454 SMILES Strings for Cyclic GMP-AMP synthase

Compound Name
SMILES String
CC(=O)N1CC(C1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CC(=O)N1CCN(Cc2nc3c(cc(cc3[nH]2)-c2ccc(C)cc2Cl)C(O)=O)CC1
CC(=O)N1CCOC(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)C1
CC(=O)N1CCOC(CCN2CCn3c(c(-c4cn[nH]c4)c4c(OCC#N)cc(Cl)c(Cl)c34)C2=O)C1
CC(=O)N1CCOCC1C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NC(=O)C(F)(F)F)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NC(=O)C(F)F)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NC(=O)CO)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NCC#N)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NCCCO)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC(N)=O)cc(Cl)c(Cl)c21
CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CC(=O)NC1CCCn2c1c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
CC(=O)NC1CCCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CC(=O)NC1CCc2c(-c3cn[nH]c3)c3c(OCC#N)cc(Cl)c(Cl)c3n2C1
CC(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CC(=O)NC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CC(=O)NC1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CC(=O)NCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)cc(-c4ccn(C)n4)c3c2C1
CC(=O)NCC(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CC(=O)NCC(=O)NC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CC(=O)NCC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
CC(=O)NCCS(=O)(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CC(=O)NCCn1cc(-c2cn[nH]c2)c2c(OCC#N)cc(Cl)c(Cl)c12
CC(=O)NCc1[nH]c2c(Cl)c(Cl)cc(OCC#N)c2c1-c1cn[nH]c1
CC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
CC(=O)NCc1c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c2n1C
CC(=O)N[C@@H]1CCn2c1c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21 |r|
CC(=O)N[C@H]1CCn2c1c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21 |r|
CC(=O)N[C@H]1Cc2c(-c3cn[nH]c3)c3c(NC(=O)C(F)F)cc(Cl)c(Cl)c3n2C1 |r|
CC(=O)N[C@H]1Cc2c(-c3cn[nH]c3)c3c(OCC#N)cc(Cl)c(Cl)c3n2C1 |r|
CC(=O)Nc1cc(Cl)c(Cl)c2[nH]c(CNC(=O)CO)c(-c3cn[nH]c3)c12
CC(=O)Nc1cc(Cl)c(Cl)c2[nH]c(CO)c(-c3cn[nH]c3)c12
CC(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
CC(=O)Nc1cc(Cl)c(Cl)c2n(cc(-c3cn[nH]c3)c12)-c1cn(CCO)nn1
CC(=O)Nc1cc(Cl)cc2n(cc(-c3cn[nH]c3)c12)-c1cn(CCO)nn1
CC(=O)OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |t:10|
CC(=O)OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1ccc(Cl)cc1C=O |t:10|
CC(=O)OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1ccc(cc1C=O)C(F)(F)F |t:10|
CC(=O)OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1cccc(Cl)c1C=O |t:10|
CC(=O)OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1ccccc1C=O |t:10|
CC(=O)OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2ccccc12 |t:10|
CC(=O)OCC(=O)N1CCC2Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2ccccc12
CC(=S)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
CC(=S)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
CC(C)(O)C(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CC(CO)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
CC(CO)COc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
CC(Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12)C#N
CCC(=O)NC(C)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CCC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12
CCN(CC)Cc1nc2c(cc(cc2[nH]1)-c1ccc(C)cc1Cl)C(O)=O
CCN(CCO)CCCC(C)Nc1ccnc2cc(Cl)ccc12
CCN1C(CCC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CCN1CCn2c(c(-c3cn[nH]c3)c3c(NC(=O)C(F)F)cc(Cl)c(Cl)c23)C1=O
CCNC(=O)COCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CCNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
CCNc1cc(Cl)c(Cl)c2n3CCN(C)C(=O)c3c(-c3cn[nH]c3)c12
CCNc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)CO
CCNc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(C)=O
CCOC(=O)c1ccc(NC23CN(CCC2=Nc2c3ccc(Cl)c2Cl)C(=O)CO)cc1 |c:16|
CCOc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
CCOc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)CO
CCOc1cc(Cl)c(Cl)c2n3CCNCc3c(-c3cn[nH]c3)c12
CCOc1cc(Cl)c(Cl)c2n3CC[C@@H](NC(C)=O)c3c(-c3cn[nH]c3)c12 |r|
CCOc1cc(Cl)c(Cl)c2n3CC[C@H](NC(=O)CO)c3c(-c3cn[nH]c3)c12 |r|
CCOc1cc(Cl)c(Cl)c2n3CC[C@H](NC(C)=O)c3c(-c3cn[nH]c3)c12 |r|
CCOc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc[nH]c2c1
CCS(=O)(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
CC[C@H]1Cc2[nH]c3c(Cl)c(Cl)ccc3c2CN1C(=O)COC |r|
CN(C)C(=O)CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN(C)C(=O)CCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NC(=O)C(F)F)cc(Cl)c(Cl)c21
CN(C)C(=O)CCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
CN(C)C(=O)COC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN(C)C(=O)COCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN(C)C(=O)NCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN(C)C1(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)COC1
CN(C)C1OCC1C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN(C)CC(=O)N1CCc2[nH]c3c(Cl)c(Cl)cc(-c4ccn(C)n4)c3c2C1
CN(C)Cc1nc2c(cc(cc2[nH]1)-c1ccc(C)cc1Cl)C(O)=O
CN(CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21)C(C)=O
CN(CCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21)C(C)=O
CN(Cc1nc2c(cc(cc2[nH]1)-c1ccc(C)cc1Cl)C(O)=O)c1ccccc1
CN1C(=O)CN(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)cc32)C1=O
CN1C(=O)SC(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)C1=O
CN1C(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)CCC1=O
CN1C(CCC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1C(CCCC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CC(=O)N(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)C1=O
CN1CC(CC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
CN1CC(CC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CC(CCC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CCC(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)C1=O
CN1CCC(CC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CCN(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)C1=O
CN1CCN(Cc2nc3c(cc(cc3[nH]2)-c2ccc(C)cc2Cl)C(O)=O)C(=O)C1
CN1CCN(Cc2nc3c(cc(cc3[nH]2)-c2ccc(C)cc2Cl)C(O)=O)CC1
CN1CCOC(C1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
CN1CCOC(C1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CCOCC1C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CCOCC1CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CN1CCOC[C@@H]1CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21 |r|
CN1CCOC[C@H]1CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21 |r|
CN1CCO[C@H](C1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21 |r|
CN1CCn2c(c(-c3cn[nH]c3)c3c(NCC#N)cc(Cl)c(Cl)c23)C1=O
CN1CCn2c(c(-c3cn[nH]c3)c3c(NCCO)cc(Cl)c(Cl)c23)C1=O
CN1CCn2c(c(-c3cn[nH]c3)c3c(OCC#N)cc(Cl)c(Cl)c23)C1=O
CN1CCn2c(c(-c3cn[nH]c3)c3c(OCCCO)cc(Cl)c(Cl)c23)C1=O
CN1CCn2c(c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c23)C1=O
CN1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2CC1=O
CNC(=O)CC(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CNC(=O)CCS(=O)(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CNC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CNC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1
CNCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)cc(-c4ccn(C)n4)c3c2C1
CNCC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
CNNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
COC(=O)c1nc(N)nc(Nc2cc(F)c(I)c(F)c2)n1
COC1(CCOC1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCC(=O)N(C)CC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)cc(-c4ccn(C)n4)c3c2[C@@H]1C |r|
COCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)cc(-c4ccn(C)n4)c3c2[C@H]1C |r|
COCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)ccc3c2[C@@H]1C |r|
COCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)ccc3c2[C@H]1C |r|
COCC(=O)N1CCc2[nH]c3c(Cl)c(F)ccc3c2[C@H]1C |r|
COCC(=O)N1CCc2[nH]c3c(Cl)cc(Cl)cc3c2C1
COCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCC(=O)N1CCn2c(c(-c3cn[nH]c3)c3c(OCC#N)cc(Cl)c(Cl)c23)C1=O
COCC(=O)N1Cc2c(CC1Cc1ccccc1)[nH]c1c(Cl)c(Cl)ccc21
COCC(=O)N1Cc2c(C[C@@H]1C(C)C)[nH]c1c(Cl)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@@H]1C)[nH]c1c(Br)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@@H]1C)[nH]c1c(Cl)c(C)ccc21 |r|
COCC(=O)N1Cc2c(C[C@@H]1C)[nH]c1c(Cl)c(Cl)cc(-c3ccn(C)n3)c21 |r|
COCC(=O)N1Cc2c(C[C@@H]1C)[nH]c1c(Cl)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@@H]1C)[nH]c1c(F)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C(F)(F)F)[nH]c1c(Cl)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(Br)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(Cl)c(Br)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(Cl)c(Cl)cc(-c3ccn(C)n3)c21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(Cl)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(Cl)c(F)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(F)c(Br)ccc21 |r|
COCC(=O)N1Cc2c(C[C@H]1C)[nH]c1c(F)c(Cl)ccc21 |r|
COCC(=O)N1Cc2c([nH]c3c(Cl)c(Cl)ccc23)C2CCCCC12
COCC(=O)N1[C@@H](C)Cc2[nH]c3c(Cl)c(Cl)ccc3c2[C@@H]1C |r|
COCC(=O)N1[C@H](C)Cc2[nH]c3c(Cl)c(Cl)ccc3c2[C@@H]1C |r|
COCC(=O)NC(C)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCCC(=O)NC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCCC(OC)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCCN1CC(CC1=O)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCCN1CCn2c(c(-c3cn[nH]c3)c3c(NC(=O)C(F)F)cc(Cl)c(Cl)c23)C1=O
COCCOCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCCOCCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
COCCS(=O)(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
COCc1[nH]c2c(Cl)c(Cl)cc(NC(=O)C(F)F)c2c1-c1cn[nH]c1
COCc1nnc(CN2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)o1
COc1cc(Cl)cc2n(cc(-c3cn[nH]c3)c12)-c1cn(CCO)nn1
COc1cc2c(ccnc2cc1Cl)-n1ccnc1
COc1cc2c(cn(-c3ccc(CO)nn3)c2cc1Cl)-c1cn[nH]c1
COc1cc2c(cn(-c3cccnn3)c2cc1Cl)-c1cn[nH]c1
COc1cc2c(cn(-c3cn(CCO)nn3)c2cc1Cl)-c1cn[nH]c1
COc1ccc(OC)c2c1NC13CN(CCC21Nc1c3ccc(Cl)c1Cl)C(=O)CO
COc1ccc2c(c[nH]c2c1)C12CN(CCC1=Nc1c2ccc(Cl)c1Cl)C(=O)CO |c:19|
COc1ccc2nc3cc(N)ccc3c(N(C)CCCN(C)c3ccncc3)c2c1
COc1cccc2oc(nc12)-c1c([nH]c2c(c(nn2c1=O)C(F)(F)F)-c1ccccc1)C#N
COc1ccccc1NC12CN(CCC1=Nc1c2ccc(Cl)c1Cl)C(=O)CO |c:16|
CS(=O)(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CS(=O)(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CS(=O)(=O)NC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
CS(=O)(=O)NC1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
CS(=O)(=O)NCCn1cc(-c2cn[nH]c2)c2c(OCC#N)cc(Cl)c(Cl)c12
C[C@@H](CO)NC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1 |r|
C[C@@H](O)C(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1 |r|
C[C@H](O)C(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1 |r|
Cc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
Cc1[nH]c2c(Cl)c(Cl)ccc2c1-n1ccnc1
Cc1[nH]n2c(c(nc2c(=O)c1-c1cccc(Cl)c1)C#N)-c1ccccc1
Cc1c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c2n1C
Cc1cc(CC(=O)NCC(=O)N2CCc3[nH]c4c(Cl)c(Cl)cc(-c5ccn(C)n5)c4c3C2)no1
Cc1cc(Cl)c(cc1F)-c1cc(C(O)=O)c2nc[nH]c2c1
Cc1cc(Cl)ccc1-c1cc(C(O)=O)c2nc[nH]c2c1
Cc1ccc(OC(F)(F)C(=O)NCC(=O)N2CCc3[nH]c4c(Cl)c(Cl)cc(-c5ccn(C)n5)c4c3C2)cc1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCC(F)(F)CC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCC(O)CC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCCCC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCN(CC(F)(F)F)CC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCN(CC3)C3CC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCN(CC3)c3ccccc3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCN(Cc4ccccc4)C(=O)C3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCN(Cc4ccccc4)CC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCN4C(CCC4=O)C3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCNC(=O)C3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCNC(C3)C(F)(F)F)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CN3CCOCC3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CNc3ccccc3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(CO)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(Cc3ccc(Cl)cc3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(Cc3ccccc3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(NCc3ccccc3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc(Nc3ccccc3)[nH]c2c1
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc([nH]c2c1)C(F)(F)F
Cc1ccc(c(Cl)c1)-c1cc(C(O)=O)c2nc[nH]c2c1
Cc1nc(C)n(CC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2c(OCC#N)cc(Cl)c(Cl)c32)n1
Cc1nc(N2C[C@@H](CC(=O)Nc3ccncc3)C[C@H]2C(O)=O)c2oc3ccccc3c2n1 |r|
Cc1nc(no1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
Cc1nc2c(cc(cc2[nH]1)-c1ccc(C)cc1Cl)C(O)=O
Cc1nn(c(O)c1C1OC(=O)c2ccccc12)-c1nc2ccc(Cl)c(Cl)c2[nH]1
Cc1nn(c(O)c1C1OC(=O)c2ccccc12)-c1nc2ccccc2[nH]1
Cc1nnc(NCc2[nH]c3c(Cl)c(Cl)ccc3c2-c2cn[nH]c2)s1
Cc1nnc(o1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
Cc1nnc(s1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
Cc1nnc(s1)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
Cc1noc(COCC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)n1
ClCC(=O)Nc1nc(cs1)-c1c[nH]c2ccccc12
Clc1c(Br)ccc2c(c[nH]c12)-c1cn[nH]c1
Clc1cc(NC(=O)CC#N)c2c(c[nH]c2c1Cl)-c1cn[nH]c1
Clc1cc(NC2COC2)c2c(c[nH]c2c1Cl)-c1cn[nH]c1
Clc1cc(NCC#N)c2c(-c3cn[nH]c3)c3C(=O)NCCn3c2c1Cl
Clc1cc(NCC#N)c2c(c[nH]c2c1Cl)-c1cn[nH]c1
Clc1cc(OC2COC2)c2c(c[nH]c2c1Cl)-c1cn[nH]c1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)C1COCCO1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CCn1cncn1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCOC1=O
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCOCC1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCOCC1=O
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)Cn1cncn1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)[C@@H]1COCCO1 |r|
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)c1cnccn1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)c1nccnc1C(=O)N1CCCCC1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)c1nccnc1C(=O)N1CCOCC1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)c1ncccn1
Clc1cc(OCC#N)c2c(-c3cn[nH]c3)c3CNCCn3c2c1Cl
Clc1cc(OCC#N)c2c(c[nH]c2c1Cl)-c1cn[nH]c1
Clc1cc(OCC#N)c2c(c[nH]c2c1Cl)-n1ccnc1
Clc1cc(OCC#N)c2c(n[nH]c2c1Cl)-c1cn[nH]c1
Clc1ccc2c(-c3cn[nH]c3)c(CC(=O)NCc3cc[nH]n3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CC(=O)NCc3cnccn3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CNC(=O)Cc3cnccn3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CNC(=O)Cn3cnnc3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CNC(=O)c3cscn3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CNC(=O)c3nnco3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CNc3ccon3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c(CNc3nncs3)[nH]c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c([nH]c2c1Cl)-c1nnc(o1)C1CC1
Clc1ccc2c(-c3cn[nH]c3)c([nH]c2c1Cl)-c1nnco1
Clc1ccc2c(-c3cn[nH]c3)c3C(=O)NCCn3c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c3CC(CCn3c2c1Cl)c1nn[nH]n1
Clc1ccc2c(-c3cn[nH]c3)c3CCC(=O)Cn3c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c3CCC(=O)n3c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c3CCC(Cn3c2c1Cl)N1CCCC1=O
Clc1ccc2c(-c3cn[nH]c3)c3CCC(Cn3c2c1Cl)NC(=O)C1CCOCC1
Clc1ccc2c(-c3cn[nH]c3)c3CCC(Cn3c2c1Cl)NS(=O)(=O)CCn1cnnn1
Clc1ccc2c(-c3cn[nH]c3)c3CCC(Cn3c2c1Cl)Nc1ncccn1
Clc1ccc2c(-c3cn[nH]c3)c3CCNC(=O)Cn3c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)C1CCOC(=O)N1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)C1CNC(=O)O1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)C1COCCO1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)C1COCCOC1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CC1COCCO1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CC1COCCOC1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CCN1CCOCC1=O
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CCn1ccnc1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CCn1cncn1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1C(=O)CSC1=O
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCCC1=O
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCOC1=O
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCOCC1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)CN1CCOCC1=O
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)C[C@H]1CCCNC1=O |r|
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)Cc1ccn[nH]1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)Cc1cnccn1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)Cn1ccnc1
Clc1ccc2c(-c3cn[nH]c3)c3CN(CCn3c2c1Cl)C(=O)On1cncn1
Clc1ccc2c(-c3cn[nH]c3)c3CNC(=O)Cn3c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c3CNCCn3c2c1Cl
Clc1ccc2c(-c3cn[nH]c3)c3NC(=O)CCn3c2c1Cl
Clc1ccc2c(c(CNC(=O)C3COC3)[nH]c2c1Cl)-c1cn[nH]c1
Clc1ccc2c(c[nH]c2c1C#N)-c1cn[nH]c1
Clc1ccc2c(c[nH]c2c1Cl)-c1cn[nH]c1
Clc1ccc2c(c[nH]c2c1Cl)-n1ccnc1
Clc1ccc2c(cn(-c3c[nH]nn3)c2c1)-c1cn[nH]c1
Clc1ccc2c(cn(-c3cn[nH]n3)c2c1Cl)-c1cn[nH]c1
Cn1c(CNC(=O)CO)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
Cn1cc(cn1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CO
Cn1cc(nn1)-n1c(CO)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
Cn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)cc12
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)C1(N)COC1
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)C1CC(C1)OC(F)F |(6.58,-17.4,;7.48,-18.65,;9.02,-18.64,;9.5,-20.1,;8.26,-21.01,;7.01,-20.11,;8.27,-22.55,;6.94,-23.32,;6.94,-24.86,;5.61,-25.63,;8.28,-25.63,;8.28,-27.17,;9.62,-24.85,;11.09,-25.32,;11.98,-24.07,;13.5,-23.9,;14.12,-22.49,;13.21,-21.25,;11.68,-21.42,;11.07,-22.83,;9.61,-23.31,;13.83,-19.84,;12.92,-18.6,;15.36,-19.67,;16.56,-20.64,;17.53,-19.43,;16.32,-18.47,;19.06,-19.27,;19.97,-20.51,;21.5,-20.34,;19.35,-21.92,)|
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)C1CC(O)C1 |(73.96,-1.29,;74.87,-2.54,;76.41,-2.53,;76.89,-4,;75.65,-4.9,;74.4,-4,;75.66,-6.44,;74.33,-7.21,;74.33,-8.75,;73,-9.52,;75.66,-9.53,;75.67,-11.07,;77.01,-8.75,;78.48,-9.21,;79.37,-7.96,;80.89,-7.79,;81.51,-6.38,;80.6,-5.14,;79.07,-5.31,;78.46,-6.72,;77,-7.2,;81.22,-3.73,;80.31,-2.49,;82.75,-3.56,;83.96,-4.53,;84.92,-3.33,;86.45,-3.16,;83.72,-2.37,)|
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CN
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CN1CCOCC1
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)C(C)(C)N
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)C(C)(C)NC(=O)OC(C)(C)C
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)C1(N)CC1
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)C1=C[C@H](O)[C@H](O)[C@@H](O)C1 |r,t:31|
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)CN
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)CN1CCNCC1
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)Cc1ccco1
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)[C@@H](N)Cc1cc[nH]n1 |r|
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)[C@@H](N)O |r|
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)[C@@H]1CC(F)(F)CN1 |r|
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CNC(=O)c1cccc(c1)-c1noc(n1)C(F)(F)F
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CO
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)OC(C(F)(F)F)C(F)(F)F
Cn1ccc(n1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)[C@@H]1CCCN1 |r|
Cn1cnc(n1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
Cn1cnnc1NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
Cn1ncnc1CCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
Cn1ncnc1COCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
Cn1ncnc1COCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
FC(F)(F)c1nnc(o1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
FC(F)C(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
FC(F)C(=O)Nc1cc(Cl)c(Cl)c2[nH]nc(-c3cn[nH]c3)c12
FC(F)C(=O)Nc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)CC1CCNC(=O)C1
FC(F)C(=O)Nc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)CN1CCOC1=O
FC(F)C(=O)Nc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)Cc1cnccn1
FC(F)C(=O)Nc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)[C@@H]1COCCO1 |r|
FC(F)C(=O)Nc1cc(Cl)cc2[nH]cc(-c3cn[nH]c3)c12
FC(F)CCNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
FC(F)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
FC(F)COc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
FCC(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
FCCNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
FCCOc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
F[C@H]1C[C@H](C1)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r,wU:3.5,1.0,(-4.65,4.39,;-3.31,3.62,;-1.82,4.02,;-1.43,2.54,;-2.91,2.14,;-.09,1.77,;-.09,.23,;-1.43,-.54,;-1.43,-2.08,;-2.76,-2.85,;-.09,-2.85,;-.09,-4.39,;1.24,-2.08,;2.71,-2.56,;3.61,-1.31,;2.71,-.07,;3.18,1.4,;4.65,1.87,;4.65,3.41,;3.18,3.89,;2.28,2.64,;1.24,-.54,)|
F[C@H]1C[C@H](C1)Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r,wU:3.5,1.0,(-4.65,4.39,;-3.31,3.62,;-1.82,4.02,;-1.43,2.54,;-2.91,2.14,;-.09,1.77,;-.09,.23,;-1.43,-.54,;-1.43,-2.08,;-2.76,-2.85,;-.09,-2.85,;-.09,-4.39,;1.24,-2.08,;2.71,-2.56,;3.61,-1.31,;2.71,-.07,;3.18,1.4,;4.65,1.87,;4.65,3.41,;3.18,3.89,;2.28,2.64,;1.24,-.54,)|
Fc1c(Cl)cc(OCC#N)c2c(c[nH]c12)-c1cn[nH]c1
Fc1c(Cl)cc(OCC#N)c2c(c[nH]c12)-n1ccnc1
Fc1cnc(CCC(=O)N2CCn3c(C2)c(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c32)nc1
Ic1cnc(Nc2cccc(NC(=O)N3CCCC3)c2)nc1NCCCNC(=O)c1cccs1
NC(=O)CCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
NC(=O)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
NC(=O)COc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
NC(=O)COc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)CO
NC(=O)COc1cc(Cl)c(F)c2[nH]cc(-c3cn[nH]c3)c12
NC(=O)Cn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
NC(=O)Cn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)cc12
NC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
NC1(CCCCC1)C(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
NC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
NCC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
NCCCCCC(=O)NCC(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
NCCN1CCn2c(c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c23)C1=O
NCCOCCOCCC(=O)NC1CCc2c(-c3cnn(c3)C3CCCCO3)c3ccc(Cl)c(Cl)c3n2C1
NCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
NCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)cc12
NS(=O)(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
Nc1ccc(cn1)-c1cc(Cl)c(Cl)c2[nH]c3CCN(Cc3c12)C(=O)CO
Nc1nnc(o1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
O=C(Nc1sc2CCCCc2c1C#N)c1n[nH]c(n1)-n1cnnc1
O=C1Nc2ccccc2\C1=C1/SC(=NC1=O)N1CCCCC1 |c:14|
OC(=O)C1CCCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OC(=O)C1CCCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
OC(=O)CCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
OC(=O)CCn1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
OC(=O)CNC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1
OC(=O)Cn1cc(cn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
OC(=O)Cn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
OC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1 |r|
OC(=O)[C@@H]1CCCN1C(=O)c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1 |r|
OC(=O)[C@@H]1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21 |r|
OC(=O)[C@H]1CCCC[C@H]1NC(=O)C1C=NN2C1N=C(C=C2O)c1ccccc1 |r,c:14,19,21|
OC(=O)[C@H]1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21 |r|
OC(=O)c1cc(cc2[nH]cnc12)-c1ccc(cc1Cl)C(F)(F)F
OC(=O)c1cc(cc2[nH]cnc12)-c1ccc(cc1Cl)C1CC1
OC(=O)c1cccc(NC(=O)c2n[nH]c(n2)-n2cnnc2)c1
OC(=O)c1n[nH]c(n1)-n1cnnc1
OC1(CCOCC1)C(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OC1(COC1)C(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
OC1CC(C1)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |(-4.65,4.39,;-3.31,3.62,;-1.82,4.02,;-1.43,2.54,;-2.91,2.14,;-.09,1.77,;-.09,.23,;-1.43,-.54,;-1.43,-2.08,;-2.76,-2.85,;-.09,-2.85,;-.09,-4.39,;1.24,-2.08,;2.71,-2.56,;3.61,-1.31,;2.71,-.07,;3.18,1.4,;2.28,2.64,;3.18,3.89,;4.65,3.41,;4.65,1.87,;1.24,-.54,)|
OC1CCCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OC1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OCC(=O)N1CC=C2Nc3c(ccc(Cl)c3Cl)C2(Cl)C1 |t:6|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1cc(F)cc(F)c1 |t:7|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |t:7|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)Nc1ccc(cc1)C(F)(F)F |t:7|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2cc(Cl)ccc12 |t:7|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2cc(F)cc(F)c12 |t:7|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2cc(F)ccc12 |t:7|
OCC(=O)N1CCC2=Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2ccccc12 |t:7|
OCC(=O)N1CCC2Nc3c(ccc(Cl)c3Cl)C2(C1)c1c[nH]c2ccccc12
OCC(=O)N1CCc2[nH]c3c(Cl)c(Cl)cc(-c4cn[nH]c4)c3c2C1
OCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NC(=O)C(F)F)cc(Cl)c(Cl)c21
OCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(NCC#N)cc(Cl)c(Cl)c21
OCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
OCC(=O)N1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
OCC(=O)NC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OCC(=O)NC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
OCC(=O)NC1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OCC(=O)NCc1[nH]c2c(Cl)c(Cl)cc(NC(=O)CO)c2c1-c1cn[nH]c1
OCC(=O)NCc1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
OCC(=O)N[C@H]1CCn2c1c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21 |r|
OCC(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(=O)Nc1cc(Cl)c(Cl)c2[nH]nc(-c3cn[nH]c3)c12
OCC(=O)Nc1cc(Cl)c(Cl)c2n3CCN(Cc3c(-c3cn[nH]c3)c12)C(=O)CO
OCC(=O)Nc1nnc(o1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
OCC(CO)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(CO)COc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(F)(F)C(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(F)(F)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(F)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(O)C(=O)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(O)CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCC(O)Cn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
OCC1CCn2c(C1)c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
OCC1CCn2c1c(-c1cn[nH]c1)c1c(OCC#N)cc(Cl)c(Cl)c21
OCC1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2CC(=O)N1
OCC1Cn2c(c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c23)C(=O)N1
OCCC1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2C1
OCCC1CCn2c1c(-c1cn[nH]c1)c1ccc(Cl)c(Cl)c21
OCCCNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCCCNc1cc(Cl)c(Cl)c2[nH]nc(-c3cn[nH]c3)c12
OCCCNc1cc(Cl)c(Cl)c2n(cc(-c3cn[nH]c3)c12)-c1cn(CCO)nn1
OCCCNc1cc(Cl)c(F)c2n(cc(-c3cn[nH]c3)c12)-c1cn(CCO)nn1
OCCCNc1cc(Cl)cc2n(cc(-c3cn[nH]c3)c12)-c1cn(CCO)nn1
OCCCOc1cc(Cl)c(Cl)c2[nH]c(CO)c(-c3cn[nH]c3)c12
OCCCOc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCCCOc1cc(Cl)c(Cl)c2n3CC(O)CCc3c(-c3cn[nH]c3)c12
OCCN1CCc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2CC1=O
OCCN1CCn2c(c(-c3cn[nH]c3)c3c(NCC#N)cc(Cl)c(Cl)c23)C1=O
OCCN1CCn2c(c(-c3cn[nH]c3)c3c(OCC#N)cc(Cl)c(Cl)c23)C1=O
OCCN1CCn2c(c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c23)C1=O
OCCN1Cc2c(-c3cn[nH]c3)c3ccc(Cl)c(Cl)c3n2CC1=O
OCCNC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1
OCCNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCCOc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCCc1[nH]c2c(Cl)c(Cl)cc(NC(=O)C(F)F)c2c1-c1cn[nH]c1
OCCc1cc(on1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
OCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2c(NC(=O)C(F)F)cc(Cl)c(F)c12
OCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2c(OCC#N)cc(Cl)c(Cl)c12
OCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(Cl)c12
OCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)c(F)c12
OCCn1cc(nn1)-n1cc(-c2cn[nH]c2)c2ccc(Cl)cc12
OC[C@@H]1C[C@@H]1Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r|
OC\C=C\CNc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12
OCc1[nH]c2c(Cl)c(Cl)cc(NC(=O)C(F)F)c2c1-c1cn[nH]c1
OCc1[nH]c2c(Cl)c(Cl)cc(OCC#N)c2c1-c1cn[nH]c1
OCc1nnc(o1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
O[C@@H]1CC[C@H](C1)Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r|
O[C@H]1CC[C@@H](C1)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r|
O[C@H]1CC[C@H](C1)Nc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r|
O[C@H]1CC[C@H](C1)Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r|
O[C@H]1C[C@H](C1)Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r,wD:3.5,1.0,(-4.65,4.39,;-3.31,3.62,;-2.91,2.14,;-1.43,2.54,;-1.82,4.02,;-.09,1.77,;-.09,.23,;-1.43,-.54,;-1.43,-2.08,;-2.76,-2.85,;-.09,-2.85,;-.09,-4.39,;1.24,-2.08,;2.71,-2.56,;3.61,-1.31,;2.71,-.07,;3.18,1.4,;4.65,1.87,;4.65,3.41,;3.18,3.89,;2.28,2.64,;1.24,-.54,)|
O[C@H]1C[C@H](O)[C@H](C1)Oc1cc(Cl)c(Cl)c2[nH]cc(-c3cn[nH]c3)c12 |r|
Oc1cc(nc2nnnn12)-c1ccccc1
Oc1cccnc1NC(=O)COc1ccc(Cl)c2ccccc12
Sc1nnc([nH]1)-c1[nH]c2c(Cl)c(Cl)ccc2c1-c1cn[nH]c1
[H][C@@]12CN(C[C@@]11Nc3c(ccc(Cl)c3Cl)[C@]11Nc3ccc(Cl)cc3[C@]2([H])O1)C(=O)CO |r|
[H][C@@]12CN(C[C@@]11Nc3c(ccc(Cl)c3Cl)[C@]11Nc3ccccc3[C@]2([H])O1)C(=O)CO |r|
[O-][N+](=O)c1cn[nH]c1C(=O)Nc1cc(ccn1)-c1ccccc1
[O-][N+](=O)c1cn[nH]c1C(=O)Nc1ccc(Cl)cn1