=O)NO)c(=O)c(n1)N1CCOCC1
ONC(=O)c1ccc(Cn2cc(nc(N3CCOCC3)c2=O)-c2cccc(O)c2)cc1
ONC(=O)c1ccc(Cn2cc(nc(N3CCOCC3)c2=O)-c2cccc3[nH]ncc23)cc1
c1cc(oc1)c2nc3c4cc(ccc4nc(n3n2)N)Cl
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(F)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(Cl)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(cc1)C#N
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(cc1)C(F)(F)F
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
CC(=O)c1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
CNC(=O)c1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
COC(=O)c1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(C)cc1
COc1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(O)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(N)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(N)nc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc(N)nc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc(nc1)N1CCOCC1
Cc1noc(C)c1-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnn(C)c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc2ccccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc2ccccc2c1
Cc1nc2cnc3ccc(cc3c2n1C)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1C1CC1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1CC1CCOCC1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1CC1CCOC1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1Cc1ccccc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccccc1)-c1cnc2[nH]ccc2c1
COc1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)nc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)C(F)(F)F)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(nc1)C(F)(F)F)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)C(C)(C)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3cc(F)c(cc3c2n1-c1ccc(cc1)C(C)(C)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(nc1)C(C)(C)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)N1CCOCC1)-c1cnc2[nH]ccc2c1
C[C@@H](c1ccccc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
C[C@H](c1ccccc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
C[C@@H](c1ccc(F)cc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
C[C@H](c1ccc(F)cc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
ONC(=O)c1ccc(\C=N\NC(=O)c2cc(nc(n2)-c2cccc(O)c2)N2CCOCC2)cc1
ONC(=O)c1ccc(\C=N\NC(=O)c2cc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)cc1
COCC1CN(C1)C1CCN(CC1)c1cc(OC)c(Nc2ncc(Br)c(Nc3ccc4OCCOc4c3P(C)(C)=O)n2)cc1C
Cc1cc(ccc1S(=O)(=O)N(CCO)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CNCCCN(C)c1cc(ccc1S(=O)(=O)N(CCO)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CN1C(=O)CN(C2CCOCC2)c2nc(Nc3cn4ncnc4cc3C)ncc12
[H][C@]12C[C@H](N(c3nc(N)nc(N)c3C#N)[C@@]1([H])CCCC2)c1nc2cccc(F)c2c(=O)n1-c1cccnc1 |r|
C[C@H]1CC[C@H](N1c1nc(N)nc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(F)c1 |r|
C[C@H]1CC[C@H](N1c1nc(N)nc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1cccnc1 |r|
COc1cncc(c1)-c1cccc2nc([C@@H]3CC[C@H](C)N3c3nc(N)nc(N)c3C#N)n(-c3cccc(F)c3)c(=O)c12 |r|
C[C@H]1CC[C@H](N1c1nc(N)nc(N)c1C#N)c1nc2c(F)cc(F)cc2c(=O)n1-c1cccnc1 |r|
COc1ncc(cc1C)-c1cc(OCCN(C)c2ncc(cn2)C(=O)NO)c2nc(N)nc(C)c2c1
COc1ncc(cc1F)-c1cc(OCCCCCCC(=O)NO)c2nc(N)nc(C)c2c1
Cn1cc(c2c1cccc2)CNCC3CCN(CC3)c4ncc(cn4)C(=O)NO
CN(C)C(=O)Oc1ccc2c(C)c(Cc3cccc(c3)N(C)S(=O)(=O)CCCNCCCCCC(=O)N3CCN(CC3)c3nc(nc(n3)-n3c(nc4ccccc34)C(F)F)N3CCOCC3)c(=O)oc2c1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CC1)C(=O)CCOCCOCCOCCONC(=O)c1ccc(F)c(F)c1Nc1ccc(I)cc1F)N1CCOCC1
CC(C)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O
CC(C)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O
c1cc(c(cc1/C=C/C(=O)c2ccc(cc2O)O)O)O
CC1=C(SC(=NC(=O)C)N1)c2ccc(c(c2)S(=O)(=O)NCCO)Cl
NC(=O)c1ccc2-c3nc(sc3CCOc2c1)-c1ncnn1-c1ccc(F)cc1F
CC1COc2cc(ccc2-c2nc(sc12)-c1ncnn1-c1ccc(F)cc1F)C(N)=O
Nc1cc(c(cn1)-c1cc(nc(c1)N1CCOCC1)N1CCOCC1)C(F)(F)F
COc1ccc2N(CCOc2c1)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCS(=O)(=O)CC1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCCCC1=O)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCN(C1=O)c1ccccc1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOC(C1)c1ccccc1)C(F)(F)F
CNC(=O)N(C)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)cc1C(F)(F)F
Nc1cc(c(cn1)-c1cc(NC(CO)Cc2ccccc2)nc(n1)N1CCOCC1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOC[C@H]1CO)C(F)(F)F |r|
Nc1cc(C#N)c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOC(CCO)C1
CNC(=O)N(CCO)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)cc1C(F)(F)F
C[C@H]1COC(=O)N1c1nc(cc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCCC1=O)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCNC1=O)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOC1=O)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOC2=O)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCCOC2=O)c(n1)C(F)(F)F
C[C@H]1COC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
Nc1ncc(-c2cc(nc(n2)N2[C@@H](CO)COC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2[C@H](CO)COC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2C[C@@H](CO)OC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2C[C@H](CO)OC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
C[C@]1(CO)COC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@@H]1OC(=O)N([C@H]1CO)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1OC(=O)N([C@H]1CO)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
[H][C@]1(COC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1)[C@H](C)O |r|
CC1(C)OC(=O)N([C@H]1CO)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
[H][C@@]12COC[C@]1([H])N(C(=O)O2)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1OC(=O)N([C@H]1CC#N)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1OC(=O)N([C@H]1CN1CC[S+]([O-])CC1)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1[C@@H](CO)OC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1[C@H](CO)OC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
Cc1cc2c(cccn2)cc1Nc3ncc4c(n3)N(C(=O)N4C)[C@@H]5CNC[C@H]5F
O=C(Nc1cc(ccn1)-c1ccnc(Nc2ccccc2)c1)C1CCOC1
O=C(Nc1cc(ccn1)-c1cccc(Nc2ccccc2)c1)C1CCOC1
O=C(Nc1cc(ccn1)-c1ccccc1)C1CCOC1
CNS(=O)(=O)c1cccc(c1)-c1ccnc(NC(=O)C2CCOC2)c1
CC(=O)Nc1cccc(c1)-c1ccnc(NC(=O)C2CCOC2)c1
CNC(=O)c1cccc(c1)-c1ccnc(NC(=O)C2CCOC2)c1
CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOC2)c1
CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(C)=O)c1
CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCN(C)CC2)c1
CNC(=O)c1cc(Nc2ccc(F)cc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CNC(=O)c1cc(Nc2cccc(F)c2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CNC(=O)c1cc(Nc2ccccc2F)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CNC(=O)c1cc(Nc2ccn(C)n2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CNC(=O)c1cc(NC2CCOCC2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
NC(=O)CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
O=C(Nc1cc(ccn1)-c1cc(Nc2ccccc2)cc(c1)C(=O)NCC1OCCO1)C1CC1
CN(CC1OCCO1)C(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
CN(C)CCNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
CN(C)CCCNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
CNC(=O)c1cc(Nc2ccc(F)cc2)cc(c1)-c1cc(NC(=O)C2CCOCC2)ncc1Cl
CNC(=O)c1cc(Nc2ccc(F)cc2)cc(c1)-c1cc(NC(=O)C2CCOCC2)ncn1
CC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
OCC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CN(C(C)=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CS(=O)(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CNS(=O)(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CN(C)CCOc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CN1CCN(Cc2cc(Nc3ccccc3)cc(c2)-c2ccnc(NC(=O)C3CCOCC3)c2)CC1
CNc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CN(C)C(=O)c1cc2cnc(Nc3ccc(cc3)-c3csc4c3oc(cc4=O)N3CCOCC3)nc2n1C1CCCC1
CC(C)Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
C1CCC(C1)Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
C(Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)c1ccccc1
CC(C)c1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
COc1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
[O-][N+](=O)c1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
N#Cc1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
FC(F)(F)c1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)c1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CCN1CCN(CC1)c1nc(nc(n1)-c1ccc2oc(N)nc2c1)N1CCOCC1
CC(C)N1CCN(CC1)c1nc(nc(n1)-c1ccc2oc(N)nc2c1)N1CCOCC1
CC(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2oc(N)nc2c1)N1CCOCC1
CS(=O)(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2oc(N)nc2c1)N1CCOCC1
CC(C)(C)OC(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2oc(N)nc2c1)N1CCOCC1
Nc1nc2ccc(cc2s1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CN(C)c1nc2ccc(cc2s1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CC(=O)Nc1nc2ccc(cc2s1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CC(C)(C)OC(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2nc(N)sc2c1)N1CCOCC1
Nc1nc2ccc(cc2s1)-c1nc(nc(n1)N1CCC(CC1)C(F)(F)F)N1CCOCC1
CC(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2nc(N)sc2c1)N1CCOCC1
CS(=O)(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2nc(N)oc2c1)N1CCN(CC1)S(C)(=O)=O
Nc1nc2ccc(cc2o1)-c1nc(Nc2ccc3OCOc3c2)nc(Nc2ccc3OCOc3c2)n1
CC(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2nc(N)oc2c1)N1CCN(CC1)C(C)=O
COC(=O)c1ccc(CNc2nc3ccc(cc3o2)-c2nc(nc(n2)N2CCN(CC2)C(C)=O)N2CCN(CC2)C(C)=O)cc1
CC(=O)N1CCN(CC1)c1nc(nc(n1)-c1ccc2nc(NCc3ccc(cc3)C(O)=O)oc2c1)N1CCN(CC1)C(C)=O
OC(=O)c1ccc(CNc2nc3ccc(cc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CC(=O)Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CC(C)C(=O)Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C1CCCCC1
CN(C)c1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COC(=O)c1ccc(CNc2nc3cc(ccc3o2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Nc1nc2cc(ccc2o1)-c1nc(nc(n1)N1CCOCC1)N1CCNCC1
Nc1nc2cc(ccc2o1)-c1nc(NC2CCOCC2)nc(n1)N1CCOCC1
Nc1nc2cc(ccc2o1)-c1nc(NC2CCC(CC2)C(F)(F)F)nc(n1)N1CCOCC1 |(6.73,-.86,;5.19,-.86,;4.31,.36,;2.81,-.1,;1.47,.67,;.14,-.1,;.14,-1.64,;1.47,-2.41,;2.81,-1.64,;4.27,-2.1,;-1.19,.67,;-2.52,-.1,;-3.85,.67,;-5.19,-.1,;-5.19,-1.64,;-3.86,-2.41,;-3.86,-3.95,;-5.19,-4.72,;-6.52,-3.95,;-6.52,-2.41,;-5.19,-6.26,;-3.86,-7.03,;-6.73,-6.26,;-5.96,-7.6,;-3.85,2.21,;-2.52,2.98,;-1.19,2.21,;-2.52,4.52,;-3.85,5.29,;-3.85,6.83,;-2.52,7.6,;-1.19,6.83,;-1.19,5.29,)|
Nc1nc2cc(ccc2o1)-c1nc(Nc2cccc(c2)C(F)(F)F)nc(n1)N1CCOCC1
CN(C)c1nc2ccc(cc2s1)-c1nc(nc(n1)N1CCOCC1)N1CCNCC1
CN(C)c1nc2ccc(cc2s1)-c1nc(nc(n1)N1CCN(CC1)S(C)(=O)=O)N1CCOCC1
CN(C)c1nc2ccc(cc2s1)-c1nc(Nc2ccc(cc2)C(F)(F)F)nc(n1)N1CCOCC1
Nc1ncnc(N2CC3(CC3)C[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r|
Nc1ncnc(N2CC(=C)C[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r|
Nc1ncnc(N2CC(F)(F)C[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r|
[H][C@]12C[C@H](N(c3ncnc(N)c3C#N)[C@@]1([H])CCCC2)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
[H][C@]12C[C@H](N(c3ncnc(N)c3C#N)[C@@]1([H])CCCC2)c1nc2cccc(Cl)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
[H][C@]12C[C@H](N(c3ncnc(N)c3C#N)[C@@]1([H])CCCC2)c1nc2cccc(F)c2c(=O)n1-c1cc(F)cc(F)c1 |r|
C[C@H]1CC[C@H](N1c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r|
C[C@H]1CC[C@H](N1c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(F)c1 |r|
C[C@H]1CC[C@H](N1c1ncnc2[nH]cnc12)c1nc2cccc(Cl)c2c(=O)n1-c1cccc(F)c1 |r|
CC(C)n1nc(N)nc1-c1cn2CCOc3cc(O[C@@H](C)C(N)=O)ccc3-c2n1 |r|
C[C@H](Oc1ccc2-c3nc(cn3CCOc2c1)-c1nc(CO)nn1CC(F)(F)F)C(N)=O |r|
CC(C)n1nc(N)nc1-c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
CC1(C)N(C(=O)NC1=O)c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CC[C@H](O)C1=O |r|
CO[C@H]1CCN(C1=O)c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CCOC1=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CCCOC1=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CCOCC1=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CCCOCC1=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CCOCCC1=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1CCn2nccc2C1=O |r|
C[C@@H]1COC(=O)N1c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
C[C@H]1CN(C(=O)O1)c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
C[C@@H]1CN(C(=O)O1)c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
COC[C@@H]1COC(=O)N1c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
CC(C)[C@@H]1COC(=O)N1c1cn2CCOc3cc(ccc3-c2n1)N1CCC[C@H]1C(N)=O |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](CCC1=O)C(F)(F)F |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)F |r|
NC(=O)[C@@H]1CCCN1c1ccc2-c3nc(cn3CCOc2c1)N1[C@H](CF)COC1=O |r|
NC(=O)[C@@H]1[C@H](F)CCN1c1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F |r|
CO[C@@H]1CCN([C@@H]1C(N)=O)c1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F |r|
NC(=O)[C@@H]1COCCN1c1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F |r|
C[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F)C(N)=O |r|
CC[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F)C(N)=O |r|
CC(C)[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F)C(N)=O |r|
NC(=O)[C@@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F)C1CC1 |r|
NC(=O)[C@@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F)C1CCC1 |r|
C[C@H](Oc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)F)C(N)=O |r|
C[C@@H](C1CC1)N1Cc2cc(cc(C)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(C)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CCC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(C)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3COC3)c2n1 |r|
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C[C@@H](C1CC1)N1Cc2cc(cc(C)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@H]3CC[C@@](C)(O)CC3)c2n1 |r,wU:1.1,27.29,30.34,(7.55,2.99,;6.78,1.66,;7.55,.32,;7.55,-1.22,;8.89,-.45,;5.24,1.66,;4.34,2.9,;2.87,2.43,;1.54,3.2,;.21,2.43,;.21,.88,;1.55,.12,;1.55,-1.42,;2.87,.89,;4.34,.41,;4.74,-1.08,;-1.12,3.2,;-1.12,4.73,;-2.45,5.5,;-3.78,4.73,;-5.24,5.21,;-6.15,3.96,;-7.69,3.96,;-5.24,2.71,;-6.01,1.38,;-7.55,1.38,;-5.24,.05,;-6.01,-1.29,;-5.24,-2.62,;-6.01,-3.95,;-7.55,-3.95,;-7.55,-5.5,;-8.89,-4.73,;-8.32,-2.62,;-7.55,-1.29,;-3.78,3.19,;-2.44,2.43,)|
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C[C@@H](C1CC1)N1Cc2cc(cc(Cl)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(C3CC3)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
CC(C)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)C(F)(F)F)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(OC(F)F)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(OC(F)(F)F)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(C)(=O)=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
CCS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)C1CC1)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(c2C1=O)S(=O)(=O)C1CCC1)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
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CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C3CC3)C(=O)c12)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(NS(C)(=O)=O)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
Cc1cc(cc2CN(CC3CC3)C(=O)c12)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1
CCN1Cc2cc(cc(C)c2C1=O)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1
Cc1cc(cc2CN([C@@H](C3CC3)C(F)(F)F)C(=O)c12)-c1ccn2nc(N)c(C(=O)NC3CC3)c2n1 |r|
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CNS(=O)(=O)c1cc(cc2CN([C@@H](C)C(F)(F)F)C(=O)c12)-c1ccn2nc(N)c(C(=O)N[C@H]3CC[C@](C)(O)CC3)c2n1 |r,wU:32.33,12.13,wD:35.38,(.21,-3.84,;.21,-2.3,;1.55,-1.53,;2.88,-2.3,;1.55,-3.07,;1.55,.01,;.21,.78,;.21,2.32,;1.54,3.09,;2.87,2.32,;4.34,2.8,;5.24,1.55,;6.78,1.55,;7.55,2.89,;7.55,.22,;9.09,.22,;6.78,-1.11,;8.1,-1.24,;4.34,.31,;4.74,-1.18,;2.87,.78,;-1.12,3.09,;-1.12,4.63,;-2.45,5.39,;-3.78,4.63,;-5.24,5.1,;-6.15,3.86,;-7.69,3.86,;-5.24,2.61,;-6.01,1.28,;-7.55,1.28,;-5.24,-.06,;-6.01,-1.39,;-5.24,-2.72,;-6.01,-4.06,;-7.55,-4.06,;-8.32,-5.39,;-9.09,-4.06,;-8.32,-2.72,;-7.55,-1.39,;-3.78,3.09,;-2.44,2.33,)|
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C[C@@H](C1CC1)N1Cc2cc(cc(NS(C)(=O)=O)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@H]3CC[C@](C)(O)CC3)c2n1 |r,wU:31.33,1.1,wD:34.38,(7.66,2.89,;6.89,1.55,;7.66,.22,;7.66,-1.32,;8.99,-.55,;5.35,1.55,;4.44,2.8,;2.98,2.32,;1.65,3.09,;.31,2.32,;.31,.78,;1.65,.01,;1.65,-1.53,;.32,-2.3,;.32,-3.84,;-1.02,-1.53,;.32,-.76,;2.98,.78,;4.44,.31,;4.84,-1.18,;-1.02,3.09,;-1.02,4.63,;-2.34,5.39,;-3.67,4.63,;-5.14,5.1,;-6.04,3.86,;-7.58,3.86,;-5.14,2.61,;-5.91,1.28,;-7.45,1.28,;-5.14,-.06,;-5.91,-1.39,;-5.14,-2.72,;-5.91,-4.06,;-7.45,-4.06,;-8.22,-5.39,;-8.99,-4.06,;-8.22,-2.72,;-7.45,-1.39,;-3.67,3.09,;-2.34,2.33,)|
C[C@@H](C1CC1)N1Cc2cc(cc(NS(C)(=O)=O)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@H]3CC[C@@](O)(CC3)C(F)(F)F)c2n1 |r,wU:31.33,1.1,34.37,(8.04,3.55,;7.27,2.22,;8.04,.89,;8.04,-.66,;9.37,.11,;5.73,2.22,;4.83,3.47,;3.36,2.99,;2.03,3.76,;.7,2.99,;.7,1.44,;2.03,.68,;2.03,-.86,;.7,-1.63,;.7,-3.17,;-.63,-.86,;.7,-.09,;3.36,1.45,;4.83,.97,;5.22,-.51,;-.64,3.76,;-.64,5.29,;-1.96,6.06,;-3.29,5.29,;-4.75,5.77,;-5.66,4.52,;-7.2,4.52,;-4.75,3.28,;-5.52,1.94,;-7.06,1.94,;-4.75,.61,;-5.52,-.72,;-4.75,-2.06,;-5.52,-3.39,;-7.06,-3.39,;-8.6,-3.39,;-7.83,-2.06,;-7.06,-.72,;-7.83,-4.73,;-7.06,-6.06,;-9.37,-4.73,;-8.6,-6.06,;-3.29,3.75,;-1.96,2.99,)|
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C[C@@H](C1CC1)N1Cc2cc(cc(OC(F)F)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@@H](CO)C3CC3)c2n1 |r|
C[C@@H](C1CC1)N1Cc2cc(cc(OC(F)(F)F)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@H]3CC[C@@](C)(O)CC3)c2n1 |r,wU:31.33,1.1,34.38,(7.66,2.89,;6.89,1.55,;7.66,.22,;7.66,-1.32,;8.99,-.55,;5.35,1.55,;4.44,2.8,;2.98,2.32,;1.65,3.09,;.31,2.32,;.31,.78,;1.65,.01,;1.65,-1.53,;.32,-2.3,;.32,-3.84,;-1.02,-1.53,;-1.02,-3.07,;2.98,.78,;4.44,.31,;4.84,-1.18,;-1.02,3.09,;-1.02,4.63,;-2.34,5.39,;-3.67,4.63,;-5.14,5.1,;-6.04,3.86,;-7.58,3.86,;-5.14,2.61,;-5.91,1.28,;-7.45,1.28,;-5.14,-.06,;-5.91,-1.39,;-5.14,-2.73,;-5.91,-4.06,;-7.45,-4.06,;-8.22,-5.39,;-8.99,-4.06,;-8.22,-2.73,;-7.45,-1.39,;-3.67,3.09,;-2.34,2.33,)|
C[C@@H](C1CC1)N1Cc2cc(cc(OC(F)F)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@H]3CC[C@@](C)(O)CC3)c2n1 |r,wU:30.32,1.1,33.37,(7.66,2.89,;6.89,1.55,;7.66,.22,;7.66,-1.32,;8.99,-.55,;5.35,1.55,;4.44,2.8,;2.98,2.32,;1.65,3.09,;.31,2.32,;.31,.78,;1.65,.01,;1.65,-1.53,;.32,-2.3,;.32,-3.84,;-1.02,-1.53,;2.98,.78,;4.44,.31,;4.84,-1.18,;-1.02,3.09,;-1.02,4.63,;-2.34,5.39,;-3.67,4.63,;-5.14,5.1,;-6.04,3.86,;-7.58,3.86,;-5.14,2.61,;-5.91,1.28,;-7.45,1.28,;-5.14,-.06,;-5.91,-1.39,;-5.14,-2.72,;-5.91,-4.06,;-7.45,-4.06,;-8.22,-5.39,;-8.99,-4.06,;-8.22,-2.72,;-7.45,-1.39,;-3.67,3.09,;-2.34,2.33,)|
CC[C@H](Nc1nc(N)nc(N)c1C#N)c1nn(-c2cccnc2)c2cc(Cl)ccc12 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1nn(-c2cccc(c2)S(C)(=O)=O)c2cc(Cl)ccc12 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1nn(-c2cccnc2)c2cc(Cl)ccc12 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(F)c1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(c1)C#N |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(c1)C(F)(F)F |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1ccc(OC)nc1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(C)c1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(OC)c1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1ccc(nc1)C#N |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cncc(c1)S(C)(=O)=O |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)nc1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1ccc(OC)c(F)c1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1ccc(F)c(c1)C#N |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1ccc(OC)c(OC)c1 |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1ccc(cc1)S(C)(=O)=O |r|
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cccc(c1)S(C)(=O)=O |r|
CCCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(OC)c1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C(C)C)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C(C)(C)C)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C3CC3)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C3CCC3)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C3CCCC3)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C3CCCCC3)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)c3ccccc3)ncnc2s1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2sc(cc12)-c1cnc(OC)c(c1)C(F)(F)F |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2sc(cc12)-c1cnc(OC)c(c1)C#N |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2sc(cc12)-c1cnc(OC)c(F)c1 |r|
CCC(=O)N1CC[C@@H](C1)Oc1ncnc2sc(cc12)-c1cnc(OC)c(OC)c1 |r|
COc1cc(cnc1OC)-c1cc2c(O[C@H]3CCN(C3)C(=O)C(C)C)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(O[C@H]3CCN(C3)C(=O)C3CC3)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(O[C@H]3CCN(C3)C(=O)C3CCC3)ncnc2s1 |r|
ONC(=O)CCCCCOc1ccc2C3=NCCN3C(NC(=O)c3ccccc3)=Nc2c1 |c:30,t:14|
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)CCOCCOCCOCCONC(=O)c1ccc(F)c(F)c1Nc1ccc(I)cc1F
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCNCC1
CC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
NOCCOCCOCCOCCC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1nc(N)c(C#N)c(n1)N1CC2(CC2)C[C@H]1c1nc2cccc(Cl)c2c(=O)n1Cc1ccc(s1)C(=O)NO |r|
CO[C@@H](C)Cn1c2c(cnc3ccc(cc23)-c2cncc(c2)C(C)(C)O)n(C)c1=O |r|
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3ccc(nc3)OC)C4CCC(CC4)OCCO
c1c(cc(c(c1O)O)O)[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O
[H][C@]1(CSCN1c1ncnc2[nH]cnc12)c1nc2cccc(Cl)c2c(=O)n1-c1ccnn1C |r,wU:1.0,(2.09,2.1,;2.09,.56,;3.42,1.33,;4.58,.27,;3.96,-1.1,;2.42,-.93,;1.33,-2.02,;-.16,-1.62,;-1.24,-2.71,;-.84,-4.19,;.64,-4.59,;1.35,-5.95,;2.87,-5.72,;3.12,-4.24,;1.73,-3.51,;.75,1.33,;-.57,.56,;-1.91,1.33,;-3.24,.56,;-4.58,1.32,;-4.58,2.87,;-3.24,3.64,;-3.24,5.18,;-1.91,2.87,;-.58,3.64,;-.58,5.18,;.75,2.87,;2.08,3.64,;3.55,3.18,;4.46,4.42,;3.59,5.64,;2.08,5.18,;.75,5.95,)|
[H][C@]1(CSCN1c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccnn1C |r,wU:1.0,(2.02,2.17,;2.02,.63,;3.36,1.4,;4.51,.33,;3.89,-1.04,;2.36,-.86,;1.27,-1.95,;-.23,-1.55,;-1.31,-2.65,;-.91,-4.13,;.58,-4.53,;.98,-6.01,;1.67,-3.44,;3.15,-3.84,;4.64,-4.24,;.69,1.4,;-.64,.62,;-1.98,1.4,;-3.3,.63,;-4.64,1.39,;-4.64,2.94,;-3.31,3.7,;-3.31,5.24,;-1.98,2.94,;-.65,3.7,;-.65,5.24,;.69,2.93,;2.02,3.7,;3.48,3.24,;4.4,4.49,;3.52,5.71,;2.02,5.24,;.69,6.01,)|
CN1CCN(C)\C(C1)=N\c1ccc(cc1C(=O)Nc1ccccc1)[N+]([O-])=O
[H][C@]1(CSCN1c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1cccs1 |r|
COc1ccc(cc1OC)-c1ccc2nc(C)c(-c3cnc(N)c(c3)C(F)(F)F)n2n1
CC(Nc1ncnc(N)c1C#N)c1cc2ncc(Cl)n2nc1-c1ccccc1
Cc1nc2c(N)cc(nn2c1Cc1cccc(F)c1C1CCNCC1)N1CCOCC1
CC(=O)Nc1cn2nc(ccc2n1)-c1cnc(N)c(c1)-c1ccccc1OC(F)(F)F
CC(=O)Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)N2CCOCC2)c1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3ccccn3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3ccncc3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3cnccn3)cc2)N2CCOCC2)CC1
Cn1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)-c2ccc(CN3CCN(CC3)S(C)(=O)=O)s2)N2CCOCC2)n1
Cn1nccc1NC(=O)Nc1ccc(cc1)-c1nc(nc(n1)-c1ccc(CN2CCN(CC2)S(C)(=O)=O)s1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3ncc[nH]3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nn3cnnc3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)NC3CN4CCC3CC4)cc2)N2CCOCC2)CC1 |THB:27:28:32.31:35.34,(-13.01,-6.11,;-12.24,-4.78,;-13.57,-4.01,;-12.24,-3.24,;-10.7,-4.78,;-9.93,-3.45,;-8.4,-3.45,;-7.63,-4.78,;-6.09,-4.78,;-5.32,-3.44,;-6.09,-2.11,;-5.06,-.96,;-3.65,-1.59,;-3.81,-3.12,;-2.32,-.82,;-2.32,.72,;-.98,1.49,;.35,.72,;.35,-.82,;-.98,-1.59,;1.68,-1.59,;1.68,-3.13,;3.02,-3.9,;4.35,-3.13,;5.68,-3.9,;7.02,-3.13,;7.02,-1.59,;8.35,-3.9,;9.68,-3.13,;10.62,-1.91,;12.15,-1.71,;12.32,.52,;11.49,-.78,;11.21,-2.93,;12.63,-3.52,;13.57,-2.3,;4.35,-1.59,;3.02,-.82,;-.98,3.03,;-2.32,3.8,;-2.32,5.34,;-.98,6.11,;.35,5.34,;.35,3.8,;-8.4,-6.11,;-9.93,-6.11,)|
CC(C)Oc1ccc(cc1F)-c1nn([C@H](C)c2oc3ccc(F)cc3c(=O)c2-c2cccc(F)c2)c2ncnc(N)c12 |r|
CCNC(=O)Nc1ccc(cn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
COCCNC(=O)Nc1ccc(cn1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
Cn1c2ccc3ccc4ccc(n(C)c1=O)c2c34
CC(C)(C)c1nc2c(nc(nc2n1CCO)-c1cccc2[nH]ccc12)N1CCOCC1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2nc(n(CCO)c2n1)C(C)(C)C
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCCN1CCOCC1
Cn1c2cc(ccc2n2nccc2c1=O)C(=O)NCCN1CCOCC1
O=C(NCCN1CCOCC1)c1ccc2c(c1)n(Cc1ccccc1)c(=O)c1ccnn21
Fc1ccc(Cn2c3cc(ccc3n3nccc3c2=O)C(=O)NCCN2CCOCC2)cc1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCCCN1CCOCC1
CCNC(=O)c1ccc2c(c1)n(CC)c(=O)c1ccnn21
CCNC(=O)c1ccc2c(c1)n(CCCN(C)C)c(=O)c1ccnn21
CNC(=O)c1ccc2c(c1)n(CCCN(C)C1CCCCC1)c(=O)c1ccnn21
CCNC(=O)c1ccc2c(c1)n(CCOC)c(=O)c1ccnn21
CCNC(=O)c1ccc2c(c1)n(CCN1CCCCC1)c(=O)c1ccnn21
CCNC(=O)c1ccc2c(c1)n(Cc1ccccc1)c(=O)c1ccnn21
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cccnc1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)N1CCN(C)CC1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)N1CCN(CC1)c1ccccc1
CN1CCC(CC1)N1CCN(CC1)C(=O)c1ccc2c(c1)[nH]c(=O)c1ccnn21
O=C(N1CCN(CC1)C1CCCC1)c1ccc2c(c1)[nH]c(=O)c1ccnn21
CCCCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cccnc1
O=C(NCc1cccnc1)c1ccc2c(c1)n(CC1CC1)c(=O)c1ccnn21
FC(F)(F)Oc1ccc(Cn2c3cc(ccc3n3nccc3c2=O)C(=O)NCc2cccnc2)cc1
CS(=O)(=O)c1ccc(Cn2c3cc(ccc3n3nccc3c2=O)C(=O)NCc2cccnc2)cc1
CC(C)(C)c1ccc(Cn2c3cc(ccc3n3nccc3c2=O)C(=O)NCc2cccnc2)cc1
FC(F)(F)c1ccc(Cn2c3cc(ccc3n3nccc3c2=O)C(=O)NCc2cccnc2)cc1
CCn1c2cc(ccc2n2nc(C)cc2c1=O)C(=O)NCc1cccnc1
CCn1c2cc(ccc2n2nc(cc2c1=O)C(C)C)C(=O)NCc1cccnc1
CCn1c2cc(ccc2n2cccc2c1=O)C(=O)NCc1cccnc1
[H][C@@]12CCCN1c1ccc(cc1N(CC)C2=O)C(=O)NCc1cccnc1 |r|
[H][C@]12CCCN1c1ccc(cc1N(CC)C2=O)C(=O)NCc1cccnc1 |r|
CCN1C(=O)C2CCCCN2c2ccc(cc12)C(=O)NCc1cccnc1
CCn1c2cc(ccc2n2c(C)ncc2c1=O)C(=O)NCc1cccnc1
CCn1c2cc(ccc2n2ccnc2c1=O)C(=O)NCc1cccnc1
CCN1C(=O)N2CCN=C2c2ccc(cc12)C(=O)NCc1cccnc1 |c:8|
CCN1C(=O)N2CCCN=C2c2ccc(cc12)C(=O)NCc1cccnc1 |c:9|
CCN1C(=O)N2CC(C)(C)CN=C2c2ccc(cc12)C(=O)NCc1cccnc1 |c:11|
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCCc1cccnc1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cccnc1C
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cnccc1C
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cncc(C)c1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1ccc(C)nc1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1ccccn1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1ccncc1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cncnc1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cnccn1
CCn1c2cc(ccc2n2nccc2c1=O)C(=O)NCc1cnn(C)c1
CCn1c2cc(C(=O)NCc3cccnc3)c(N)cc2n2nccc2c1=O
CCn1c2cc(C(=O)NCc3cncnc3)c(N)cc2n2nccc2c1=O
CCn1c2cc(C(=O)NCc3cccnc3)c(NC)cc2n2nccc2c1=O
CCn1c2cc(C(=O)NCc3cccnc3)c(cc2n2nccc2c1=O)N(C)C
CCn1c2cc(C(=O)NCc3cncnc3)c(NC(C)=O)cc2n2nccc2c1=O
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1 |t:18|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1
Nc1cc(c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1)C(F)(F)F |t:15|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1)C(F)(F)F
Nc1ncc(-c2nc(nc(n2)C2=CCOCC2)N2CCOCC2)c(n1)C(F)F |t:12|
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)C2CCOCC2)c(n1)C(F)F
Nc1ncc(-c2nc(nc(n2)C2=CCOCC2)N2CCOCC2)c(n1)C(F)(F)F |t:12|
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)C2CCOCC2)c(n1)C(F)(F)F
Nc1ncc(cc1C(F)(F)F)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1 |t:19|
Nc1ncc(cc1C(F)(F)F)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1
Nc1cnc(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1 |t:15|
Nc1cnc(cn1)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1=CCOCC1 |r,t:26|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1=CCOCC1 |r,t:26|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1CCOCC1 |r|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1=CCOCC1 |r,t:27|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1CCOCC1 |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1C2CCC1COC2 |t:18|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)C1CCOCC1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCCCC1 |t:18|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCCCC1)C1CCOCC1
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc3OCOc3c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1cccc(c1)S(C)(=O)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1ccccn1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cscn1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccn[nH]1 |r|
O=C1NC(=O)\C(S1)=C\c1ccc2nccc(-c3ccncc3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncc(C#N)c(N3CCOCC3)c2c1
CC(C)(C#N)c1ccc(cc1)N1C(=O)OCc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOC[C@@H]4C)c32)N2CCOC[C@@H]2C)c(O)cc1O |r|
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3cccc(Cl)c3)cc2)c(O)cc1O
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2)c(O)cc1O
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2)c(O)cc1O
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3ccc(F)c(Cl)c3)cc2)c(O)cc1O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C(=O)NCCN3CCOCC3)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)C(=O)NCCN(C)C
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)C(=O)NCCc1ccccc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)C(=O)NCc1cn(CCCN2CCOCC2)nn1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)C(=O)NCc1cn(CCN2CCOCC2)nn1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)-c1cn(CCN2CCOCC2)nn1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)-c1cn(CCN(C)C)nn1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)-c1cn(CCN2CCN(C)CC2)nn1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cn2c(cnc2cn1)-c1cn(CCN2CCCC2)nn1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C(=O)NCCc3ccccc3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C(=O)NCc3cn(CCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C(=O)NCc3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCN(C)C)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCN4CCN(C)CC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCN4CCCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCCN4CCCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCCN4CCN(C)CC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCCN4CCCCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)cc1F)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cncc(c1)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(CC(F)(F)F)cc1)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1N)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3nnc(CCN4CCN(C)CC4)o3)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(Oc2ccc(cc2)\N=N/c2ccc(Oc3cc(cc4c(C)ncnc34)-c3cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c3)cc2)c2ncnc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(Oc2ccc(cc2)\N=N\c2ccc(Oc3cc(cc4c(C)ncnc34)-c3cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c3)cc2)c2ncnc(C)c2c1
COc1cc(COc2ccc3cc(CN(c4cc(cnc4OC)-c4cc(OC5CCOCC5)c5ncnc(C)c5c4)S(=O)(=O)c4ccc(F)cc4F)c(=O)oc3c2)c(cc1OC)[N+]([O-])=O
COc1ncc(cc1N(Cc1cc2ccc(O)cc2oc1=O)S(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2ncnc(C)c2c1
COc1cc(COC(=O)n2ncc3cc(cnc23)-c2cnc(Cl)c(NS(=O)(=O)c3ccccc3)c2)c(cc1OC)[N+]([O-])=O
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NC(=O)CCCC(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NC(=O)CCCCC(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NC(=O)CCCCCCC(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NC(=O)c2ccc(cc2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NC(=O)Cc2ccc(cc2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NC(=O)c2ccc(cn2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)Nc2ccc(cn2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)Nc2ncc(cn2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NS(=O)(=O)c2ccc(cc2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
Cc1nc(NC(=O)N2C[C@@H](C[C@H]2C(N)=O)NS(=O)(=O)Cc2ccc(cc2)C(=O)NO)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F |r|
COCCSC(=S)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2c(OC)cccc12)C(F)F)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCCN(C)C)N1CCOCC1
CCN(CC)CCSC(=S)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2c(OC)cccc12)C(F)F)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCCN1CCCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCCN1CCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCCN1CCOCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCCN1CCN(C)CC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(N)=O)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)N(C)C)N1CCOCC1
CCN(CC)C(=O)CSC(=S)N1CCN(CC1)c1nc(nc(n1)-n1c(nc2c(OC)cccc12)C(F)F)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCOCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCN(C)CC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCN(CC1)S(C)(=O)=O)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCN(CC1)C1CCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CCCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(nc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)N(C)C)N1CCOCC1
CCN(CC)C(=O)CSC(=S)N1CCN(CC1)c1cc(nc(n1)-n1c(nc2c(OC)cccc12)C(F)F)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)N1CCOCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CCCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CCCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CCC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(=O)NC1CC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCCN(C)C)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCCN1CCN(C)CC1)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCCN1CCOCC1)N1CCOCC1
COCCSC(=S)N1CCN(CC1)c1cc(nc(n1)-n1c(nc2c(OC)cccc12)C(F)F)N1CCOCC1
COc1cccc2n(c(nc12)C(F)F)-c1nc(cc(n1)N1CCN(CC1)C(=S)SCC(N)=O)N1CCOCC1
Cc1ccccc1Nc1ncc(cc1NC(=O)c1csc2ccccc12)C(=O)NC1C[S+]([O-])C1 |(6.4,-4.16,;5.07,-4.93,;5.07,-6.46,;3.73,-7.23,;2.41,-6.47,;2.4,-4.93,;3.74,-4.16,;3.74,-2.62,;2.4,-1.85,;1.08,-2.61,;-.26,-1.85,;-.26,-.31,;1.07,.46,;2.4,-.31,;3.74,.46,;3.74,2,;2.4,2.77,;5.07,2.77,;6.48,2.15,;7.51,3.29,;6.74,4.63,;7.21,6.1,;6.18,7.23,;4.68,6.91,;4.21,5.45,;5.23,4.31,;-1.59,.46,;-1.59,2,;-2.93,-.31,;-4.26,.46,;-5.77,.06,;-6.17,1.55,;-7.51,2.32,;-4.66,1.95,)|
COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1NC(=O)CCC(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
Clc1ccc(cc1)-c1nc(N\N=C\c2cccc(Cl)c2)nc(N2CCOCC2)c1C#N
Oc1cccc(\C=N\Nc2nc(N3CCOCC3)c(C#N)c(n2)-c2ccc(Cl)cc2)c1
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCCCC1 |r|
C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cn2c1nc(N1CCC(F)(F)CC1)c(C#N)c2=O |r|
CC1(CCn2nc(-c3ccc(Cl)c(O)c3)c3c(N)ncnc32)COC1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3)ncc21
Cc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
Cc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
Cc1ccccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
COc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
COc1ccccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(Cl)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(Cl)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3Cl)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc([N+](=O)[O-])cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc([N+](=O)[O-])c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3[N+](=O)[O-])ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(N)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(N)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3N)ncc21
CC(=O)Nc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
CC(=O)Nc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
CC(=O)Nc1ccccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(C#N)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(C#N)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3C#N)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(C(F)(F)F)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(C(F)(F)F)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3C(F)(F)F)ncc21
CC(=O)c1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
CC(=O)c1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(S(C)(=O)=O)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(S(C)(=O)=O)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3S(C)(=O)=O)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(OCc4ccccc4)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(OCc4ccccc4)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3OCc3ccccc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(O)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(O)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3O)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(C(C)(C)C#N)cc3)ncc21
Cc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C)c1
Cc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1C
Cc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1C
Cc1c(Cl)cccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(Cl)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1ccc(Cl)cc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(S(C)(=O)=O)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1ccc(S(C)(=O)=O)cc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(C#N)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C)c1
COc1ccc(C)c(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
Cc1cc(O)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(F)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(OC(F)(F)F)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(OC(F)F)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
CCOc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C)c1
Cc1cc(OCCN(C)C)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(N2CCOCC2)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(N2CCN(C)CC2)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C(F)(F)F)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C#N)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(Cl)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(OC)c1
COc1ccc(N(C)c2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C)c1
COCCn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(OC)cc3C)ncc21
COc1ccc(Nc2cc3c(cn2)n(CCOCc2ccccc2)c(=O)n3C2CCCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(CCO)c(=O)n3C2CCCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C(C)C)c(=O)n3C2CCCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C2CCCC2)c(=O)n3C2CCCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(Cc2ccccc2)c(=O)n3C2CCCC2)c(C)c1
COCCn1c(=O)n(C)c2cnc(Nc3ccc(OC)cc3C)cc21
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2COC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCOC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCOCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3CC2CCOCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3CCC2CCOCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(OC)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(OCc3ccccc3)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(O)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3-c2ccccc2)c(C)c1
COc1ccc(-n2c(=O)n(C)c3cnc(Nc4ccc(OC)cc4C)cc32)cc1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3-c2ccc(OCc3ccccc3)cc2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3-c2ccc(O)cc2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3-c2ccc(C(C)(C)C#N)cc2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCNCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3CC2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3CC2CCNCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(NC(=O)OC(C)(C)C)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(N)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCN(C)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3CC2CCN(C)CC2)c(C)c1
COc1ccc(N(C(=O)OCc2ccccc2)c2cc3c(cn2)n(C)c(=O)n3C2CCOCC2)c(C)c1
COc1ccc(nn1)[C@@H](O)c1cc(c(F)cc1Cl)-c1ncnc2cc(ccc12)N1CCOCC1 |r|
C[C@H](Nc1nc(N)nc(N)c1C#N)c1cn(-c2cccnc2)c2cc(Cl)cnc12
CC(Nc1nc(N)nc(N)c1C#N)c1cn(-c2cccnc2)c2cc(Cl)cnc12
C[C@@H](Nc1nc(N)nc(N)c1C#N)c1cn(-c2cccnc2)c2cc(Cl)cnc12
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O
c1cc(ccc1Oc2ccc(cc2Cl)NC(=O)c3cc(cc(c3O)I)I)Cl
c1c(cc(c(c1O)O)O)C2=C(C(=O)c3c(cc(cc3O2)O)O)O
C\C=C1/NC(=O)[C@H]2CSSCC\C=C\[C@H](CC(=O)N[C@H](C(C)C)C(=O)N2)OC(=O)[C@@H](NC1=O)C(C)C |r,t:12|
[H][C@]12CC(=O)N[C@H](C(C)C)C(=O)N[C@]([H])(CSSCC\C=C\1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)O2 |r,t:20|
CC(C)[C@H]1NC(=O)C[C@H]2/C=C/CCSSC[C@@H](NC1=O)C(=O)N[C@H](Cc1cccc3ccccc13)C(=O)NCC(=O)O2
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCN(CCOCCOCCOCCONC(=O)c2ccc(F)c(F)c2Nc2ccc(I)cc2F)CC1)N1CCOCC1
CCOC(=O)c1nn(-c2ccccc2)c(=O)c2c(N)c(C#N)c(-c3cccs3)cc12
O=C(Nc1ncc2ncc(-c3cn[nH]c3)cc2n1)NC1CCCC1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(F)cc1F
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccccc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(-c2ccccc2)cc1
COc1ccc(/N=N/c2cc(-c3cc(OC4CCOCC4)c4ncnc(C)c4c3)cnc2OC)cc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(F)cc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1cccc(F)c1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccccc1F
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccccc1Cl
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccccc1Br
COc1ccccc1/N=N/c1cc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cnc1OC
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccccc1-c1ccccc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(Cl)cc1F
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(Cl)cc1Cl
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(F)cc1Cl
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=N/c1ccc(F)cc1Br
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(F)cc1F
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccccc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(-c2ccccc2)cc1
COc1ccc(/N=Nc2cc(-c3cc(OC4CCOCC4)c4ncnc(C)c4c3)cnc2OC)cc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(F)cc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1cccc(F)c1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccccc1F
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccccc1Cl
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccccc1Br
COc1ccccc1/N=Nc1cc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cnc1OC
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccccc1-c1ccccc1
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(Cl)cc1F
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(Cl)cc1Cl
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(F)cc1Cl
COc1ncc(-c2cc(OC3CCOCC3)c3ncnc(C)c3c2)cc1/N=Nc1ccc(F)cc1Br
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
Cc1c(CN2CCN(C(=O)[C@H](C)O)CC2)sc2c(N3CCOCC3)nc(N)nc12
O=C1NC(=O)C(Cc2ccc3nccc(-c4ccncc4)c3c2)S1
c1cc(-c2ccnc3ccc(-c4cnc5[nH]ncc5c4)cc23)ccn1
Nc1ncc(-c2ccc3nccc(-c4ccncc4)c3c2)cc1S(N)(=O)=O
O=S(=O)(Nc1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1)c1ccccc1F
COc1ccc(-c2cc(OCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ccc(-c2cc(OCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ccc(-c2cc(OCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ccc(-c2cc(OCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ccc(-c2cc(OCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ccc(-c2cc(OCCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ccc(-c2cc(OCCCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cn1
COc1ncc(-c2cc(OCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ccc(-c2cc(OCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cn1
COc1ncc(-c2cc(OCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ccc(-c2cc(OCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cn1
COc1ncc(-c2cc(OCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ccc(-c2cc(OCCOc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cn1
COc1ncc(-c2cc(OCCOc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCOc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ccc(-c2cc(OCCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cn1
COc1ncc(-c2cc(OCCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ccc(-c2cc(OCCCOc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cn1
COc1ncc(-c2cc(OCCCOc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1F
COc1ncc(-c2cc(OCCCOc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
Cc1nn(C(C)c2nn(-c3cccnc3)c3cc(Cl)ccc23)c2ncnc(N)c12
CCC(c1nn(-c2cccnc2)c2cc(Cl)ccc12)n1nc(C)c2c(N)ncnc21
Cc1nn(C(C)c2nn(-c3cccc(C(N)=O)c3)c3cc(Cl)ccc23)c2ncnc(N)c12
CNC(=O)c1cccc(-n2nc(C(C)n3nc(C)c4c(N)ncnc43)c3ccc(Cl)cc32)c1
Cc1nn(C(C)c2nn(-c3cccc(S(C)(=O)=O)c3)c3cc(Cl)ccc23)c2ncnc(N)c12
Cc1nn(C(C)c2nn(-c3ccc(C(N)=O)cc3)c3cc(Cl)ccc23)c2ncnc(N)c12
Cc1nn(C(C)c2nn(-c3ccc(S(C)(=O)=O)cc3)c3cc(Cl)ccc23)c2ncnc(N)c12
Cc1nn(C(C)c2nn(-c3ccncc3)c3cc(Cl)ccc23)c2ncnc(N)c12
CCc1nn(C(C)c2nn(-c3cccnc3)c3cc(Cl)ccc23)c2ncnc(N)c12
CCc1nn(C(C)c2nn(-c3ccncc3)c3cc(Cl)ccc23)c2ncnc(N)c12
Cc1nn([C@@H](C)c2nn(-c3ccncc3)c3cc(Cl)ccc23)c2ncnc(N)c12
Cc1nn([C@H](C)c2nn(-c3ccncc3)c3cc(Cl)ccc23)c2ncnc(N)c12
CC(C)(C)OC(=O)N1Cc2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc2C1=O
CC(C)(C)OC(=O)N1Cc2ccc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)cc2C1=O
CC(C)(C)OC(=O)N1C(=O)c2ccc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)cc2C1=O
CC(C)(C)OC(=O)N1Cc2ccc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)cc2C1
CN1Cc2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc2C1=O
CN(C)CCN1Cc2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc2C1=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)C(=O)OC2
CC1OC(=O)c2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc21
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)CNC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)C(=O)NC2
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)C(=O)NC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)CNC2
C[C@H]1COCCN1c1nc(-c2ccc(NC(=O)Nc3ccc4c(c3)COC4=O)cc2)nc(N2CCOCC2)n1
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCO[C@@H](CO)C3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCO[C@H](CO)C3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3C4CCC3COC4)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3C4CCC3COC4)nc(N3C4CCC3COC4)n2)cc1)Nc1ccc2c(c1)COC2=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cn[nH]c3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc[nH]n3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3ncnn3C)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3ccncc3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3ccncn3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3ncccn3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cnccn3)cc1-2)C(N)=O
Cc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(C(F)(F)F)ncn3)cc1-2)C(N)=O
COc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(N)ncn3)cc1-2)C(N)=O
CNc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
CCNc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
CCCNc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(NC4CC4)ncn3)cc1-2)C(N)=O
CC(C)Nc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(NC(C)(C)C)ncn3)cc1-2)C(N)=O
CC(C)CNc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(N(C)C)ncn3)cc1-2)C(N)=O
CCN(CC)c1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
CCN(C)c1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(N4CCCCC4)ncn3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(N4CCOCC4)ncn3)cc1-2)C(N)=O
C[C@H](Oc1ccc2c(c1)OCc1ccc(-c3cc(NCCN(C)C)ncn3)cc1-2)C(N)=O
COCCNc1cc(-c2ccc3c(c2)-c2ccc(O[C@@H](C)C(N)=O)cc2OC3)ncn1
O=C(O)COc1ccc2c(c1)oc(=O)c1ccc(-c3cnc(Cl)c(NS(=O)(=O)c4ccc(F)cc4)c3)cc12
CN1CCN(CCC(=O)Nc2ccc3Sc4c(Sc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)CC1
COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
Cn1c(=O)n(C(C)(C)C#N)c2c3cc(-c4cnc5ccccc5c4)ccc3ncc21
COc1cc(-c2ccn3nc(N)c(-c4cnn(C)c4)c3n2)cnc1OC
CCn1cc(-c2c(N)nn3ccc(-c4cnc(OC)c(OC)c4)nc23)cn1
COc1cc(-c2ccn3nc(N)c(-c4cnn(C(C)C)c4)c3n2)cnc1OC
COc1cc(-c2ccn3nc(N)c(-c4cn(C)nc4C)c3n2)cnc1OC
COc1cc(-c2ccn3nc(N)c(-c4cnn(C(F)F)c4)c3n2)cnc1OC
COc1cc(-c2ccn3nc(N)c(-c4cnn(CC(F)F)c4)c3n2)cnc1OC
COCCn1cc(-c2c(N)nn3ccc(-c4cnc(OC)c(OC)c4)nc23)cn1
COc1cc(-c2ccn3nc(N)c(-c4cncs4)c3n2)cnc1OC
COc1cc(-c2ccn3nc(N)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCOc4ccccc4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCOc4ccccc4)c(-c4cnn(C)c4)c3n2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3n2)cnc1OC
CCOCCNC(=O)Nc1cc2nc(-c3cnc(OC)c(OC)c3)ccn2n1
COc1cc(-c2ccn3nc(NC(=O)NCCOC(C)C)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCOCC4CC4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCN4CCOCC4)cc3n2)cnc1OC
COc1cc(-c2ccc3nc(NC(=O)NCCOc4cccnc4)nn3c2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)nc3c2)cnc1OC
COc1cc(-c2ccc3nc(NC(=O)NCCOc4cccnc4)cn3n2)cnc1OC
COc1cc(-c2ccc3[nH]c(NC(=O)NCCOc4cccnc4)nc3c2)cnc1OC
COc1cc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cnc1OC
CCOc1cc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cnc1OC
COc1ncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cc1OC(C)C
COc1ncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cc1F
COc1ncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cc1C(F)(F)F
COc1ncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cc1OC(F)F
COc1ncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cc1NS(C)(=O)=O
COc1ccc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cn1
Cc1cncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)c1
O=C(NCCOc1cccnc1)Nc1cc2cc(-c3cncc(F)c3)ccn2n1
O=C(NCCOc1cccnc1)Nc1cc2cc(-c3cncc(OC(F)F)c3)ccn2n1
CCOc1cc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cnc1OCC
O=C(NCCOc1cccnc1)Nc1cc2cc(-c3cnc4c(c3)OCCO4)ccn2n1
COc1ccc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)cc1OC
COc1ncc(-c2ccn3nc(NC(=O)NCCOc4cccnc4)cc3c2)nc1OC
O=C(O)CNc1nc(-c2cccc(O)c2)nc(N2CCOCC2)n1
CNC(=O)c1cccc(Nc2nc(-c3cccc4[nH]ncc34)nc(N3CCOCC3)n2)c1
CN(C)C(=O)C1CCC(Oc2nc(-c3cccc4[nH]ncc34)nc(N3CCOCC3)n2)CC1
Nc1ncc(-c2nc(-c3ccc(CN4CCOCC4)s3)nc(N3CCOCC3)n2)cn1
CS(=O)(=O)N1CCN(Cc2ccc(-c3nc(-c4cnc(N)nc4)nc(N4CCOCC4)n3)s2)CC1
CNC(=O)Nc1ncc(-c2nc(-c3ccc(CN4CCN(S(C)(=O)=O)CC4)s3)nc(N3CCOCC3)n2)cn1
COc1ncc(-c2ccc3nccc(C(=O)NCCCCC(=O)NO)c3c2)cc1NS(=O)(=O)c1cc(F)cc(F)c1
COc1ncc(-c2ccc3nccc(C(=O)NCCCCCC(=O)NO)c3c2)cc1NS(=O)(=O)c1cc(F)cc(F)c1
COc1ncc(-c2ccc3ncc(C(=O)NCCCCCCC(=O)NO)cc3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CCc1nc2c([C@@H](C)Nc3ccc(Cl)nc3C(=O)O)cc(C)cc2c2nccn12
CCc1nc2c([C@@H](C)Nc3ccc(Cl)nc3C(=O)O)cc(C)cc2c2nc(C)cn12
CCc1cn2c(CC)nc3c([C@@H](C)Nc4ccc(Cl)nc4C(=O)O)cc(C)cc3c2n1
CCc1nc2c([C@@H](C)Nc3ccc(Cl)nc3C(=O)O)cc(C)cc2c2nncn12
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CCC(C)(C)CC3)n3cnnc3c2c1
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3Cc4ccccc4C3)n3cnnc3c2c1
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CCC(C)(C)C3)n3cnnc3c2c1
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CC(C)(C)C3)n3cnnc3c2c1
Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CCC(F)(F)CC3)n3cnnc3c2c1
C[C@@H](Nc1ccccc1C(=O)O)c1cc(F)cc2c1nc(N1CCC(F)(F)CC1)n1cnnc21
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CCC(C)(C)CC3)n3ncnc3c2c1
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CCC(C)(C)CC3)n3nnnc3c2c1
Cc1cc(C(C)Nc2ccc(Cl)nc2C(=O)O)c2nc(-c3cccc(C#N)c3)n3cnnc3c2c1
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(-c3cc(F)cc(F)c3)n3cnnc3c2c1
Cc1ccc(Oc2nc3c(C)ccc(C)c3cc2C2NC(=O)c3ccccc3N2)cc1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]nc(-c3ccncc3)c2c1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4ccncc4)c3c2)cnc1Cl)c1ccc(F)cc1
O=S(=O)(Nc1cc(-c2cnc3[nH]cc(-c4ccc(N5CCOCC5)nc4)c3c2)cnc1Cl)c1ccccc1
O=S(=O)(Nc1cc(-c2cnc3[nH]cc(-c4cnn(CCN5CCOCC5)c4)c3c2)cnc1Cl)c1ccccc1
Nc1nc2ccc(-c3ccc4ncc(C(=O)N5CCO[C@@H](CO)C5)n4c3)cc2o1
COC1CCN(C(=O)c2cnc3ccc(-c4ccc5oc(N)nc5c4)cn23)C1
CN(C)C1CCN(C(=O)c2cnc3ccc(-c4ccc5oc(N)nc5c4)cn23)C1
Nc1nc2cc(-c3ccc4ncc(C(=O)N5C[C@@H]6OCCO[C@@H]6C5)n4c3)ccc2o1
Nc1nc2cc(-c3ccc4ncc(C(=O)N5C[C@H]6OCCO[C@@H]6C5)n4c3)ccc2o1
C[C@H](NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)C(N)=O
C[C@@H](NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)C(N)=O
C[C@H](NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)C(=O)O
CCOC(=O)[C@H](C)NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12
CCC(NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)C(=O)OC
NC(=O)C(NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)c1ccccc1
NC(=O)[C@@H](NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)c1ccccc1
NC(=O)[C@H](NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12)c1ccccc1
NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12
NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cnc2ccc(-c3ccc4oc(N)nc4c3)cn12
C[C@H](Nc1ncnc2ccc(-c3ccc4oc(N)nc4c3)cc12)C(N)=O
NC(=O)CNc1ncnc2ccc(-c3ccc4oc(N)nc4c3)cc12
Nc1nc2cc(-c3ccc4ncc(N5C[C@@H]6OCCO[C@@H]6C5)nc4c3)ccc2o1
C[C@H](Nc1cnc2ccc(-c3ccc4oc(N)nc4c3)cc2n1)C(N)=O
NC(=O)CNc1cnc2ccc(-c3ccc4oc(N)nc4c3)cc2n1
Nc1nc2cc(-c3ccc4ncc(N5C[C@@H]6OCCO[C@H]6C5)nc4c3)ccc2o1
Nc1nc2cc(-c3ccc4nc(N5C[C@@H]6OCCO[C@@H]6C5)cnc4c3)ccc2o1
NC(=O)CNc1cnc2cc(-c3ccc4oc(N)nc4c3)ccc2n1
Nc1nc2cc(-c3ccc4ncc(NCC(=O)NO)nc4c3)ccc2o1
COc1cc(-c2ccn3nc(Nc4ccccn4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccnc4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4ccncc4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(N)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CN)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(C)=O)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(Cn5cnc(C)c5)n4)cc3n2)cnc1OC
CCc1nccn1Cc1cccc(Nc2cc3nc(-c4cnc(OC)c(OC)c4)ccn3n2)n1
COc1cc(-c2ccn3nc(Nc4cccc(CN5CCN(C)C5=O)n4)cc3n2)cnc1OC
CCC(=O)NCc1cccc(Nc2cc3nc(-c4cnc(OC)c(OC)c4)ccn3n2)n1
COCC(=O)NCc1cccc(Nc2cc3nc(-c4cnc(OC)c(OC)c4)ccn3n2)n1
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)C5CC5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)C5CCCC5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)C5CCCCC5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)C(F)F)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)CC(F)F)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccccc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccccn5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccoc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccco5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5cn(C)cn5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccc(OC(C)C)cc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccc(OC(F)(F)F)cc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccc(C(F)(F)F)cc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)CCc5ccccc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccccc5F)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5cccc(F)c5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5ccc(F)cc5)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5c(F)cccc5F)n4)cc3n2)cnc1OC
COc1cc(OC)cc(C(=O)NCc2cccc(Nc3cc4nc(-c5cnc(OC)c(OC)c5)ccn4n3)n2)c1
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5cccc6c5OCO6)n4)cc3n2)cnc1OC
COc1cc(-c2ccn3nc(Nc4cccc(CNC(=O)c5cccc6c5OCCO6)n4)cc3n2)cnc1OC
COc1nc(-c2ccc(NC(=O)Nc3ccc(C(=O)Nc4ccc(F)c(F)c4N)cc3)cc2)nc(N2CCOCC2)n1
Nc1ccccc1NC(=O)CNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCCCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
COc1nc(-c2ccc(NC(=O)Nc3ccc(C(=O)NCCCCCC(=O)Nc4ccccc4N)cc3)cc2)nc(N2CCOCC2)n1
Nc1ccccc1NC(=O)CCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(OC4COC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1cc(F)ccc1NC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1c(NC(=O)c2ccc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)cc2)ccc(F)c1F
Nc1ccccc1NC(=O)CCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(N4CCOCC4)nc(N4CCOCC4)n3)cc2)cc1
COc1nc(-c2ccc(NC(=O)Nc3ccc(C(=O)Nc4ccccc4N)cc3)cc2)nc(N2CCOCC2)n1
COc1nc(-c2ccc(NC(=O)Nc3ccc(C(=O)NCCCCCCC(=O)Nc4ccccc4N)cc3)cc2)nc(N2CCOCC2)n1
Nc1ccccc1NC(=O)CCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(OC4COC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(OC4COC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(OC4CCOC4)nc(N4CCOCC4)n3)cc2)cc1
Nc1ccccc1NC(=O)CCCCCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(OC4CCOC4)nc(N4CCOCC4)n3)cc2)cc1
CNCCNC(=O)c1ccc(NC(=O)Nc2ccc(-c3nc(OC)nc(N4CCOCC4)n3)cc2)cc1
CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N
Nc1ccc(cn1)C(=O)Nc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(NC(=O)c3ccc(C)c(OC)c3)cc2)cc(OC)c1
C=CCN(/C=C1/C(=O)O[C@H](COC)[C@@]2(C)C1=C(O)C(=O)C1=C2[C@H](OC(C)=O)C[C@]2(C)C(=O)CC[C@@H]12)CC=C
COc1cccc2cc(-c3nc([C@H]4CC[C@H](C(=O)O)CC4)n4ncnc(N)c34)[nH]c12
Nc1nccn2c1c(-c1cc3cccc(Cl)c3[nH]1)nc2[C@H]1CC[C@H](C(=O)O)CC1
c1ccc(-c2ccc3nccc(-c4ccncc4)c3c2)cc1
c1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1
c1cc(-c2ccnc3ccc(-c4ccc5[nH]ncc5c4)cc23)ccn1
Nc1ncc(-c2ccc3nccc(-c4ccncc4)c3c2)cc1S(=O)(=O)Nc1ccc(F)cc1F
O=S(=O)(Nc1ccc(F)cc1F)c1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1
O=S(=O)(Nc1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1)c1ccc(F)cc1F
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
CCc1cc(Nc2nccc(n2)-c2c(nc3ccccn23)-c2ccc(OC)c(c2)C(=O)Nc2c(F)cccc2F)c(OC)cc1N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O
c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)N3CC(C3)([C@@H]4CCCCN4)O
Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CCOCC3)cc(=O)n2c1
CC(=O)Nc1nc(C)c(-c2cnc(Cl)c(NS(C)(=O)=O)c2)s1
CC(C)(O)CNc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccnc(Cl)c2)n1
CN1c2ccsc2C(=O)N(c3c1nc(nc3)Nc4ccc(cc4)S(=O)(=O)N)C
CCC(=O)N1CCN(c2ccc(N3C(=O)CCc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc2C(F)(F)F)CC1
Nc1ncc(c(CC2CC2)n1)-c1ccnc(Nc2ccncc2)n1