3919 SMILES Strings for Platelet-derived growth factor receptor beta

Compound Name
SMILES String
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2nn(CCCCCCCC(=O)NO)c3ncnc(N)c23)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2nn(CCCCCCCC(=O)NO)c3ncnc(N)c23)c1
CN(CCCC(=O)NO)CCCn1nc(-c2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)c2c(N)ncnc12
CN(CCCC(=O)NO)CCCn1nc(-c2ccc(NC(=O)Nc3cccc(C)c3)cc2)c2c(N)ncnc12
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3cccc(F)c23)c1C
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(cc3NC(=O)c12)C#N
CCCc1ccc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)cc1O
Cc1ccc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)cc1O
CCOC(=O)Nc1ccc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)cc1O
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)ccc1Br
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)ccc1NS(=O)(=O)c1ccccc1
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c(F)cc1Br
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)cc(F)c1F
COc1cc(O)cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c1
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c(Cl)cc1Cl
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)ccc1Cl
Oc1ccc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)cc1O
Oc1ccc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCC(F)(F)F)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4cccc(Cl)c4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCC(N)=O)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCCCO)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCN4CCOCC4)cc3NC(=O)c12
CC(C)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CCC4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCCO)cc3NC(=O)c12
CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CCCCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCO)cc3NC(=O)c12
CCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNc4ccccc4)cc3NC(=O)c12
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)cc1O
CCN(CC)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCOCC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC5CC5)cc4NC(=O)c23)cc1O
CCNCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC5)cc4NC(=O)c23)cc1O
CN(C)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC5CCCC5)cc4NC(=O)c23)cc1O
Oc1cccc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c1
Oc1ccc(Cl)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c1
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c(F)cc1Cl
Oc1cc(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C#N)c(F)cc1F
CCN(CC)Cc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CN4CCCC4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CN4CCOCC4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CN4CCC(O)CC4)cc3NC(=O)c12
CN1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)CC1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CN4CCN(CCO)CC4)cc3NC(=O)c12
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(O)CC5)cc4NC(=O)c23)cc1O
CN1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)CC1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCN(CCO)CC5)cc4NC(=O)c23)cc1O
CC(C)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(C)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCOCCN(CC)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1)C(C)C
CCN(CCO)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCCCN(CC)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCCC1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)CC1
CCN(CCOC)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(C)(C)CC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(C5)C(N)=O)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(CCO)C5)cc4NC(=O)c23)cc1O
CC1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)CC1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(C5)OCC5CCC5)cc4NC(=O)c23)cc1O
CCN(CC)C(=O)COC1CCCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)C1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(O)CC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCCCC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5C[C@H](O)C[C@H]5CO)cc4NC(=O)c23)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(O)C5)cc4NC(=O)c23)cc1O
COC1CCCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)C1
CCOC1CCCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)C1
CCCOC1CCCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)C1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(O)C5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(C5)Oc5ccccc5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(O)(C5)c5ccccc5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNCCc5ccncc5)cc4NC(=O)c23)cc1O
CC(C)C(CO)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN[C@H]5CC[C@H](O)CC5)cc4NC(=O)c23)cc1O |r,wU:22.22,wD:19.18,(-10.46,3.64,;-9.12,2.87,;-9.12,1.33,;-7.79,.56,;-7.79,-.98,;-6.46,1.33,;-5.12,.56,;-5.12,-.98,;-6.46,-1.75,;-6.46,-3.29,;-5.12,-4.06,;-3.79,-3.29,;-2.59,-4.25,;-1.08,-3.91,;-.22,-5.18,;1.32,-5.06,;1.99,-3.68,;3.53,-3.68,;4.3,-2.34,;5.84,-2.34,;6.61,-3.68,;8.15,-3.68,;8.92,-2.34,;10.46,-2.34,;8.15,-1.01,;6.61,-1.01,;1.12,-2.4,;-.42,-2.52,;-1.08,-1.13,;-2.59,-.79,;-2.98,.7,;-3.79,-1.75,;-6.46,2.87,;-7.79,3.64,;-7.79,5.18,)|
CC(NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1)C1CCCCC1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC(CO)CO)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(O)=O)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(N)=O)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)NC2CCCC(O)C2)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2CCCC(O)C2)cc1O
CCNC(=O)c1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(CC)C(=O)c1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2CCOCC2)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2CCC(O)C2)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(C)(O)C5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCCC(C5)OCC(F)(F)F)cc4NC(=O)c23)cc1O
CCN(CCO)Cc1ccc2Nc3nccc(Nc4cc(O)c(Cl)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CC(O)C(C5)NCCO)cc4NC(=O)c23)cc1O
CCN1CCCC1CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CCC(CC)CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4cccc(F)c4F)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4ccc(Cl)nc4)cc3NC(=O)c12
COc1cccc(CNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCn4ccnn4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4(C)CCS(=O)(=O)C4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CCOC4)cc3NC(=O)c12
CC(NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1)C1CCC=CC1 |c:36|
Cc1ccn(CCCNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)n1
C[C@@H](NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1)C1CCCCC1 |r|
CCn1ccc(CNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)n1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNc4ccc5[nH]cnc5c4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNc4ccn(C)n4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC(CO)c4ccccc4)cc3NC(=O)c12
COc1ccc(NCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)cc1F
COc1ccccc1CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CN1CCN(CCNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)CC1
CC1CCN(CCNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)CC1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCN4CCCCCC4)cc3NC(=O)c12
CCN(CC)CC(C)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CCS(=O)(=O)C4)cc3NC(=O)c12
CC(CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1)Cn1cccn1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCC(F)(F)F)cc3NC(=O)c12
COCCOCCCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
C[C@@H](CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1)c1ccccc1 |r|
CCOCCC(C)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4ccc(F)cc4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4cccc(F)c4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4ccccc4F)cc3NC(=O)c12
CC(CN(C)C)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCc4ccncc4)cc3NC(=O)c12
CC1CCCCC1NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CCCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCF)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCC4CC4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CN[C@H](CO)c4ccccc4)cc3NC(=O)c12 |r|
COCCCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCC4CNC(=O)C4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC(C)(C)CN4CCCC4)cc3NC(=O)c12
CC(NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1)c1ccco1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCOCC4CCCO4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4(C)CCC4)cc3NC(=O)c12
CC(CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1)N1CCOCC1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CCOCC4)cc3NC(=O)c12
CN1C(CNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)CCC1=O
CN1CCC(CC1)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CCCNC4=O)cc3NC(=O)c12
CC(C)N1CCC(CNCc2ccc3Nc4nccc(Nc5cc(O)ccc5C)c4C(=O)Nc3c2)C1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCCN4CCCC4=O)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCC(C)(C)C)cc3NC(=O)c12
CN(C)C(=O)CCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CN(C)C(C)(C)CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4ccccc4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCc4cccnc4)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNc4ccccc4F)cc3NC(=O)c12
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNCC(O)CO)cc3NC(=O)c12
CC(C)OCCCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CC(C)[C@H](CO)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1 |r|
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CC4)cc3NC(=O)c12
CC(C)CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CCC(C)CNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(CNC4CCCC4)cc3NC(=O)c12
CCC(CC)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CN(C)CCNCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
CC(C)C(C)NCc1ccc2Nc3nccc(Nc4cc(O)ccc4C)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2C[C@H](O)C[C@H]2CO)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2CCC(CCO)CC2)cc1O
CCN(CCO)C(=O)c1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(CCO)CC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CC6CC6C5CO)cc4NC(=O)c23)cc1O
CC1CN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)CCC1(C)O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(O)C(C)(C)C5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNCCO)cc4NC(=O)c23)cc1O
CC(CO)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CSCC(CO)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(O)C(O)C5)cc4NC(=O)c23)cc1O
CC[C@@H](C)[C@@H](CO)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1 |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN[C@@H](CO)C(N)=O)cc4NC(=O)c23)cc1O |r|
CCN(CC)Cc1ccc2Nc3nccc(Nc4cc(O)c(Cl)cc4F)c3C(=O)Nc2c1
OC1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(Cl)cc5F)c4C(=O)Nc3c2)CC1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC[C@@H]5CCN(C[C@H]5O)C(=O)OC(C)(C)C)cc4NC(=O)c23)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(CO)C5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2CCC(O)CC2)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(cc4NC(=O)c23)C(=O)N2CCCC(CCO)C2)cc1O
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Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(CCO)C5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC6(O)CCCCC6C5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC(CO)Cc5cnc[nH]5)cc4NC(=O)c23)cc1O
COCCOCCOCCOCCOCCOCCOCCOCCNCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNCCOCCOCCOCCOCO)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC5CC(O)C5)cc4NC(=O)c23)cc1O |(-9.65,3.64,;-8.32,2.87,;-8.32,1.33,;-6.99,.56,;-6.99,-.98,;-5.65,1.33,;-4.32,.56,;-4.32,-.98,;-5.65,-1.75,;-5.65,-3.29,;-4.32,-4.06,;-2.99,-3.29,;-1.78,-4.25,;-.28,-3.91,;.59,-5.18,;2.12,-5.06,;2.79,-3.68,;4.33,-3.68,;5.1,-2.34,;6.43,-1.57,;7.92,-1.97,;8.32,-.48,;9.65,.29,;6.83,-.09,;1.92,-2.41,;.39,-2.52,;-.28,-1.13,;-1.78,-.79,;-2.18,.7,;-2.99,-1.75,;-5.65,2.87,;-6.99,3.64,;-6.99,5.18,)|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC5CCC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CNC5CC(F)(F)C5)cc4NC(=O)c23)cc1O
CC(C)OC1CC(C1)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1 |(10.99,.29,;9.65,-.48,;9.65,-2.02,;8.32,.29,;6.99,-.48,;6.59,-1.97,;5.1,-1.57,;5.5,-.09,;3.77,-2.34,;3,-3.68,;1.46,-3.68,;.79,-5.06,;-.75,-5.18,;-1.61,-3.91,;-3.12,-4.25,;-4.32,-3.29,;-5.65,-4.06,;-6.99,-3.29,;-6.99,-1.75,;-5.65,-.98,;-5.65,.56,;-6.99,1.33,;-6.99,2.87,;-8.32,3.64,;-8.32,5.18,;-9.65,2.87,;-10.99,3.64,;-9.65,1.33,;-8.32,.56,;-8.32,-.98,;-4.32,-1.75,;-3.12,-.79,;-3.51,.7,;-1.61,-1.13,;-.95,-2.52,;.59,-2.41,)|
CCOC(=O)[C@@H]1C[C@@H](C1)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1 |r,wU:7.9,5.4,(10.32,4.14,;10.32,2.6,;8.99,1.83,;8.99,.29,;10.32,-.48,;7.65,-.48,;6.17,-.09,;5.77,-1.57,;7.26,-1.97,;4.43,-2.34,;3.66,-3.68,;2.12,-3.68,;1.46,-5.06,;-.08,-5.18,;-.95,-3.91,;-2.45,-4.25,;-3.65,-3.29,;-4.99,-4.06,;-6.32,-3.29,;-6.32,-1.75,;-4.99,-.98,;-4.99,.56,;-6.32,1.33,;-6.32,2.87,;-7.65,3.64,;-7.65,5.18,;-8.99,2.87,;-10.32,3.64,;-8.99,1.33,;-7.65,.56,;-7.65,-.98,;-3.65,-1.75,;-2.45,-.79,;-2.85,.7,;-.95,-1.13,;-.28,-2.52,;1.26,-2.41,)|
CCOC(=O)[C@H]1C[C@@H](C1)NCc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1 |r,wU:7.9,wD:5.4,(10.32,4.14,;10.32,2.6,;8.99,1.83,;8.99,.29,;10.32,-.48,;7.65,-.48,;6.17,-.09,;5.77,-1.57,;7.26,-1.97,;4.43,-2.34,;3.66,-3.68,;2.12,-3.68,;1.46,-5.06,;-.08,-5.18,;-.95,-3.91,;-2.45,-4.25,;-3.65,-3.29,;-4.99,-4.06,;-6.32,-3.29,;-6.32,-1.75,;-4.99,-.98,;-4.99,.56,;-6.32,1.33,;-6.32,2.87,;-7.65,3.64,;-7.65,5.18,;-8.99,2.87,;-10.32,3.64,;-8.99,1.33,;-7.65,.56,;-7.65,-.98,;-3.65,-1.75,;-2.45,-.79,;-2.85,.7,;-.95,-1.13,;-.28,-2.52,;1.26,-2.41,)|
CC1NC(=O)C2CN(Cc3ccc4Nc5nccc(Nc6cc(O)c(C)cc6F)c5C(=O)Nc4c3)CCN2C1=O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN[C@H]5C[C@@H](C5)C(O)=O)cc4NC(=O)c23)cc1O |r,wU:19.18,wD:21.23,(-10.32,3.64,;-8.99,2.87,;-8.99,1.33,;-7.65,.56,;-7.65,-.98,;-6.32,1.33,;-4.99,.56,;-4.99,-.98,;-6.32,-1.75,;-6.32,-3.29,;-4.99,-4.06,;-3.65,-3.29,;-2.45,-4.25,;-.95,-3.91,;-.08,-5.18,;1.46,-5.07,;2.12,-3.68,;3.66,-3.68,;4.43,-2.34,;5.77,-1.57,;6.17,-.09,;7.65,-.48,;7.26,-1.97,;8.99,.29,;8.99,1.83,;10.32,-.48,;1.26,-2.41,;-.28,-2.52,;-.95,-1.13,;-2.45,-.79,;-2.85,.7,;-3.65,-1.75,;-6.32,2.87,;-7.65,3.64,;-7.65,5.18,)|
CC(C)N1C(=O)CN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)CC1(C)C
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCNCC5)cc4NC(=O)c23)cc1O
CN(CCO)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(CCN(C)C)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(CCN)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
C[C@@H](O)CN(C)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1 |r|
C[C@H](O)CN(C)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1 |r|
CN(C)CCN(C)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(CC(C)O)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CC[C@H](O)C5)cc4NC(=O)c23)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CC[C@@H](O)C5)cc4NC(=O)c23)cc1O |r|
CN(CCN)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5C[C@H](O)[C@H](O)C5)cc4NC(=O)c23)cc1O |r|
CN(C)C1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)CC1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC[C@@H](N)C5)cc4NC(=O)c23)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CC[C@H](N)C5)cc4NC(=O)c23)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CC[C@@H](N)C5)cc4NC(=O)c23)cc1O |r|
CN(C)[C@@H]1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)C1 |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC(N)CC5)cc4NC(=O)c23)cc1O
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC[C@H](N)C5)cc4NC(=O)c23)cc1O |r|
CN(C)[C@H]1CCN(Cc2ccc3Nc4nccc(Nc5cc(O)c(C)cc5F)c4C(=O)Nc3c2)C1 |r|
CN(CCCO)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
CCN(CCCO)Cc1ccc2Nc3nccc(Nc4cc(O)c(C)cc4F)c3C(=O)Nc2c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC[C@H](O)C5)cc4NC(=O)c23)cc1O |r|
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCC[C@@H](O)C5)cc4NC(=O)c23)cc1O |r|
Cc1ccc(O)cc1Nc1ccnc2Nc3ccc(cc3NC(=O)c12)C(=O)NCc1cccc(Cl)c1
Cc1cc(F)c(Nc2ccnc3Nc4ccc(CN5CCN(CC(F)F)CC5)cc4NC(=O)c23)cc1O
Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CC(=O)Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-10.82,-.43,;-9.48,.34,;-9.48,1.88,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cn1c2nc(=O)[nH]cc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CC(C)Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-9.48,-2.74,;-8.15,-1.97,;-6.82,-2.74,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CCCCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-6.5,-5.16,;-7.59,-4.08,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cn1c2nc(NC3CCCCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.81,-2.74,;-6.81,-4.28,;-8.14,-5.05,;-9.48,-4.29,;-9.48,-2.75,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCCO)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.75,;-9.88,-4.23,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-10.82,-1.97,;-12.15,-2.74,;-12.15,-4.28,;-10.82,-5.05,;-9.48,-4.28,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN(C)c1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-8.15,-1.97,;-8.15,-.43,;-9.48,.34,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
CCN(CC)CCCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-6.72,-6.82,;-8.2,-7.22,;-9.29,-6.13,;-10.38,-7.22,;-11.71,-6.45,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
Cn1c2nc(NCCCN3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-8.52,-4.79,;-9.18,-6.13,;-8.09,-7.22,;-8.49,-8.7,;-9.97,-9.1,;-11.06,-8.01,;-10.66,-6.53,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN1CCN(CCCNc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-10.37,-10.59,;-9.97,-9.1,;-8.49,-8.7,;-8.09,-7.22,;-9.18,-6.13,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-10.66,-6.53,;-11.06,-8.01,)|
CN1CCN(CCCCNc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-8.54,-12.22,;-8.54,-10.68,;-7.27,-9.81,;-7.39,-8.28,;-8.78,-7.61,;-9.18,-6.13,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-10.05,-8.49,;-9.93,-10.02,)|
CN1CCN(CCCCCNc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-9.18,-13.72,;-9.18,-12.18,;-7.84,-11.41,;-7.84,-9.87,;-9.18,-9.1,;-8.78,-7.61,;-9.18,-6.13,;-8.52,-4.79,;-8.92,-3.31,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-10.51,-9.87,;-10.51,-11.41,)|
Cn1c2nc(NCc3ccccn3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-10.45,-3.09,;-11.4,-4.3,;-10.82,-5.73,;-9.3,-5.95,;-8.35,-4.73,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCc3cccnc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-10.46,-3.31,;-11.23,-4.64,;-10.46,-5.97,;-8.92,-5.97,;-8.15,-4.64,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCCc3ccccn3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-8.15,-4.64,;-8.9,-5.99,;-8.1,-7.31,;-6.56,-7.28,;-5.82,-5.93,;-6.61,-4.61,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(NCCCCCC(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-8.92,-3.31,;-8.15,-4.64,;-8.92,-5.97,;-8.52,-7.46,;-9.61,-8.55,;-9.61,-10.09,;-10.94,-7.78,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.81,-2.74,;-6.81,-4.28,;-8.14,-5.05,;-9.48,-4.29,;-9.48,-2.75,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CCn1c2nc(Nc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.73,-3.06,;-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.81,-2.74,;-6.81,-4.28,;-8.14,-5.05,;-9.48,-4.29,;-9.48,-2.75,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3cccnc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
COc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cn1 |(-7.06,-7.68,;-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,)|
Cn1c2nc(Nc3ccncc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CCn1c2nc(Nc3ccncc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.73,-3.06,;-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(Cl)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3cccc(Br)c3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-5.48,-5.05,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,)|
COc1ccccc1Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-12.15,-2.74,;-10.82,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,)|
COc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-12.15,-4.28,;-10.82,-5.05,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,)|
COc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-7.06,-7.68,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
Cn1c2nc(Nc3cccc(O)c3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-10.82,-5.05,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN1c2c(cnc(n2)Nc3cccc(c3)CO)C=C(C1=O)c4c(cccc4Cl)Cl
COc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1C |(-7.06,-7.68,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,;-10.82,-5.05,)|
COc1cc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc(OC)c1 |(-12.15,-4.28,;-10.82,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,;-5.48,-5.05,;-4.15,-4.28,;-8.15,-5.05,)|
CCOC(=O)c1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-14.82,-4.28,;-13.49,-5.05,;-12.15,-4.28,;-10.82,-5.05,;-10.82,-6.59,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,)|
CCOC(=O)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-4.15,-7.36,;-5.48,-6.59,;-6.82,-7.36,;-8.15,-6.59,;-9.48,-7.36,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CCOC(=O)CCCc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-.15,-6.59,;-1.48,-7.36,;-2.82,-6.59,;-4.15,-7.36,;-4.15,-8.9,;-5.48,-6.59,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,)|
Cn1c2nc(Nc3ccc(OCCN)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-6.82,-7.36,;-6.82,-8.9,;-5.48,-9.67,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CCNCCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-2.66,-9.3,;-4.15,-8.9,;-5.48,-9.67,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CN(C)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-4.15,-8.9,;-5.48,-9.67,;-5.48,-11.21,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CN(C)CCCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-4.15,-11.98,;-5.48,-11.21,;-6.82,-11.98,;-5.48,-9.67,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CCN(CC)CCOc1cccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)c1 |(-13.08,-10.99,;-11.59,-10.59,;-10.82,-9.26,;-9.48,-10.03,;-8.4,-8.94,;-11.59,-7.93,;-10.82,-6.59,;-10.82,-5.05,;-9.48,-4.28,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,)|
CCN(CC)CCOc1ccc(cc1)Nc2ncc3c(n2)N(C(=O)C(=C3)c4c(cccc4Cl)Cl)C
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(CC)c3n2)cc1 |(-8.3,-10.68,;-6.82,-11.08,;-5.73,-9.99,;-4.24,-10.39,;-3.15,-9.3,;-6.82,-8.9,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-1.48,-2.74,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CC[N+](C)(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-2.82,-5.05,;-2.82,-6.59,;-4.15,-7.36,;-2.82,-8.13,;-4.15,-8.9,;-5.48,-9.67,;-5.48,-6.59,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CC[N+]([O-])(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-1.48,-7.36,;-2.82,-6.59,;-4.09,-7.36,;-2.82,-8.13,;-4.15,-8.9,;-5.48,-9.67,;-5.48,-6.59,;-6.82,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
Cn1c2nc(Nc3ccc(OCCN4CCCCC4)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-6.82,-7.36,;-5.48,-6.59,;-4.15,-7.36,;-4.19,-8.9,;-2.88,-9.71,;-1.53,-8.98,;-1.48,-7.44,;-2.79,-6.63,;-9.48,-4.28,;-9.48,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CN1CCN(CC1)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-8.03,-11.21,;-8.03,-9.67,;-9.39,-8.95,;-9.45,-7.41,;-8.15,-6.59,;-6.79,-7.31,;-6.73,-8.85,;-8.15,-5.05,;-6.82,-4.28,;-6.82,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-9.48,-2.74,;-9.48,-4.28,)|
CN1CCN(Cc2ccc(Nc3ncc4cc(-c5c(Cl)cccc5Cl)c(=O)n(C)c4n3)cc2)CC1 |(-13.49,-9.67,;-12.15,-8.9,;-12.15,-7.36,;-10.82,-6.59,;-9.48,-7.36,;-8.15,-6.59,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-8.15,-1.97,;-8.15,-.43,;-6.82,.34,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,;-2.82,-.43,;-2.82,-1.97,;-4.15,.34,;-5.48,-.43,;-6.82,-2.74,;-6.82,-4.28,;-9.48,-8.9,;-10.82,-9.67,)|
Cn1c2nc(Nc3cccc(c3)C(O)=O)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-6.82,-2.74,;-6.82,-4.28,;-8.15,-5.05,;-9.48,-4.28,;-9.48,-2.74,;-10.82,-5.05,;-12.15,-4.28,;-10.82,-6.59,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(CC(O)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-7.38,-7.93,;-5.84,-7.93,;-8.15,-9.26,;-6.82,-4.28,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
Cn1c2nc(Nc3ccc(CCCC(O)=O)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-2.82,-1.97,;-2.82,-.43,;-4.15,.34,;-5.48,-.43,;-6.82,.34,;-8.15,-.43,;-8.15,-1.97,;-9.48,-2.74,;-9.48,-4.28,;-8.15,-5.05,;-8.15,-6.59,;-7.38,-7.93,;-8.15,-9.26,;-7.06,-10.35,;-5.57,-10.75,;-7.83,-11.68,;-6.82,-4.28,;-6.82,-2.74,;-6.82,1.88,;-5.48,2.65,;-4.15,1.88,;-2.82,2.65,;-1.48,1.88,;-.15,2.65,;-.15,4.19,;-1.48,4.96,;1.18,4.96,;2.52,4.19,;2.52,2.65,;1.18,1.88,;1.18,.34,;-1.48,.34,;-.15,-.43,)|
CNC(=O)c1c(SSc2c(C(=O)NC)c3ccccc3n2C)n(C)c2ccccc12
Cn1c([Se][Se]c2c(C(=O)OC(C)(C)C)c3ccccc3n2C)c(C(=O)OC(C)(C)C)c2ccccc12
Cn1c([Se][Se]c2c(C(O)=O)c3ccccc3n2C)c(C(O)=O)c2ccccc12
CNC(=O)c1c([Se][Se]c2c(C(=O)NC)c3ccccc3n2C)n(C)c2ccccc12
CCN(CC)CCNC(=O)c1c([Se][Se]c2c(C(=O)NCCN(CC)CC)c3ccccc3n2C)n(C)c2ccccc12
CNC(=O)c1c([Se][Se]c2[nH]c3ccccc3c2C(=O)NC)[nH]c2ccccc12
CCN(CC)CCNC(=O)c1c([Se][Se]c2[nH]c3ccccc3c2C(=O)NCCN(CC)CC)[nH]c2ccccc12
CCN(CC)CCn1c([Se][Se]c2c(C(=O)NC)c3ccccc3n2CCN(CC)CC)c(C(=O)NC)c2ccccc12
FC(F)(F)C(=O)N[C@H](Cc1c([Se]c2[nH]c3ccccc3c2C[C@@H](NC(=O)C(F)(F)F)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1 |r|
FC(F)(F)C(=O)N[C@H](Cc1c([Se][Se]c2[nH]c3ccccc3c2C[C@@H](NC(=O)C(F)(F)F)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1 |r|
N[C@H](Cc1c([Se][Se]c2[nH]c3ccccc3c2C[C@@H](N)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1 |r|
N[C@@H](Cc1c([Se][Se]c2[nH]c3ccccc3c2C[C@H](N)C(=O)NCc2ccccc2)[nH]c2ccccc12)C(=O)NCc1ccccc1 |r|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)cccc1Cl |(4.56,-3.94,;3.23,-3.17,;1.89,-3.94,;3.23,-4.71,;3.23,-1.63,;1.89,-.86,;.56,-1.63,;1.89,.68,;.56,1.45,;-.77,.68,;-2.11,1.45,;-3.44,.68,;-4.78,1.45,;-6.11,.68,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
Nc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
CCN(CC)CCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-13.7,2.41,;-12.93,1.08,;-11.44,.68,;-11.24,-.85,;-9.82,-1.44,;-10.11,1.45,;-8.78,.68,;-7.44,1.45,;-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-13.7,2.41,;-12.93,1.08,;-11.44,.68,;-11.24,-.85,;-9.82,-1.44,;-10.11,1.45,;-8.78,.68,;-7.44,1.45,;-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;1.89,-.86,;.56,-1.63,;3.23,-1.63,;4.56,-.86,;5.89,-1.63,;4.56,.68,;5.89,-.09,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
Cc1cccc(C)c1-c1cc2cnc(N)nc2nc1N |(3.23,1.45,;3.23,2.99,;4.56,3.76,;4.56,5.3,;3.23,6.07,;1.89,5.3,;.56,6.07,;1.89,3.76,;.56,2.99,;-.77,3.76,;-2.11,2.99,;-3.44,3.76,;-4.78,2.99,;-4.78,1.45,;-6.11,.68,;-3.44,.68,;-2.11,1.45,;-.77,.68,;.56,1.45,;1.89,.68,)|
Cc1cccc(C)c1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(3.23,1.45,;3.23,2.99,;4.56,3.76,;4.56,5.3,;3.23,6.07,;1.89,5.3,;.56,6.07,;1.89,3.76,;.56,2.99,;-.77,3.76,;-2.11,2.99,;-3.44,3.76,;-4.78,2.99,;-4.78,1.45,;-6.11,.68,;-3.44,.68,;-2.11,1.45,;-.77,.68,;.56,1.45,;1.89,.68,;1.89,-.86,;.56,-1.63,;3.23,-1.63,;4.56,-.86,;5.89,-1.63,;4.56,.68,;5.89,-.09,)|
CCN(CC)CCCNc1ncc2cc(c(N)nc2n1)-c1c(C)cccc1C |(-14.11,.68,;-12.78,1.45,;-11.44,.68,;-11.44,-.86,;-12.78,-1.63,;-10.11,1.45,;-8.78,.68,;-7.44,1.45,;-6.11,.68,;-4.78,1.45,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;.56,1.45,;1.89,.68,;-.77,.68,;-2.11,1.45,;-3.44,.68,;1.89,3.76,;3.23,2.99,;3.23,1.45,;4.56,3.76,;4.56,5.3,;3.23,6.07,;1.89,5.3,;.56,6.07,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(C)cccc1C |(-13.18,.33,;-11.84,1.1,;-10.51,.33,;-10.51,-1.21,;-9.18,-1.98,;-9.18,1.1,;-7.84,.33,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
Nc1ncc2cc(c(N)nc2n1)-c1c(Br)cccc1Br |(-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Br)cccc1Br |(5.49,-4.29,;4.16,-3.52,;2.83,-4.29,;4.16,-5.06,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCNc1ncc2cc(c(N)nc2n1)-c1c(Br)cccc1Br |(-13.18,.33,;-11.84,1.1,;-10.51,.33,;-10.51,-1.21,;-9.42,-2.3,;-9.18,1.1,;-7.84,.33,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Br)cccc1Br |(-13.18,.33,;-11.84,1.1,;-10.51,.33,;-10.51,-1.21,;-9.42,-2.3,;-9.18,1.1,;-7.84,.33,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
Cc1cc(C)c(C)c(c1C)-c1cc2cnc(N)nc2nc1N |(4.16,7.26,;4.16,5.72,;5.49,4.95,;5.49,3.41,;6.83,2.64,;4.16,2.64,;4.16,1.1,;2.83,3.41,;2.83,4.95,;1.49,5.72,;1.49,2.64,;.16,3.41,;-1.17,2.64,;-2.51,3.41,;-3.84,2.64,;-3.84,1.1,;-5.18,.33,;-2.51,.33,;-1.17,1.1,;.16,.33,;1.49,1.1,;2.83,.33,)|
Cc1cc(C)c(C)c(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(4.16,7.26,;4.16,5.72,;5.49,4.95,;5.49,3.41,;6.83,2.64,;4.16,2.64,;4.16,1.1,;2.83,3.41,;2.83,4.95,;1.49,5.72,;1.49,2.64,;.16,3.41,;-1.17,2.64,;-2.51,3.41,;-3.84,2.64,;-3.84,1.1,;-5.18,.33,;-2.51,.33,;-1.17,1.1,;.16,.33,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.67,-3.92,;5.49,-4.29,;4.16,-5.06,)|
COc1cc(OC)cc(c1)-c1cc2cnc(N)nc2nc1N
COc1cc(OC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.34,.05,;-10.57,1.39,;-9.09,1.79,;-8.69,3.27,;-7.2,3.67,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCNC(=O)Nc1nc2nc(NCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.34,.05,;-8.69,3.27,;-7.2,3.67,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.34,.05,;-10.57,1.39,;-9.09,1.79,;-8.69,3.27,;-7.2,3.67,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCNC(=O)Nc1nc2nc(NCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(2.83,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.66,2.48,;-13.15,2.08,;-10.57,-.15,;-11.91,-.92,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)NC(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-13.15,2.08,;-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-11.91,-.92,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;5.49,-4.29,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCNC(=O)Nc1nc2nc(NCCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.66,2.48,;-13.15,2.08,;-13.55,.59,;-11.26,3.96,;-9.78,4.36,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC3CCCCC3)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;2.83,-5.83,;4.16,-6.6,;5.49,-5.83,;5.49,-4.29,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)Nc3ccccc3)nc2n1)-c1c(Cl)cccc1Cl |(-13.55,.59,;-13.15,2.08,;-11.66,2.48,;-11.26,3.96,;-9.78,4.36,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;2.83,-5.83,;4.16,-6.6,;5.49,-5.83,;5.49,-4.29,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCN(C)c1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-5.18,-1.21,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CCCN(C)c1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-5.18,-1.21,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.4,-1.8,;3.92,-2.3,;3.92,-3.84,;2.58,-4.61,;5.25,-4.61,;3.92,-5.38,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CC(C)(C)CNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-8.4,-.79,;-7.6,2.19,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN(C)CC(C)(C)CNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.66,2.48,;-10.57,1.39,;-10.57,-.15,;-9.09,1.79,;-8,.7,;-8.4,-.79,;-7.6,2.19,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
Nc1nc2nc(NCCCN3CCOCC3)ncc2cc1-c1c(Cl)cccc1Cl |(2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC(C)(C)NC(=O)Nc1nc2nc(NCCCN3CCOCC3)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;2.83,-4.29,;4.16,-5.06,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC1CCCCN1CCCNc1ncc2cc(c(N)nc2n1)-c1c(Cl)cccc1Cl |(-11.91,3.7,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CC1CCCCN1CCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(-11.91,3.7,;-11.91,2.16,;-13.24,1.39,;-13.24,-.15,;-11.91,-.92,;-10.57,-.15,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.34,-1.61,;4.05,-2.15,;5.47,-1.56,;6.69,-2.5,;6.96,-1.16,;4.98,-.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN1CCN(CCCNc2ncc3cc(c(N)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.57,-.92,;-13.24,-.15,;-13.24,1.39,;-11.91,2.16,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.57,-.15,;-11.91,-.92,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.57,-.92,;-13.24,-.15,;-13.24,1.39,;-11.91,2.16,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.34,-1.61,;4.05,-2.15,;5.47,-1.56,;6.69,-2.5,;6.96,-1.16,;4.98,-.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.57,-.15,;-11.91,-.92,)|
CN1CCN(CCCCNc2ncc3cc(c(N)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-15.76,4.51,;-14.27,4.11,;-12.91,4.83,;-11.61,4.02,;-11.66,2.48,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-13.02,1.76,;-14.33,2.57,)|
CN1CCN(CCCCNc2ncc3cc(c(NC(=O)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-15.76,4.51,;-14.27,4.11,;-12.91,4.83,;-11.61,4.02,;-11.66,2.48,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;2.83,-4.29,;4.16,-5.06,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-13.02,1.76,;-14.33,2.57,)|
CN1CCN(CCCNc2ncc3cc(c(NC(N)=O)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;4.16,-1.98,;1.49,-1.98,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.87,2.22,;-13.24,1.51,;-13.31,-.03,;-14.64,-.8,;-12.01,-.86,;-10.64,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NCC=C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;5.49,-4.29,;5.49,-5.83,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CC(C)NC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(5.49,-4.29,;4.16,-3.52,;2.83,-4.29,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.87,2.22,;-13.24,1.51,;-13.31,-.03,;-14.64,-.8,;-12.01,-.86,;-10.64,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CCCCCCCCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(-1.17,-11.22,;.16,-10.45,;.16,-8.91,;1.49,-8.14,;1.49,-6.6,;2.83,-5.83,;2.83,-4.29,;4.16,-3.52,;4.16,-1.98,;2.83,-1.21,;1.49,-1.98,;2.83,.33,;1.49,1.1,;.16,.33,;-1.17,1.1,;-2.51,.33,;-3.84,1.1,;-5.18,.33,;-6.51,1.1,;-8,.7,;-9.09,1.79,;-10.57,1.39,;-11.87,2.22,;-13.24,1.51,;-13.31,-.03,;-14.64,-.8,;-12.01,-.86,;-10.64,-.15,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NCc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.83,-4.29,;1.49,-3.52,;.16,-4.29,;.16,-5.83,;1.49,-6.6,;2.83,-5.83,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC4CCCCC4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(-14.64,-.8,;-13.31,-.03,;-13.24,1.51,;-11.87,2.22,;-10.57,1.39,;-9.09,1.79,;-8,.7,;-6.51,1.1,;-5.18,.33,;-3.84,1.1,;-3.84,2.64,;-2.51,3.41,;-1.17,2.64,;.16,3.41,;1.49,2.64,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.8,-4.24,;2.74,-5.78,;4.04,-6.6,;5.4,-5.88,;5.46,-4.34,;.16,.33,;-1.17,1.1,;-2.51,.33,;2.83,3.41,;2.83,4.95,;1.49,5.72,;4.16,5.72,;5.49,4.95,;5.49,3.41,;4.16,2.64,;4.16,1.1,;-10.64,-.15,;-12.01,-.86,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NC45CC6CC(CC(C6)C4)C5)nc3n2)-c2c(Cl)cccc2Cl)CC1 |TLB:27:22:29:28.26.25,27:26:29:21.22.23,THB:25:24:21:28.26.27,25:26:21:29.24.23,(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;26.9,-20.31,;26.9,-22.76,;28.89,-23.49,;31.09,-22.83,;29.48,-25.41,;27.66,-24.12,;24.83,-24.68,;27.66,-21.18,;31.09,-20.41,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)NCCNC(=O)OC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;30.36,-19.89,;30.36,-21.43,;31.7,-22.2,;33.03,-21.43,;31.7,-23.74,;33.03,-24.51,;34.36,-23.74,;33.03,-26.05,;34.36,-25.28,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN(C)CCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(29.03,-22.2,;30.36,-21.43,;31.7,-22.2,;30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCN(CC)C(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;30.36,-16.81,;31.7,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(Cl)cc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.88,-23.74,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(Br)cc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.88,-23.74,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(cc4)C(F)(F)F)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;30.29,-21.47,;30.34,-19.93,;28.88,-23.74,;27.34,-23.74,;28.48,-25.22,;30.41,-23.96,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(Cl)c(Cl)c4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.93,-23.74,;30.29,-21.47,;31.62,-22.24,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4ccc(C)cc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.67,-19.85,;27.62,-21.39,;28.93,-22.2,;28.93,-23.74,;30.29,-21.47,;30.34,-19.93,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
COc1ccccc1NC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(33.16,-19.56,;31.67,-19.16,;30.34,-19.93,;30.29,-21.47,;28.93,-22.2,;27.62,-21.39,;27.67,-19.85,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
COc1cccc(NC(=O)Nc2nc3nc(NCCCN4CCN(C)CC4)ncc3cc2-c2c(Cl)cccc2Cl)c1 |(32.95,-21.55,;31.6,-22.28,;30.29,-21.47,;28.93,-22.2,;27.62,-21.39,;27.67,-19.85,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;30.34,-19.93,)|
COc1ccc(NC(=O)Nc2nc3nc(NCCCN4CCN(C)CC4)ncc3cc2-c2c(Cl)cccc2Cl)cc1 |(30.19,-24.55,;28.88,-23.74,;28.93,-22.2,;27.62,-21.39,;27.67,-19.85,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;16.87,-14.9,;15.78,-13.81,;14.29,-14.21,;13,-13.38,;11.63,-14.08,;11.56,-15.62,;10.23,-16.39,;12.86,-16.45,;14.22,-15.75,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;30.34,-19.93,;30.29,-21.47,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Nc4cccc5ccccc45)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.23,-16.39,;11.56,-15.62,;11.63,-14.08,;13,-13.38,;14.29,-14.21,;15.78,-13.81,;16.87,-14.9,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;30.34,-19.93,;30.29,-21.47,;28.93,-22.2,;27.62,-21.39,;26.26,-22.11,;24.96,-21.3,;25,-19.76,;26.36,-19.03,;27.67,-19.85,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.22,-15.75,;12.86,-16.45,)|
CCN(CC)CCCNc1ncc2cc(c(NC(=O)CC(C)(C)C)nc2n1)-c1c(Cl)cccc1Cl |(12.63,-13.01,;13.02,-14.5,;14.36,-15.27,;14.36,-16.81,;13.59,-18.14,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.69,-19.89,;30.36,-19.89,;29.03,-20.66,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCN(CC)CCCNc1ncc2cc(c(\N=C\N(C)C)nc2n1)-c1c(Cl)cccc1Cl |(12.63,-13.01,;13.02,-14.5,;14.36,-15.27,;14.36,-16.81,;13.59,-18.14,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;29.03,-17.58,;29.03,-19.12,;30.52,-17.18,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCNC(=S)Nc1nc2nc(NCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;12.63,-13.01,;14.36,-16.81,;13.59,-18.14,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCNC(N)=Nc1nc2nc(NCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |w:5.5,(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;12.63,-13.01,;14.36,-16.81,;13.59,-18.14,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCN(CC)CCCCNc1ncc2cc(c(NC(=S)NCCCN3CCOCC3)nc2n1)-c1c(Cl)cccc1Cl |(11.69,-12.19,;13.02,-12.96,;13.02,-14.5,;11.69,-15.27,;11.69,-16.81,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;30.36,-19.89,;30.36,-21.43,;31.7,-22.2,;31.64,-23.74,;32.95,-24.55,;34.31,-23.83,;34.36,-22.29,;33.05,-21.48,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CCCC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(30.36,-19.89,;29.03,-19.12,;29.03,-17.58,;27.69,-16.81,;26.36,-17.58,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;11.69,-15.27,;11.69,-16.81,;10.36,-17.58,;13.02,-17.58,;14.36,-16.81,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)CC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;28.26,-20.45,;30.57,-19.12,;29.8,-20.45,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=O)Cc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.69,-19.89,;27.69,-21.43,;29.03,-22.2,;30.36,-21.43,;30.36,-19.89,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(NS(=O)(=O)c4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-16.04,;28.46,-18.14,;28.46,-19.68,;29.8,-20.45,;31.13,-19.68,;31.13,-18.14,;29.8,-17.37,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(N=C(N)Nc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |w:16.15,(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.69,-19.89,;27.69,-21.43,;29.03,-22.2,;30.36,-21.43,;30.36,-19.89,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CC(C)NC(NC(C)C)=Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(25.03,-19.89,;26.36,-19.12,;27.69,-19.89,;26.36,-17.58,;27.69,-16.81,;29.03,-17.58,;30.52,-17.18,;31.6,-18.27,;30.91,-15.69,;27.69,-15.27,;26.36,-14.5,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;21.03,-14.5,;19.69,-15.27,;18.36,-14.5,;17.02,-15.27,;15.69,-14.5,;14.36,-15.27,;13.02,-14.5,;11.69,-15.27,;11.69,-16.81,;10.36,-17.58,;13.02,-17.58,;14.36,-16.81,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=S)NC(C)(C)C)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;30.52,-17.18,;31.6,-18.27,;30.91,-15.69,;32,-16.78,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
CN1CCN(CCCNc2ncc3cc(c(NC(=S)Nc4ccccc4)nc3n2)-c2c(Cl)cccc2Cl)CC1 |(10.36,-17.58,;11.69,-16.81,;11.69,-15.27,;13.02,-14.5,;14.36,-15.27,;15.69,-14.5,;17.02,-15.27,;18.36,-14.5,;19.69,-15.27,;21.03,-14.5,;21.03,-12.96,;22.36,-12.19,;23.69,-12.96,;25.03,-12.19,;26.36,-12.96,;26.36,-14.5,;27.69,-15.27,;27.69,-16.81,;26.36,-17.58,;29.03,-17.58,;29.03,-19.12,;27.64,-19.79,;27.53,-21.32,;28.8,-22.19,;30.19,-21.52,;30.3,-19.98,;25.03,-15.27,;23.69,-14.5,;22.36,-15.27,;27.69,-12.19,;27.69,-10.65,;26.36,-9.88,;29.03,-9.88,;30.36,-10.65,;30.36,-12.19,;29.03,-12.96,;29.03,-14.5,;14.36,-16.81,;13.02,-17.58,)|
c1ccc(cc1)Cn2cnc3c2cccc3
O=C(c1ccccc1)n1cnc2ccccc12
c1ccc(cc1)-c1nc2ccccc2[nH]1
C1CC(=Nc2ccccc2N1)c1ccccc1 |c:2|
c1cc2ccccc2n1-c1ccccc1
c1nn(-c2ccccc2)c2ccccc12
c1ccc(cc1)-n1nnc2ccccc12
c1nc2ccccc2n1-c1ccccc1
Cc1ccccc1-n1cnc2ccccc12
COc1ccccc1-n1cnc2ccccc12
Oc1ccccc1-n1cnc2ccccc12
Clc1ccccc1-n1cnc2ccccc12
OC(=O)c1ccccc1-n1cnc2ccccc12
CCOC(=O)c1ccccc1-n1cnc2ccccc12
NC(=O)c1ccccc1-n1cnc2ccccc12
[O-][N+](=O)c1ccccc1-n1cnc2ccccc12
Nc1ccccc1-n1cnc2ccccc12
CC(=O)c1ccccc1-n1cnc2ccccc12
O=Cc1ccccc1-n1cnc2ccccc12
N#Cc1ccccc1-n1cnc2ccccc12
c1nc2ccccc2n1-c1ccccn1
Cc1cccc(c1)-n1cnc2ccccc12
COc1cccc(c1)-n1cnc2ccccc12
Oc1cccc(c1)-n1cnc2ccccc12
Clc1cccc(c1)-n1cnc2ccccc12
OC(=O)c1cccc(c1)-n1cnc2ccccc12
CCOC(=O)c1cccc(c1)-n1cnc2ccccc12
NC(=O)c1cccc(c1)-n1cnc2ccccc12
[O-][N+](=O)c1cccc(c1)-n1cnc2ccccc12
Nc1cccc(c1)-n1cnc2ccccc12
CC(=O)c1cccc(c1)-n1cnc2ccccc12
O=Cc1cccc(c1)-n1cnc2ccccc12
N#Cc1cccc(c1)-n1cnc2ccccc12
c1nc2ccccc2n1-c1cccnc1
Cc1ccc(cc1)-n1cnc2ccccc12
COc1ccc(cc1)-n1cnc2ccccc12
Oc1ccc(cc1)-n1cnc2ccccc12
Clc1ccc(cc1)-n1cnc2ccccc12
OC(=O)c1ccc(cc1)-n1cnc2ccccc12
COC(=O)c1ccc(cc1)-n1cnc2ccccc12
NC(=O)c1ccc(cc1)-n1cnc2ccccc12
[O-][N+](=O)c1ccc(cc1)-n1cnc2ccccc12
Nc1ccc(cc1)-n1cnc2ccccc12
CC(=O)c1ccc(cc1)-n1cnc2ccccc12
O=Cc1ccc(cc1)-n1cnc2ccccc12
N#Cc1ccc(cc1)-n1cnc2ccccc12
c1nc2ccccc2n1-c1ccncc1
Cc1nc2ccccc2n1-c1ccccc1
O=c1[nH]c2ccccc2n1-c1ccccc1
Nc1nc2ccccc2n1-c1ccccc1
Cc1cccc2n(cnc12)-c1ccccc1
COc1cccc2n(cnc12)-c1ccccc1
Oc1cccc2n(cnc12)-c1ccccc1
Clc1cccc2n(cnc12)-c1ccccc1
OC(=O)c1cccc2n(cnc12)-c1ccccc1
COC(=O)c1cccc2n(cnc12)-c1ccccc1
NC(=O)c1cccc2n(cnc12)-c1ccccc1
[O-][N+](=O)c1cccc2n(cnc12)-c1ccccc1
Nc1cccc2n(cnc12)-c1ccccc1
Cc1ccc2n(cnc2c1)-c1ccccc1
COc1ccc2n(cnc2c1)-c1ccccc1
Oc1ccc2n(cnc2c1)-c1ccccc1
Clc1ccc2n(cnc2c1)-c1ccccc1
OC(=O)c1ccc2n(cnc2c1)-c1ccccc1
COC(=O)c1ccc2n(cnc2c1)-c1ccccc1
NC(=O)c1ccc2n(cnc2c1)-c1ccccc1
[O-][N+](=O)c1ccc2n(cnc2c1)-c1ccccc1
Nc1ccc2n(cnc2c1)-c1ccccc1
CC(=O)c1ccc2n(cnc2c1)-c1ccccc1
O=Cc1ccc2n(cnc2c1)-c1ccccc1
c1nc2cnccc2n1-c1ccccc1
Cc1ccc2ncn(-c3ccccc3)c2c1
COc1ccc2ncn(-c3ccccc3)c2c1
Oc1ccc2ncn(-c3ccccc3)c2c1
Clc1ccc2ncn(-c3ccccc3)c2c1
OC(=O)c1ccc2ncn(-c3ccccc3)c2c1
COC(=O)c1ccc2ncn(-c3ccccc3)c2c1
NC(=O)c1ccc2ncn(-c3ccccc3)c2c1
[O-][N+](=O)c1ccc2ncn(-c3ccccc3)c2c1
Nc1ccc2ncn(-c3ccccc3)c2c1
Cc1cccc2ncn(-c3ccccc3)c12
COc1cccc2ncn(-c3ccccc3)c12
Oc1cccc2ncn(-c3ccccc3)c12
Clc1cccc2ncn(-c3ccccc3)c12
OC(=O)c1cccc2ncn(-c3ccccc3)c12
COC(=O)c1cccc2ncn(-c3ccccc3)c12
NC(=O)c1cccc2ncn(-c3ccccc3)c12
[O-][N+](=O)c1cccc2ncn(-c3ccccc3)c12
Nc1cccc2ncn(-c3ccccc3)c12
c1nc2cccnc2n1-c1ccccc1
COc1ccc2n(cnc2c1)-c1cccs1
COc1ccc2n(cnc2c1)-c1ccsc1
CCOc1ccc2n(cnc2c1)-c1ccccc1
CCCOc1ccc2n(cnc2c1)-c1ccccc1
CC(C)Oc1ccc2n(cnc2c1)-c1ccccc1
CCCCOc1ccc2n(cnc2c1)-c1ccccc1
C=CCOc1ccc2n(cnc2c1)-c1ccccc1
OCCCCOc1ccc2n(cnc2c1)-c1ccccc1
C(Oc1ccc2n(cnc2c1)-c1ccccc1)C1CO1
OCC(O)COc1ccc2n(cnc2c1)-c1ccccc1
NCCOc1ccc2n(cnc2c1)-c1ccccc1
CN(C)CCOc1ccc2n(cnc2c1)-c1ccccc1
CN(C)CCCOc1ccc2n(cnc2c1)-c1ccccc1
CN(C)CCCCOc1ccc2n(cnc2c1)-c1ccccc1
C(CN1CCOCC1)Oc1ccc2n(cnc2c1)-c1ccccc1
C(COc1ccc2n(cnc2c1)-c1ccccc1)CN1CCOCC1
C(CCN1CCOCC1)COc1ccc2n(cnc2c1)-c1ccccc1
COc1ccc2n(cnc2c1)-c1ccc(N)cc1
Sc1ccc2n(cnc2c1)-c1ccccc1
CSc1ccc2n(cnc2c1)-c1ccccc1
C(CSc1ccc2n(cnc2c1)-c1ccccc1)CN1CCOCC1
CN(C)C(=S)Oc1ccc2n(cnc2c1)-c1ccccc1
Oc1ccc2n(cnc2c1O)-c1ccccc1
COc1ccc2n(cnc2c1O)-c1ccccc1
COc1c(O)ccc2n(cnc12)-c1ccccc1
COc1ccc2n(cnc2c1OC)-c1ccccc1
Oc1ccc2n(cnc2c1Br)-c1ccccc1
Brc1c(OCC=C)ccc2n(cnc12)-c1ccccc1
Oc1ccc2n(cnc2c1CC=C)-c1ccccc1
CC1Cc2c(O1)ccc1n(cnc21)-c1ccccc1
COc1cc2ncn(-c3ccccc3)c2cc1OC
Oc1cc2ncn(-c3ccccc3)c2cc1O
C1Oc2cc3ncn(-c4ccccc4)c3cc2O1
COc1cc2ncn(-c3ccccc3)c2cc1C
Cc1cc2n(cnc2cc1O)-c1ccccc1
COc1cc2ncn(-c3ccccc3)c2cc1C(O)=O
OC(=O)c1cc2n(cnc2cc1O)-c1ccccc1
COC(=O)c1cc2n(cnc2cc1OC)-c1ccccc1
COc1cc2ncn(-c3ccccc3)c2cc1CO
COc1cc2ncn(-c3ccccc3)c2cc1C=O
CCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CCCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.32,-5.1,;-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CCCCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(1.02,-5.87,;-.32,-5.1,;-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CC(C)Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.32,-5.1,;-.32,-3.56,;1.02,-2.79,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
COC(=O)Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(2.35,-3.56,;1.02,-2.79,;-.32,-3.56,;-.32,-5.1,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
CC(C)(C)OC(=O)Cn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(3.69,-2.79,;2.35,-3.56,;2.35,-5.1,;3.69,-4.33,;1.02,-2.79,;-.32,-3.56,;-.32,-5.1,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(CC(O)=O)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;1.02,-2.79,;-.32,-5.1,;-2.98,-.48,;-4.32,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(Cc3ccccc3)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;2.35,-5.1,;2.35,-3.56,;1.02,-2.79,;-2.98,-.48,;-4.32,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(Cc3ccncc3)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;2.35,-5.1,;2.35,-3.56,;1.02,-2.79,;-2.98,-.48,;-4.32,-1.25,)|
CN(C)CCCn1c2nc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(1.02,-7.41,;1.02,-5.87,;2.35,-5.1,;-.32,-5.1,;-.32,-3.56,;-1.65,-2.79,;-1.65,-1.25,;-2.98,-.48,;-4.32,-1.25,;-5.65,-.48,;-6.98,-1.25,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(CCCOCc3ccccc3)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;1.02,-7.41,;2.35,-8.18,;2.35,-9.72,;3.69,-10.49,;5.02,-9.72,;5.02,-8.18,;3.69,-7.41,;-2.98,-.48,;-4.32,-1.25,)|
Nc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(CCCO)c2n1 |(-6.98,-1.25,;-5.65,-.48,;-5.65,1.06,;-4.32,1.83,;-2.98,1.06,;-1.65,1.83,;-.32,1.06,;1.02,1.83,;1.02,3.37,;-.32,4.14,;2.35,4.14,;3.69,3.37,;3.69,1.83,;2.35,1.06,;2.35,-.48,;-.32,-.48,;1.02,-1.25,;-1.65,-1.25,;-1.65,-2.79,;-.32,-3.56,;-.32,-5.1,;1.02,-5.87,;-2.98,-.48,;-4.32,-1.25,)|
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2ccccc2)c1=O
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2ccsc2)c1=O
Cn1c2nc(Nc3ccncc3)ncc2cc(-c2ccccc2)c1=O
Cn1c2nc(Nc3ccncc3)ncc2cc(-c2ccsc2)c1=O
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccccc4)c(=O)n(C)c3n2)cc1
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccsc4)c(=O)n(C)c3n2)cc1
Cn1c2nc(N)ncc2cc(-c2ccsc2)c1=O
CNc1ncc2cc(-c3ccsc3)c(=O)n(C)c2n1
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2cccs2)c1=O
Cn1c2nc(Nc3ccccc3)ncc2cc(-c2ccc(cc2)-c2ccccc2)c1=O
CCn1c2nc(Nc3ccccc3)ncc2cc(-c2ccccc2)c1=O
CCn1c2nc(Nc3ccccc3)ncc2cc(-c2ccsc2)c1=O
CCn1c2nc(Nc3ccncc3)ncc2cc(-c2ccccc2)c1=O
CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccccc4)c(=O)n(CC)c3n2)cc1
Cn1c2cc(N)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
CNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-6.52,-3.49,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CN(C)c1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-6.52,-3.49,;-6.52,-1.95,;-7.85,-1.18,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-11.85,-1.95,;-13.19,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-13.19,-4.26,;-11.85,-3.49,;-11.85,-1.95,;-13.19,-1.18,;-13.19,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCCCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-11.85,1.13,;-13.19,.36,;-13.19,-1.18,;-14.52,-1.95,;-14.52,-3.49,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CCN(CC)CCCCCNc1cc2n(C)c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-15.85,-4.26,;-14.52,-3.49,;-14.52,-1.95,;-15.85,-1.18,;-15.85,.36,;-13.19,-1.18,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CN1CCN(CCCNc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-15.61,-4.58,;-14.52,-3.49,;-14.52,-1.95,;-13.19,-1.18,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-11.85,-3.49,;-13.19,-4.26,)|
CN1CCN(CCCCNc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-17.31,.81,;-15.82,.41,;-14.47,1.16,;-13.16,.36,;-13.19,-1.18,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-14.53,-1.92,;-15.85,-1.13,)|
CN1CCN(CCCCCNc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-18.56,-3.32,;-17.18,-2.64,;-17.09,-1.1,;-15.71,-.41,;-14.43,-1.26,;-12.94,-.86,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-14.52,-2.8,;-15.9,-3.48,)|
Cn1c2cc(NCCCN3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-11.85,-1.95,;-13.19,-1.18,;-14.52,-1.95,;-14.52,-3.49,;-13.19,-4.26,;-11.85,-3.49,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(NCCCCN3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-11.85,-1.95,;-13.19,-1.18,;-13.05,.36,;-14.31,1.24,;-15.7,.59,;-15.84,-.94,;-14.58,-1.83,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(NCCCn3ccnc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-11.85,-1.95,;-12.33,-3.41,;-13.87,-3.41,;-14.34,-1.95,;-13.1,-1.04,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(Nc3ccccc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-7.85,.36,;-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
Cn1c2cc(Nc3ccncc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-7.85,.36,;-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
COc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCOc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-14.52,7.29,;-14.52,5.75,;-13.19,4.98,;-11.85,5.75,;-10.52,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCCOc1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-15.85,8.06,;-14.52,7.29,;-14.52,5.75,;-15.85,4.98,;-15.85,3.44,;-13.19,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CN1CCN(CCOc2ccc(Nc3cc4n(C)c(=O)c(cc4cn3)-c3c(Cl)cccc3Cl)cc2)CC1 |(-13.19,9.6,;-13.19,8.06,;-14.52,7.29,;-14.52,5.75,;-13.19,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,;-11.85,5.75,;-11.85,7.29,)|
CN1CCN(CCCOc2ccc(Nc3cc4n(C)c(=O)c(cc4cn3)-c3c(Cl)cccc3Cl)cc2)CC1 |(-18.38,8.29,;-17.09,7.44,;-15.72,8.14,;-14.43,7.29,;-14.52,5.75,;-13.19,4.98,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,;-15.9,5.06,;-17.18,5.91,)|
CN1CCN(CC1)c1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-15.85,3.44,;-14.52,2.67,;-13.19,3.44,;-11.85,2.67,;-11.85,1.13,;-13.19,.36,;-14.52,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
Cn1c2cc(Nc3ccc(cc3)N3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-9.18,-1.95,;-10.52,-1.18,;-10.52,.36,;-9.18,1.13,;-7.85,.36,;-11.85,1.13,;-11.85,2.67,;-13.19,3.44,;-14.52,2.67,;-14.52,1.13,;-13.19,.36,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
CCN(CC)C(=O)c1ccc(Nc2cc3n(C)c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-10.52,4.98,;-10.52,3.44,;-11.85,2.67,;-13.19,3.44,;-14.52,2.67,;-11.85,1.13,;-13.19,.36,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;-1.18,-3.43,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCCCNc1cc2[nH]c(=O)c(cc2cn1)-c1c(Cl)cccc1Cl |(-15.85,-1.18,;-14.52,-1.95,;-13.19,-1.18,;-13.19,.36,;-11.85,1.13,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,)|
CN1CCN(CCCNc2cc3[nH]c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-15.95,-4.09,;-14.58,-3.37,;-14.52,-1.84,;-13.15,-1.12,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-11.92,-3.49,;-13.28,-4.2,)|
CCN(CC)CCCOc1ccc(Nc2cc3[nH]c(=O)c(cc3cn2)-c2c(Cl)cccc2Cl)cc1 |(-18.31,-.65,;-18.31,.89,;-16.98,1.66,;-16.98,3.2,;-15.65,3.97,;-15.65,.89,;-14.31,1.66,;-13.04,.79,;-11.65,1.45,;-10.39,.57,;-10.51,-.96,;-9.24,-1.84,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-3.85,-1.95,;-2.52,-1.12,;-1.18,-1.89,;.15,-1.12,;1.48,-1.89,;.15,.42,;-1.18,1.19,;-2.52,.42,;-3.85,1.13,;-5.18,.36,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;-7.73,.36,;-8.99,1.23,)|
Cn1c2nc(N)ccc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
CCN(CC)CCCNc1ccc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-13.58,.31,;-13.19,-1.18,;-11.85,-1.95,;-11.85,-3.49,;-13.19,-4.26,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,)|
CN1CCN(CCCNc2ccc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)CC1 |(-15.93,-4.12,;-14.6,-3.35,;-14.52,-1.81,;-13.14,-1.11,;-11.85,-1.95,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,;-11.93,-3.49,;-13.31,-4.19,)|
Cn1c2nc(Nc3ccccc3)ccc2cc(-c2c(Cl)cccc2Cl)c1=O |(-1.18,-3.43,;-1.18,-1.89,;-2.52,-1.12,;-3.85,-1.95,;-5.18,-1.18,;-6.52,-1.95,;-7.85,-1.18,;-7.85,.36,;-9.18,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,)|
COc1ccc(Nc2ccc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-13.19,.36,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCOc1ccc(Nc2ccc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-18.34,1.74,;-16.85,2.14,;-15.76,1.05,;-16.16,-.44,;-15.07,-1.52,;-14.27,1.45,;-13.19,.36,;-11.85,1.13,;-10.52,.36,;-10.52,-1.18,;-9.18,-1.95,;-7.85,-1.18,;-6.52,-1.95,;-5.18,-1.18,;-5.18,.36,;-3.85,1.13,;-2.52,.42,;-1.18,1.19,;.15,.42,;1.48,1.19,;1.48,2.73,;.15,3.5,;2.82,3.5,;4.15,2.73,;4.15,1.19,;2.82,.42,;2.82,-1.12,;.15,-1.12,;1.48,-1.89,;-1.18,-1.89,;-1.18,-3.43,;-2.52,-1.12,;-3.85,-1.95,;-7.85,.36,;-9.18,1.13,)|
CCN(CC)CCNc1ncc2cc(-c3c(Cl)cccc3Cl)c(=O)n(C)c2n1 |(-12.59,.48,;-11.1,.88,;-10.01,-.21,;-10.78,-1.54,;-10.01,-2.88,;-8.53,-.61,;-7.19,.16,;-5.86,-.61,;-4.53,.16,;-4.53,1.7,;-3.19,2.47,;-1.86,1.7,;-.52,2.47,;.81,1.7,;2.14,2.47,;2.14,4.01,;.81,4.78,;3.48,4.78,;4.81,4.01,;4.81,2.47,;3.48,1.7,;3.48,.16,;.81,.16,;2.14,-.61,;-.52,-.61,;-.52,-2.15,;-1.86,.16,;-3.19,-.61,)|
Cn1c2nc(Nc3ccc(cc3)N3CCOCC3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.52,-2.15,;-.52,-.61,;-1.86,.16,;-3.19,-.61,;-4.53,.16,;-5.86,-.61,;-7.19,.16,;-8.55,-.56,;-9.86,.26,;-9.8,1.8,;-8.44,2.52,;-7.14,1.7,;-11.11,2.62,;-11.11,4.16,;-12.44,4.93,;-13.78,4.16,;-13.78,2.62,;-12.44,1.85,;-4.53,1.7,;-3.19,2.47,;-1.86,1.7,;-.52,2.47,;.81,1.7,;2.14,2.47,;2.14,4.01,;.81,4.78,;3.48,4.78,;4.81,4.01,;4.81,2.47,;3.48,1.7,;3.48,.16,;.81,.16,;2.14,-.61,)|
CCN(CC)C(=O)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-13.8,4.21,;-13.8,2.67,;-12.47,1.9,;-12.47,.36,;-13.8,-.41,;-11.11,2.62,;-11.05,4.16,;-9.8,1.8,;-9.86,.26,;-8.55,-.56,;-7.19,.16,;-5.86,-.61,;-4.53,.16,;-4.53,1.7,;-3.19,2.47,;-1.86,1.7,;-.52,2.47,;.81,1.7,;2.14,2.47,;2.14,4.01,;.81,4.78,;3.48,4.78,;4.81,4.01,;4.81,2.47,;3.48,1.7,;3.48,.16,;.81,.16,;2.14,-.61,;-.52,-.61,;-.52,-2.15,;-1.86,.16,;-3.19,-.61,;-7.14,1.7,;-8.44,2.52,)|
Nc1cc2nc(N)c(cc2cn1)-c1ccccc1
CCNC(=O)Nc1nc2cc(N)ncc2cc1-c1ccccc1
CC(C)(C)NC(=O)Nc1nc2cc(N)ncc2cc1-c1ccccc1
Nc1cc2nc(N)c(cc2cn1)-c1c(Cl)cccc1Cl |(-5.57,-1.95,;-4.23,-1.18,;-2.9,-1.95,;-1.57,-1.18,;-.23,-2.01,;1.1,-1.24,;2.43,-2.01,;1.1,.3,;-.23,1.07,;-1.57,.36,;-2.9,1.13,;-4.23,.36,;2.43,1.07,;3.78,.32,;3.78,-1.22,;5.1,1.11,;5.08,2.65,;3.73,3.4,;2.41,2.61,;1.08,3.38,)|
CCNC(=O)Nc1nc2cc(N)ncc2cc1-c1c(Cl)cccc1Cl |(-.23,-6.63,;1.1,-5.86,;1.1,-4.32,;2.43,-3.55,;3.77,-4.32,;2.43,-2.01,;1.1,-1.24,;-.23,-2.01,;-1.57,-1.18,;-2.9,-1.95,;-4.23,-1.18,;-5.57,-1.95,;-4.23,.36,;-2.9,1.13,;-1.57,.36,;-.23,1.07,;1.1,.3,;2.43,1.07,;3.78,.32,;3.78,-1.22,;5.1,1.11,;5.08,2.65,;3.73,3.4,;2.41,2.61,;1.08,3.38,)|
CC(C)(C)NC(=O)Nc1nc2cc(N)ncc2cc1-c1c(Cl)cccc1Cl |(-.23,-6.63,;1.1,-5.86,;1.1,-7.4,;2.59,-6.26,;1.1,-4.32,;2.43,-3.55,;3.77,-4.32,;2.43,-2.01,;1.1,-1.24,;-.23,-2.01,;-1.57,-1.18,;-2.9,-1.95,;-4.23,-1.18,;-5.57,-1.95,;-4.23,.36,;-2.9,1.13,;-1.57,.36,;-.23,1.07,;1.1,.3,;2.43,1.07,;3.78,.32,;3.78,-1.22,;5.1,1.11,;5.08,2.65,;3.73,3.4,;2.41,2.61,;1.08,3.38,)|
COc1cc(OC)cc(c1)-c1cc2cnc(N)cc2nc1N
CNC(=O)Nc1nc2cc(N)ncc2cc1-c1cc(OC)cc(OC)c1
CCNC(=O)Nc1nc2cc(N)ncc2cc1-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(N)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(N)cc2nc1NC(=O)Nc1ccccc1
COc1cc(OC)cc(c1)-c1cc2cnc(NC(C)=O)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NC(=O)C(F)(F)F)cc2nc1N
COc1cc(OC)cc(c1)-c1cc2cnc(NC(=O)NC(C)(C)C)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCOCC3)cc2nc1NC(=O)NC(C)(C)C
Cc1c(c([nH]c1/C=C\2/c3ccccc3NC2=O)C)CCC(=O)O
CN1CCN(CCCc2c(C)[nH]c(\C=C3/C(=O)Nc4ccccc34)c2C)CC1
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccccc23)c1C
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(Cl)cc23)c1C
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(Br)cc23)c1C
CN(C)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
Cc1c([nH]c(c1C(=O)NCCN2CCCC2)C)/C=C\3/c4cc(ccc4NC3=O)F
CN1CCC(CNC(=O)c2c(C)[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c2C)CC1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NCCN1CCOCC1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NCc1ccncc1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NCCn1ccnn1
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1ccccc1
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1cccc(Cl)c1Cl
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)ccc(Cl)c1Cl |(6.86,-1.2,;5.37,-.8,;4.97,.69,;6.46,.29,;4.28,-1.89,;2.8,-1.49,;1.71,-2.58,;2.4,-0,;.91,.4,;-.42,-.37,;-1.76,.4,;-3.09,-.37,;-4.43,.4,;-5.76,-.37,;-4.43,1.94,;-3.09,2.71,;-1.76,1.94,;-.42,2.71,;.91,1.94,;2.24,2.71,;3.58,1.94,;3.58,.4,;4.91,2.71,;4.91,4.25,;3.58,5.02,;3.58,6.56,;2.24,4.25,;.91,5.02,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)cccc1Br |(6.86,-1.2,;5.37,-.8,;4.97,.69,;6.46,.29,;4.28,-1.89,;2.8,-1.49,;1.71,-2.58,;2.4,-0,;.91,.4,;-.42,-.37,;-1.76,.4,;-3.09,-.37,;-4.43,.4,;-5.76,-.37,;-4.43,1.94,;-3.09,2.71,;-1.76,1.94,;-.42,2.71,;.91,1.94,;2.24,2.71,;3.58,1.94,;3.58,.4,;4.91,2.71,;4.91,4.25,;3.58,5.02,;2.24,4.25,;.91,5.02,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(F)cccc1F |(6.86,-1.2,;5.37,-.8,;4.97,.69,;6.46,.29,;4.28,-1.89,;2.8,-1.49,;1.71,-2.58,;2.4,-0,;.91,.4,;-.42,-.37,;-1.76,.4,;-3.09,-.37,;-4.43,.4,;-5.76,-.37,;-4.43,1.94,;-3.09,2.71,;-1.76,1.94,;-.42,2.71,;.91,1.94,;2.24,2.71,;2.24,4.25,;.91,5.02,;3.58,5.02,;4.91,4.25,;4.91,2.71,;3.58,1.94,;3.58,.4,)|
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1cc(F)cc(F)c1
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1ccccc1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1ccc(cc1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1cccc(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1cc(C)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
Cc1cc(C)c(c(C)c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(6.24,5.02,;4.91,4.25,;3.58,5.02,;2.24,4.25,;.91,5.02,;2.24,2.71,;3.58,1.94,;3.51,.4,;4.82,2.53,;.91,1.94,;-.42,2.71,;-1.76,1.94,;-3.09,2.71,;-4.43,1.94,;-4.43,.4,;-5.76,-.37,;-3.09,-.37,;-1.76,.4,;-.42,-.37,;.91,.4,;2.4,-0,;2.8,-1.49,;1.71,-2.58,;4.28,-1.89,;5.37,-.8,;6.86,-1.2,;4.97,.69,;6.46,.29,)|
Cc1c(C)c(C)c(c(C)c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(6.26,4.98,;4.91,4.25,;3.58,5.02,;3.58,6.56,;2.24,4.25,;.91,5.02,;2.24,2.71,;3.58,1.94,;3.51,.4,;4.82,2.53,;6.1,1.67,;.91,1.94,;-.42,2.71,;-1.76,1.94,;-3.09,2.71,;-4.43,1.94,;-4.43,.4,;-5.76,-.37,;-3.09,-.37,;-1.76,.4,;-.42,-.37,;.91,.4,;2.4,-0,;2.8,-1.49,;1.71,-2.58,;4.28,-1.89,;5.37,-.8,;6.86,-1.2,;4.97,.69,;6.46,.29,)|
CCN(CC)CCOc1ccc(C)c(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(7.58,11.95,;6.24,11.18,;6.24,9.64,;7.58,8.87,;8.91,9.64,;4.91,8.87,;4.91,7.33,;3.58,6.56,;3.58,5.02,;4.91,4.25,;4.82,2.53,;3.58,1.94,;3.51,.4,;2.24,2.71,;2.24,4.25,;.91,5.02,;.91,1.94,;-.42,2.71,;-1.76,1.94,;-3.09,2.71,;-4.43,1.94,;-4.43,.4,;-5.76,-.37,;-3.09,-.37,;-1.76,.4,;-.42,-.37,;.91,.4,;2.4,-0,;2.8,-1.49,;1.71,-2.58,;4.28,-1.89,;5.37,-.8,;6.86,-1.2,;4.97,.69,;6.46,.29,)|
CCc1ccccc1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCc1cc(CC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccccc1-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1cccc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccc(cc1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccc(cc1OC)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCOc1cccc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CCOc1cc(OCC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
CN(C)c1cc(cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C)N(C)C
C(c1ccncc1)c1nnc(Nc2ccccc2)c2ccccc12
Cc1cccc(Nc2nnc(Cc3ccncc3)c3ccccc23)c1
CC(C)(C)c1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
C(c1ccncc1)c1nnc(Nc2ccc(cc2)-c2ccccc2)c2ccccc12
COc1cccc(Nc2nnc(Cc3ccncc3)c3ccccc23)c1
Oc1cccc(Nc2nnc(Cc3ccncc3)c3ccccc23)c1
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1Cl
COc1cc(Nc2nnc(Cc3ccncc3)c3ccccc23)ccc1Cl
Cc1cc(C)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)c1
FC(F)(F)c1cc(Nc2nnc(Cc3ccncc3)c3ccccc23)ccc1Cl
FC(F)(F)c1cc(Br)cc(Nc2nnc(Cc3ccncc3)c3ccccc23)c1
Fc1cc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc(c1)C(F)(F)F
Cc1c[nH]c(\C=C2/C(=O)Nc3ccccc23)c1CCC(O)=O
Cc1c[nH]c(\C=C2/C(=O)Nc3cccc(C)c23)c1CCC(O)=O
Cc1c[nH]c(\C=C2/C(=O)Nc3ccc(Br)cc23)c1CCC(O)=O
COc1cccc(c1)-c1ccc2\C(=C\c3[nH]cc(C)c3CCC(O)=O)C(=O)Nc2c1
CCOc1cccc(c1)-c1ccc2\C(=C\c3[nH]cc(C)c3CCC(O)=O)C(=O)Nc2c1
Cc1c(CCC(O)=O)c[nH]c1\C=C1/C(=O)Nc2ccccc12
Cc1c(CCC(O)=O)c[nH]c1\C=C1/C(=O)Nc2ccc(cc12)C(O)=O
Cc1c(CCC(O)=O)c[nH]c1\C=C1/C(=O)Nc2ccc(cc12)S(N)(=O)=O
COc1ccc2\C(=C\c3[nH]cc(CCC(O)=O)c3C)C(=O)Nc2c1
Cc1c(CCC(O)=O)c[nH]c1\C=C1/C(=O)Nc2cc(ccc12)-c1ccccc1
COc1cccc(c1)-c1ccc2\C(=C\c3[nH]cc(CCC(O)=O)c3C)C(=O)Nc2c1
COc1ccccc1-c1ccc2\C(=C\c3[nH]cc(CCC(O)=O)c3C)C(=O)Nc2c1
COc1ccc(cc1)-c1ccc2\C(=C\c3[nH]cc(CCC(O)=O)c3C)C(=O)Nc2c1
Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(Br)cc23)c(C)c1CCC(O)=O
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)C(O)=O)c(C)c1CCC(O)=O
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(N)(=O)=O)c(C)c1CCC(O)=O
COc1ccc2\C(=C\c3[nH]c(C)c(CCC(O)=O)c3C)C(=O)Nc2c1
Cc1[nH]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2)c(C)c1CCC(O)=O
COc1cccc(c1)-c1ccc2\C(=C\c3[nH]c(C)c(CCC(O)=O)c3C)C(=O)Nc2c1
COc1ccccc1-c1ccc2\C(=C\c3[nH]c(C)c(CCC(O)=O)c3C)C(=O)Nc2c1
COc1ccc(cc1)-c1ccc2\C(=C\c3[nH]c(C)c(CCC(O)=O)c3C)C(=O)Nc2c1
O=C1Nc2ccccc2\C1=C\c1cc2CCCCc2[nH]1
Brc1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
OC(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1
COc1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
O=C1Nc2cc(ccc2\C1=C\c1cc2CCCCc2[nH]1)-c1ccccc1
COc1cccc(c1)-c1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
COc1ccccc1-c1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
COc1ccc(cc1)-c1ccc2\C(=C\c3cc4CCCCc4[nH]3)C(=O)Nc2c1
OC(=O)CCc1c(\C=C2/C(=O)Nc3ccccc23)[nH]c2CCCCc12
OC(=O)CCc1c(\C=C2/C(=O)Nc3ccc(Br)cc23)[nH]c2CCCCc12
NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(O)=O)c2c1
OC(=O)CCc1c(\C=C2/C(=O)Nc3ccc(cc23)C(O)=O)[nH]c2CCCCc12
COc1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
OC(=O)CCc1c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2)[nH]c2CCCCc12
COc1cccc(c1)-c1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
COc1ccccc1-c1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
COc1ccc(cc1)-c1ccc2\C(=C\c3[nH]c4CCCCc4c3CCC(O)=O)C(=O)Nc2c1
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S1(=O)CCNCC1
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S1(=O)CCN(CC1)C(N)=O
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=S1(=O)CCOCC1
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S1(=O)CCOCC1
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S1(=O)CCOCC1
Cc1ccc(F)c(NC(=O)c2cccc(c2)C#Cc2cc(cnc2N)C(=O)N=S2(=O)CCOCC2)c1
Nc1ncc(cc1C#Cc1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)C(F)(F)F)C(=O)N=S1(=O)CCOCC1
CC(C)(C)c1cc(NC(=O)c2cccc(c2)C#Cc2cc(cnc2N)C(=O)N=S2(=O)CCOCC2)no1
COc1cccc(NC(=O)c2cccc(c2)C#Cc2cc(cnc2N)C(=O)N=S2(=O)CCOCC2)c1
Fc1ccc(Nc2ncnc3NC(=O)\C(=C/c4ccc[nH]4)c23)cc1Cl
Cc1[nH]c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)c(C)c1CCC(O)=O
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)c1C
Cc1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)[nH]1
Cc1cc(CCC(O)=O)[nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc(F)c(Cl)c3)c12
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc(F)c(Cl)c3)c12)C(O)=O
Fc1ccc(Nc2ncnc3NC(=O)\C(=C/c4ccc([nH]4)C(=O)NCCN4CCOCC4)c23)cc1Cl
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc(F)c(Cl)c3)c12)C(=O)NCCN1CCOCC1
CN1C(=O)\C(=C/c2[nH]c(C)cc2C)c2c1ncnc2Nc1ccc(F)c(Cl)c1
CN1C(=O)\C(=C/c2[nH]c(cc2C)C(=O)NCCN2CCOCC2)c2c1ncnc2Nc1ccc(F)c(Cl)c1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc(F)c(Cl)c3)c12)C(=O)N1CCOCC1
CN1CCN(CC1)C(=O)c1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)[nH]1
CN1CCN(CC1)C(=O)c1[nH]c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)cc1C
CN1CCN(CC1)C(=O)c1c[nH]c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)c1C
CCN1CCN(CC1)C(=O)c1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)[nH]1
CCN(CC)CCNC(=O)c1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)[nH]1
CC1CN(CC(C)N1)C(=O)c1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)[nH]1
CCN(CC)CC(O)CNC(=O)c1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(F)c(Cl)c4)c23)[nH]1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3cccc(c3)C#C)c12)C(=O)NCCN1CCOCC1
CCN(CC)CCNC(=O)c1cc(C)c(\C=C2/C(=O)Nc3ncnc(Nc4ccc(Cl)cc4F)c23)[nH]1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc4CCCc4c3)c12)C(=O)N1CCOCC1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc4n(Cc5ccccc5)ccc4c3)c12)C(=O)N1CCOCC1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc4n(Cc5ccccc5)ncc4c3)c12)C(=O)N1CCOCC1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(Nc3ccc4n(Cc5ccccc5)ccc4c3)c12)C(=O)NCCN1CCOCC1
Cc1cc([nH]c1\C=C1/C(=O)Nc2ncnc(N3CCCCC3)c12)C(=O)N1CCOCC1
Oc1ccc(\C=C(/C#N)C(=O)Nc2ccccc2)cc1O
N=C(C(C#N)C#N)C(=Cc1ccc2[nH]ccc2c1)C#N |w:8.8|
CC(NC(=O)C(=C\c1ccc2[nH]ccc2c1)\C#N)c1ccccc1
Oc1ccc(cc1O)C(=O)C(=C\c1ccc2[nH]ccc2c1)\C#N
Oc1ccc(cc1O)C(=O)C(=C\c1c[nH]c2ccccc12)\C#N
N#CC(=Cc1c[nH]c2ccccc12)C#N |(2.53,2.99,;1.76,4.33,;.99,5.66,;-.55,5.66,;-1.64,4.57,;-.73,3.32,;-1.64,2.08,;-3.1,2.55,;-4.32,1.78,;-5.65,2.55,;-5.65,4.1,;-4.32,4.87,;-3.1,4.1,;1.76,6.99,;2.53,8.33,)|
NC(=S)C(=C\c1c[nH]c2ccccc12)\C#N
N=C(C(C#N)C#N)C(=Cc1c[nH]c2ccccc12)C#N |w:8.8|
O=C(\C(=C\c1c[nH]c2ccccc12)C#N)c1ccccc1
NC(=O)C(=C\c1c[nH]c2ccccc12)\C#N
Nc1[nH]nc(C(=Cc2c[nH]c3ccccc23)C#N)c1C#N |w:6.6|
N#C\C(=C/c1c[nH]c2ccccc12)c1nc2ccccc2s1
COc1ccc2nc(Cl)c(cc2c1)-c1ccccc1
Clc1nc2cc3OCOc3cc2cc1-c1ccccc1
COc1cc2nc(Cl)c(cc2c(OC)c1OC)-c1ccccc1
COc1ccc(OC)c2nc(Cl)c(cc12)-c1ccccc1
COc1cc2cc(c(Cl)nc2cc1OC)-c1ccccc1
COc1cc2cc(-c3ccccc3)c(nc2cc1OC)-c1ccccc1
COC(=O)c1cc2cc(OC)c(OC)cc2nc1-c1ccc(cc1)[N+]([O-])=O
O=C(Cc1ccccc1)Nc1cnc2ccccc2c1
N#C\[#6](=[#6]\c1ccnc2ccccc12)C#N
N#C\[#6](=[#6]\c1cccc2ccccc12)C#N
NC(=O)C(=C\c1cccc2ccccc12)\C#N
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCN(C)CC3)cc2nc1N
CCNC(=O)Nc1nc2cc(NCCCN3CCN(C)CC3)ncc2cc1-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCN(C)CC3)cc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCN3CCOCC3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCN3CCN(C)CC3)cc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCCCNc1cc2nc(N)c(cc2cn1)-c1cc(OC)cc(OC)c1
CCNC(=O)Nc1nc2cc(NCCCCN(CC)CC)ncc2cc1-c1cc(OC)cc(OC)c1
CCN(CC)CCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCN3CCOCC3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCN3CCN(C)CC3)cc2nc1NC(=O)NC(C)(C)C
CCN(CC)CCCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1cc(OC)cc(OC)c1
CN1CCN(CCCNc2cc3nc(N)c(cc3cn2)-c2ccccc2)CC1
CN1CCN(CCCNc2cc3nc(NC(=O)NC(C)(C)C)c(cc3cn2)-c2ccccc2)CC1
CN1CCN(CCCNc2cc3nc(NCCCN4CCN(C)CC4)c(cc3cn2)-c2ccccc2)CC1
CCN(CC)CCCCNc1cc2nc(N)c(cc2cn1)-c1ccccc1
CCN(CC)CCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1ccccc1
CN1CCN(CCCNc2cc3nc(N)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-11.94,-2.96,;-10.6,-2.19,;-10.6,-.65,;-9.27,.12,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,;-7.94,-2.19,;-9.27,-2.96,)|
CCNC(=O)Nc1nc2cc(NCCCN3CCN(C)CC3)ncc2cc1-c1c(Cl)cccc1Cl |(2.8,-4.2,;3.88,-3.12,;3.88,-1.58,;5.22,-.81,;6.55,-1.58,;5.22,.73,;3.88,1.5,;2.55,.73,;1.22,1.5,;-.12,.73,;-1.45,1.5,;-2.78,.73,;-4.27,1.13,;-5.36,.04,;-6.85,.44,;-7.94,-.65,;-9.27,.12,;-10.6,-.65,;-10.6,-2.19,;-11.94,-2.96,;-9.27,-2.96,;-7.94,-2.19,;-1.45,3.05,;-.12,3.82,;1.22,3.05,;2.55,3.82,;3.88,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
CN1CCN(CCCNc2cc3nc(NC(=O)NC(C)(C)C)c(cc3cn2)-c2c(Cl)cccc2Cl)CC1 |(-11.94,-2.96,;-10.6,-2.19,;-10.6,-.65,;-9.27,.12,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;5.22,-.81,;6.55,-1.58,;3.88,-1.58,;3.88,-3.12,;2.55,-3.89,;5.22,-3.89,;3.88,-4.66,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,;-7.94,-2.19,;-9.27,-2.96,)|
CCN(CC)CCCCNc1cc2nc(N)c(cc2cn1)-c1c(Cl)cccc1Cl |(-11.31,1.64,;-9.82,1.24,;-9.42,-.25,;-10.51,-1.34,;-12,-.94,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
CCNC(=O)Nc1nc2cc(NCCCCN(CC)CC)ncc2cc1-c1c(Cl)cccc1Cl |(2.55,-3.89,;3.88,-3.12,;3.88,-1.58,;5.22,-.81,;6.55,-1.58,;5.22,.73,;3.88,1.5,;2.55,.73,;1.22,1.5,;-.12,.73,;-1.45,1.5,;-2.78,.73,;-4.27,1.13,;-5.36,.04,;-6.85,.44,;-7.94,-.65,;-9.42,-.25,;-9.82,1.24,;-11.31,1.64,;-10.51,-1.34,;-12,-.94,;-1.45,3.05,;-.12,3.82,;1.22,3.05,;2.55,3.82,;3.88,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
CCN(CC)CCCCNc1cc2nc(NC(=O)NC(C)(C)C)c(cc2cn1)-c1c(Cl)cccc1Cl |(-11.31,1.64,;-9.82,1.24,;-9.42,-.25,;-10.51,-1.34,;-12,-.94,;-7.94,-.65,;-6.85,.44,;-5.36,.04,;-4.27,1.13,;-2.78,.73,;-1.45,1.5,;-.12,.73,;1.22,1.5,;2.55,.73,;3.88,1.5,;5.22,.73,;5.22,-.81,;6.55,-1.58,;3.88,-1.58,;3.88,-3.12,;2.55,-3.89,;5.22,-3.89,;3.88,-4.66,;3.88,3.05,;2.55,3.82,;1.22,3.05,;-.12,3.82,;-1.45,3.05,;5.22,3.82,;6.52,3,;6.47,1.46,;7.88,3.72,;7.94,5.26,;6.63,6.08,;5.27,5.35,;3.97,6.17,)|
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCOCc1ccccc1)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCOCc1ccccc1)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCCOCc1ccccc1)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCO)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCO)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(cc2nc1NC(=O)NC(C)(C)C)N(CCCCCO)C(C)=O
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCOCc3ccccc3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCOCc3ccccc3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCOCc3ccccc3)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCO)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCO)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCCCO)cc2nc1NC(=O)NC(C)(C)C
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCOCc1ccccc1)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCOCc1ccccc1)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCCOCc1ccccc1)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCO)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCO)C(C)=O |c:20|
COc1cc(OC)cc(c1)C1Cc2cnc(cc2N=C1NC(=O)NC(C)(C)C)N(CCCCCO)C(C)=O |c:20|
CCNC(=O)Nc1nc2nc(NCCCN3CCN(C)CC3)ncc2cc1-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCN3CCN(C)CC3)nc2nc1NC(=O)NC(C)(C)C
CCNC(=O)Nc1nc2nc(NCCCCN(CC)CC)ncc2cc1-c1cc(OC)cc(OC)c1
CCN(CC)CCCCNc1ncc2cc(c(NC(=O)NC(C)(C)C)nc2n1)-c1cc(OC)cc(OC)c1
COc1cc(OC)cc(c1)-c1cc2cnc(NCCCO)nc2nc1NC(=O)NC(C)(C)C
OCCCNc1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1
OCCCCNc1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1
CN(C)CCNc1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1
Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCc3cccnc3)c2)c1
Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCn3cccn3)c2)c1
Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCn3cncn3)c2)c1
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
Cn1c2nc(Nc3ccc(F)cc3)ncc2cc(-c2c(Cl)cccc2Cl)c1=O |(-.18,-.45,;-.18,1.09,;-1.51,1.86,;-2.84,1.08,;-4.18,1.85,;-5.51,1.08,;-6.84,1.86,;-6.84,3.4,;-8.18,4.17,;-9.51,3.4,;-10.84,4.17,;-9.51,1.86,;-8.18,1.08,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,)|
CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(-13.51,4.17,;-12.18,3.4,;-10.84,4.17,;-9.51,3.4,;-9.51,1.86,;-8.18,1.08,;-6.84,1.86,;-5.51,1.08,;-4.18,1.85,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,;-.18,1.09,;-.18,-.45,;-1.51,1.86,;-2.84,1.08,;-6.84,3.4,;-8.18,4.17,)|
CCN(CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1)C(C)=O |(-17.51,3.4,;-16.18,4.17,;-14.85,3.4,;-13.51,4.17,;-12.18,3.4,;-10.84,4.17,;-9.51,3.4,;-9.51,1.86,;-8.18,1.08,;-6.84,1.86,;-5.51,1.08,;-4.18,1.85,;-4.18,3.39,;-2.84,4.16,;-1.51,3.4,;-.18,4.17,;1.16,3.4,;2.49,4.17,;2.49,5.71,;1.16,6.48,;3.83,6.48,;5.16,5.71,;5.16,4.17,;3.83,3.39,;3.83,1.85,;1.16,1.86,;2.49,1.09,;-.18,1.09,;-.18,-.45,;-1.51,1.86,;-2.84,1.08,;-6.84,3.4,;-8.18,4.17,;-14.85,1.86,;-13.51,1.09,;-16.18,1.09,)|
Cc1cc(ccc1F)Nc2ncc3c(n2)N(C(=O)C(=C3)c4c(cccc4Cl)Cl)C
COc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
COc1ccc2cc([nH]c2c1)C(=O)c1cc2ccccc2[nH]1
COc1cccc2cc([nH]c12)C(=O)c1cc2ccccc2[nH]1
COc1ccc2[nH]c(cc2c1)C(=O)c1cc2cc(OC)ccc2[nH]1
Cc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
COc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2s1
COc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2o1
O=C(c1cc2ccccc2s1)c1cc2ccccc2s1
Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(c1cc2ccccc2[nH]1)c1cc2cc(OCc3ccccc3)ccc2[nH]1
CCOc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(c1cc2ccccc2[nH]1)c1cc2cc(OCCN3CCOCC3)ccc2[nH]1
CN(C)CCCOc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
ICCCCOc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
CN(C)CCOc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(c1cc2ccccc2[nH]1)c1cc2cc(OCC3CCCCC3)ccc2[nH]1
ICCCCCOc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
CC(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccccc1
O=C(c1cc2ccccc2[nH]1)c1cc2cc(OCCN3CCCCC3)ccc2[nH]1
CC(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
COc1ccc(cc1)C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
CCCC(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
CN(C)CC(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
CCC(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(Cc1cccs1)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
CC(=O)Oc1ccccc1C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccc(cc1)-c1ccccc1
O=C(CCc1ccccc1)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
[H]C(OC(C)=O)(C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccccc1 |w:1.0|
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccccc1
COc1cccc(CC(=O)Oc2ccc3[nH]c(cc3c2)C(=O)c2cc3ccccc3[nH]2)c1
Clc1ccccc1C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
[O-][N+](=O)c1ccc(cc1)C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
COc1cc(cc(OC)c1OC)C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)\C=C\c1ccccc1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccco1
COCC(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccc2ccccc2n1
CCOc1ccc(cc1)C(=O)Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)C1CC1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)C1CCC1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1cccnc1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)C(c1ccccc1)c1ccccc1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccccc1Oc1ccccc1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1cccc(Oc2ccccc2)c1
O=C(Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccccc2[nH]1)c1ccccc1C(=O)c1ccccc1
O=C(Nc1ccccn1)Nc1cccc2C(=O)N3CCC[C@@H]3c12 |r|
c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
Cc1ccc(F)c(C(=O)n2nc(Nc3ccc(cc3)S(N)(=O)=O)nc2N)c1F
Cc1ccsc1C(=O)n1nc(Nc2ccc(cc2)S(N)(=O)=O)nc1N
c1cc(c(c(c1)F)NC(=S)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
COc1ccc2NC(=O)C(=Cc3cnc[nH]3)c2c1 |w:10.10|
COc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
CC(C)NS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
OC(=O)c1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Fc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Clc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Brc1ccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c2c1
Cc1cccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c12
OCCc1cccc2NC(=O)\C(=C/c3[nH]cc4c3CCOC4=O)c12
O=C1Nc2cccc(C3CCNCC3)c2\C1=C\c1[nH]cc2c1CCOC2=O
COc1ccc2\C(=C\c3[nH]cc4c3CCOC4=O)C(=O)Nc2c1
O=C1Nc2cc(ccc2\C1=C\c1[nH]cc2c1CCOC2=O)-c1ccccc1
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)-c1nnn(CCCO)n1
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)c1
Cc1cccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)c1
CC(C)(C)c1ccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)cc1
Nc1ncc2CN(CCc2n1)c1cccc(c1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1ccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)cc1
COc1cccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)c1
CCc1ccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)cc1
CCc1cccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)c1
CCCc1ccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)cc1
CN1CCC(CC1)Oc1ccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)cc1
CC(C)c1ccc(NC(=O)c2cccc(c2)N2CCc3nc(N)ncc3C2)cc1
CCCCNC(=O)c1cccc(c1)N1CCc2nc(N)ncc2C1
CC(C)(C)C1CCC(CC1)NC(=O)c1cccc(c1)N1CCc2nc(N)ncc2C1 |(9.34,-.77,;8,-1.54,;8,-3.08,;9.34,-2.31,;6.67,-.77,;5.33,-1.54,;4,-.77,;4,.77,;5.33,1.54,;6.67,.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,.77,;-4,.77,;-5.33,1.54,;-6.67,.77,;-6.67,-.77,;-8,-1.54,;-8,-3.08,;-9.34,-3.85,;-6.67,-3.85,;-5.33,-3.08,;-5.33,-1.54,;-4,-.77,)|
Nc1ncc2CN(CCc2n1)c1cccc(c1)C(=O)NCC1CCCCC1
Nc1ncc2CN(CCc2n1)c1cccc(c1)C(=O)NC1CCCC1
CC(C)(C)CCNC(=O)c1cccc(c1)N1CCc2nc(N)ncc2C1
CCN(CC)C(=O)c1cccc(c1)N1CCc2nc(N)ncc2C1
Cc1cccc(NC(=O)c2cccc(n2)N2CCc3nc(N)ncc3C2)c1
CC(C)c1ccc(NC(=O)c2cc(ccn2)N2Cc3cnc(N)nc3C2)cc1
Cc1ccc(cc1N1CCc2nc(N)ncc2C1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1cc(cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F)N1CCc2nc(N)ncc2C1
CC(C)c1cccc(NC(=O)c2ccc(C)c(c2)N2CCc3nc(N)ncc3C2)c1
CC(C)c1cccc(NC(=O)c2cc(C)cc(c2)N2CCc3nc(N)ncc3C2)c1
FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(cc1)N1CCc2ccncc2C1
Cc1cccc(NC(=O)Nc2ccc(cc2)N2CCc3ccncc3C2)c1
O=C(Nc1ccccc1)Nc1ccc(cc1)N1CCc2ccncc2C1
Cc1ccc(NC(=O)Nc2ccc(cc2)N2CCc3ccncc3C2)cc1
Cc1cccc(NC(=O)Nc2ccc(N3CCc4ccncc4C3)c(C)c2)c1
Cc1cccc(NC(=O)Nc2ccc(cc2C)N2CCc3ccncc3C2)c1
CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3ccncc3C2)c1
COC(=O)c1cncc2CN(CCc12)c1cccc(c1)C(=O)Nc1cccc(c1)C(C)C
Nc1ncc2CN(CCc2n1)c1cccc(c1)C(=O)Nc1ccc(F)c(c1)C(F)(F)F
Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)C(=O)N=S(C)(C)=O)c1
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(F)c(Cl)c3)ccc2s1
Cc1ccc(F)c(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)C(=O)N=S(C)(C)=O)c1
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccccc3)ccc2s1
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)ccc2s1
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cc(ccc3F)C(F)(F)F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cccc(c3)C(F)(F)F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cc(ccc3F)C(F)(F)F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cc(C)ccc3F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cccc(C)c3)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(F)c(Cl)c3)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(C)cc3)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccccc3F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccccc3)ccc2s1
Nc1ncc(cc1-c1cc2cc(NC(=O)Nc3ccc(F)c(Cl)c3)ccc2s1)C(O)=O
Cc1ccc(F)c(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)C(O)=O)c1
Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)C(O)=O)c1
Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)C(N)=O)c1
COC(=O)CCCNC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cccc(C)c3)ccc2s1
COC(=O)CCCCCNC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cccc(C)c3)ccc2s1
CC1(C)OB(OC1(C)C)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cc(ccc3F)C(F)(F)F)ccc2s1
CC1(C)OB(OC1(C)C)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cccc(c3)C(F)(F)F)ccc2s1
CC1(C)OB(OC1(C)C)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)ccc2s1
Cc1ccc(F)c(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B2OC(C)(C)C(C)(C)O2)c1
CC1(C)OB(OC1(C)C)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(F)c(Cl)c3)ccc2s1
CCc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B2OC(C)(C)C(C)(C)O2)c1
Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B2OC(C)(C)C(C)(C)O2)c1
CC1(C)OB(OC1(C)C)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccccc3)ccc2s1
Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B(O)O)c1
Nc1ncc(cc1-c1cc2cc(NC(=O)Nc3ccccc3)ccc2s1)B(O)O
Cc1ccoc1C(=O)Nc1ccc2sc(cc2c1)-c1cc(cnc1N)C(=O)N=S(C)(C)=O
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3ccc(Cl)c(c3)C(F)(F)F)ccc2s1
Cc1ccc(F)c(c1)C(=O)Nc1ccc2sc(cc2c1)-c1cc(cnc1N)C(=O)N=S(C)(C)=O
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3ccccc3)ccc2s1
Cc1cccc(c1)C(=O)Nc1ccc2sc(cc2c1)-c1cc(cnc1N)C(=O)N=S(C)(C)=O
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3cc(ccc3F)C(F)(F)F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3occc3C)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3cccc(C)c3)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3cc(C)ccc3F)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3ccccc3)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3ccc(F)c(Cl)c3)ccc2s1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3cc(ccc3F)C(F)(F)F)ccc2s1
Cc1cccc(c1)C(=O)Nc1ccc2sc(cc2c1)-c1cccnc1N
Nc1ncccc1-c1cc2cc(NC(=O)c3ccccc3)ccc2s1
Cc1cccc(NC(=O)c2ccc3sc(cc3c2)-c2cccnc2N)c1
COC(=O)CCCC[S@](C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cccc(C)c3)ccc2s1 |r|
COC(=O)CCCC[S@](C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3cc(C)ccc3F)ccc2s1 |r|
COC(=O)CCCC[S@](C)(=O)=NC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(F)c(Cl)c3)ccc2s1 |r|
Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)C(=O)N=S(=O)(CCCO)CCCO)c1
CS(C)(=O)=NC(=O)c1cncc(c1)-c1cc2cc(NC(=O)Nc3cc(ccc3F)C(F)(F)F)ccc2s1
CS(C)(=O)=NC(=O)c1cncc(c1)-c1cc2cc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)ccc2s1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cc(cnc2N)C(=O)N=S(=O)(CCCO)CCCO)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cc(cnc2N)C(=O)N=S(C)(C)=O)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cc(cnc2N)B(O)O)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cc(cnc2N)B2OC(C)(C)C(C)(C)O2)c1
CC1(C)OB(OC1(C)C)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2ccccc2)cc1
COP(=O)(OC)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
CCOP(=O)(OCC)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
COP(=O)(OC)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
COP(=O)(OC)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
COP(=O)(OC)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2ccccc2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2cc(cnc2N)C(=O)N=S(=O)(CCCO)CCCO)c1
COC(=O)CCCCS(=O)(CCCCC(=O)OC)=NC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
COC(=O)CCCCS(=O)(CCCCC(=O)OC)=NC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
COC(=O)CCCCS(=O)(CCCCC(=O)OC)=NC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
COC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
COC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
COC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
COC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2ccccc2)cc1
COc1ccc(-c2ccc(NC(=O)Nc3cc(C)ccc3F)cc2)c2c(N)noc12
COc1ccc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2)c2c(N)noc12
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
C/C(=C\c1coc2c1c(nc(n2)N)N)/c3ccccc3OC
C/C(=C/c1coc2c1c(nc(n2)N)N)/c3ccccc3OC
CCC\C(=C\c1coc2nc(N)nc(N)c12)c1ccccc1OC
CC(C)/C(=C/c1coc2c1c(nc(n2)N)N)/c3ccccc3OC
COc1ccccc1\C(=C/c1coc2nc(N)nc(N)c12)C1CC1
CCCC\C(=C\c1coc2nc(N)nc(N)c12)c1ccccc1OC
COc1ccccc1\C(CC(C)C)=C/c1coc2nc(N)nc(N)c12
CCC(C)C(=C\c1coc2nc(N)nc(N)c12)\c1ccccc1OC
CCCC(Cc1coc2nc(N)nc(N)c12)c1ccccc1OC
COc1ccccc1C(Cc1coc2nc(N)nc(N)c12)C(C)C
COc1ccccc1C(Cc1coc2nc(N)nc(N)c12)C1CC1
CCCCC(Cc1coc2nc(N)nc(N)c12)c1ccccc1OC
COc1ccccc1C(CC(C)C)Cc1coc2nc(N)nc(N)c12
CCC(C)C(Cc1coc2nc(N)nc(N)c12)c1ccccc1OC
Cc1cc2ncc(nc2cc1C)-c1ccccc1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
[H][C@@]12C[C@@H]([C@H](OC)[C@@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |TLB:11:10:9:4.3.2,17:33:9:4.3.2,THB:24:32:9:4.3.2,5:4:9:10.31.33.32,30:31:9:4.3.2|
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
CCNCCCCNc1ncc2CN(C(=O)N(Cc3cccc(NC(=O)C=C)c3)c2n1)c1c(Cl)c(OC)cc(OC)c1Cl
CCNCCCCNc1ncc2CN(C(=O)N(Cc3cccc(NC(=O)CC)c3)c2n1)c1c(Cl)c(OC)cc(OC)c1Cl
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccccc3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCC4CCCC4)cc3)nnc2c1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
Cc1cc(O)cc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CN1CCN(CCOc2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)c2)CC1
CN1CCN(CCCOc2cccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)c2)CC1
CN1CCN(CCCOc2ccc(Nc3nnc4cc(cc(C)c4n3)-c3c(C)cccc3C)cc2)CC1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(o3)C(=O)NCCN3CCCC3)nnc2c1
CN1CCN(CC1)S(=O)(=O)c1cccc(Nc2nnc3cc(ccc3n2)-c2c(C)cccc2C)c1
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3nc(cs3)C(=O)NCCN3CCCC3)nnc2c1
Cc1cccc(C)c1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C |(-5.05,5.05,;-6.38,4.28,;-7.71,5.05,;-9.05,4.28,;-9.04,2.74,;-7.71,1.97,;-7.71,.43,;-6.38,2.75,;-5.05,1.97,;-3.72,2.74,;-2.39,1.98,;-1.05,2.77,;.3,1.99,;.31,.43,;1.65,-.33,;2.98,.44,;4.31,-.33,;5.64,.44,;5.63,1.99,;4.29,2.75,;2.96,1.97,;6.96,2.76,;6.19,4.09,;7.73,1.43,;8.3,3.53,;9.63,2.75,;10.97,3.52,;12.3,2.75,;12.46,1.23,;13.97,.91,;14.74,2.24,;13.71,3.39,;-1.03,-.34,;-2.38,.43,;-3.72,-.34,;-5.05,.43,;-6.38,-.34,)|
Cc1ccccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
CC(=O)Nc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(C)cccc1C
COc1ccc(Cl)c(c1)-c1cc2nnc(Nc3ccc(cc3)C(=O)N3CCN(C)CC3)nc2cc1C
Cc1cccc(C)c1-c1cc(NS(C)(=O)=O)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cc(Cl)ccc2C)cc1
CN1CCN(CC1)C(=O)c1ccc(Nc2nnc3cc(c(C)cc3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Cc1ccc(F)cc1-c1cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc2cc1C
Cc1cc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2cc1-c1cccc(O)c1
Cc1cc(cc2nnc(Nc3cccnc3)nc12)-c1cc(O)ccc1Cl
Cc1cc(F)ccc1-c1cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc2cc1C
CC(=O)Nc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(C)cccc1C
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(o3)C(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
COc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1ccccc1C
CN(C)CCNC(=O)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)c1
CN(C)c1cccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)c1
Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc2nc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nnc2cc1-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(nc3)N3CCOCC3)nc12)-c1cc(O)ccc1Cl
CN(CCN1CCCC1)S(=O)(=O)c1ccc(Nc2nnc3cc(cc(C)c3n2)-c2cc(O)ccc2Cl)cc1
Cc1cc2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2cc1-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)CCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)C3CCNCC3)nc12)-c1cc(O)ccc1Cl
Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1c(Cl)ccc(O)c1Cl
CN1CCN(CC1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
Cc1ccc(NC(=O)c2ccc3C(CCc3c2)N2CCN(CC2)C(=O)OC(C)(C)C)cc1Nc1nccc(n1)-c1cccnc1
Cc1ccc(NC(=O)c2ccc3C(CCc3c2)N2CCNCC2)cc1Nc1nccc(n1)-c1cccnc1
CCN1CCN(CC1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
CC(C)N1CCN(CC1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
Cc1ccc(NC(=O)c2ccc3C(CCc3c2)N2CCN(CCO)CC2)cc1Nc1nccc(n1)-c1cccnc1
CC(=O)N1CCN(CC1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
CN1CCN(CC1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cncnc2)c1
CN(C)C1CCN(C1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
CN(C)[C@@H]1CCN(C1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 |r|
CN1CCN(CC1)[C@H]1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 |r|
CN1CCN(CC1)C1CCc2cc(ccc12)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2ccncc2)c1
CCN1CCN(Cc2ccc(NC(=O)c3cccc(c3)-c3ccc4nc(NC(=O)C5CC5)sc4n3)cc2C(F)(F)F)CC1
Nc1ccc(cc1)-c1n[nH]c-2c1Cc1sccc-21
Oc1cccc(Cc2ccc(cc2)-c2n[nH]c-3c2Cc2sccc-32)c1
COc1ccc(cc1)-c1cc-2c(Cc3c-2[nH]nc3-c2ccc(OC)cc2)s1
COc1ccc(cc1)-c1n[nH]c-2c1Cc1sc(cc-21)-c1cccnc1
COc1ccc(cc1)-c1n[nH]c-2c1Cc1sc(cc-21)-c1ccc(N)nc1
COc1ccc(cc1)-c1n[nH]c-2c1Cc1sc(cc-21)-c1ccc(NC(=O)CN2CCCC2)nc1
NC(=O)c1c(NC(=O)NCCCN2CCOCC2)snc1-c1ccc([NH2+][O-])cc1
NC(=O)c1c(NC(=O)NCCCN2CCOCC2)snc1-c1ccc(N)cc1
NC(=O)c1c(NC(=O)NCCCN2CCOCC2)snc1-c1ccc(NC(=O)Nc2ccccc2)cc1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2nsc(NC(=O)NCCCN3CCOCC3)c2C(N)=O)c1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2nsc(NC(=O)NCCCN3CCOCC3)c2C(N)=O)c1
NC(=O)c1c(NC(=O)NCCCN2CCOCC2)snc1-c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nsc(NC(=O)NCCCN3CCOCC3)c2C(N)=O)cc1
COCCCNC(=O)Nc1snc(c1C(N)=O)-c1ccc(N)cc1
NC(=O)c1c(NC(=O)NCCCN2CCOCC2)snc1-c1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nsc(NC(=O)NCCCC(O)=O)c2C(N)=O)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nsc(NC(=O)NCCCO)c2C(N)=O)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nsc(N)c2C(N)=O)cc1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2nsc(N)c2C(N)=O)c1
NC(=O)c1c(N)snc1-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
NC(=O)c1c(N)snc1-c1cccc(NC(=O)Nc2ccccc2)c1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nsc(NC(=O)NCCCN3CCCC3)c2C(N)=O)cc1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2snc(N)c2C(N)=O)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2snc(NCCCN3CCOCC3)c2C(N)=O)c1
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1ccccc1
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1ccccc1Cl
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1cccc(Cl)c1
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1ccccc1F
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1ccc(F)cc1
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
COc1ccccc1N1CCN(CC(O)COc2ncnc3ccccc23)CC1
COc1cccc(c1)N1CCN(CC(O)COc2ncnc3ccccc23)CC1
COc1ccc(cc1)N1CCN(CC(O)COc2ncnc3ccccc23)CC1
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1cccc(c1)C(F)(F)F
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1cccc(Cl)c1Cl
OC(COc1ncnc2ccccc12)CN1CCN(CC1)c1ccc(Cl)c(Cl)c1
Cc1ccc(N2CCN(CC(O)COc3ncnc4ccccc34)CC2)c(C)c1
OC(COc1ncnc2ccccc12)CN1CCN(Cc2ccccc2)CC1
CN1CCN(CC(O)COc2ncnc3ccccc23)CC1
CCN1CCN(CC(O)COc2ncnc3ccccc23)CC1
CN(C)CC(O)COc1ncnc2ccccc12
OC(COc1ncnc2ccccc12)CN1CCOCC1
OC(COc1ncnc2ccccc12)CN1CCCCC1
OC(COc1ncnc2ccccc12)Cn1ccnc1
Cc1nccn1CC(O)COc1ncnc2ccccc12
Cc1cn(CC(O)COc2ncnc3ccccc23)cn1
COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(C)on4)c(Cl)c3)c2cc1OC
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCC(=O)NO
Cc1cccc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nc(N)cn3n2)c1
FC(F)(F)c1cccc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nccn3n2)c1
Cc1cccc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nccn3n2)c1
Nc1cn2nc(ccc2n1)C#Cc1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
FC(F)(F)c1cc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nccn3n2)ccc1Cl
O=C(Nc1ccccc1)Nc1ccc(cc1)C#Cc1ccc2nccn2n1
Fc1ccc(cc1NC(=O)Nc1ccc(cc1)C#Cc1ccc2nccn2n1)C(F)(F)F
Fc1ccc(cc1NC(=O)Nc1cn2nc(ccc2n1)C#Cc1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1)C(F)(F)F
Cc1ccc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nccn3n2)cc1
Nc1ccc(cc1)C#Cc1ccc2nc(NC(=O)Nc3ccc(F)c(Cl)c3)cn2n1
Fc1ccc(NC(=O)Nc2cn3nc(ccc3n2)C#Cc2ccc(NC(=O)Nc3ccc(F)c(Cl)c3)cc2)cc1Cl
Nc1cn2nc(ccc2n1)C#Cc1ccc(NC(=O)c2ccccc2)cc1
Cc1ccc(F)c(c1)C(=O)Nc1ccc(cc1)C#Cc1ccc2nc(N)cn2n1
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1ccc2nc(N)cn2n1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)C#Cc1ccc2nccn2n1
Cc1cccc(c1)C(=O)Nc1cccc(c1)C#Cc1ccc2nccn2n1
Fc1ccc(cc1Cl)C(=O)Nc1cccc(c1)C#Cc1ccc2nccn2n1
O=C(Nc1cccc(c1)C#Cc1ccc2nccn2n1)c1cc2ccccc2o1
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1ccc2nccn2n1
O=C(Nc1cccc(c1)C#Cc1ccc2nccn2n1)c1ccccc1
Cc1ccc(cc1)C(=O)Nc1cccc(c1)C#Cc1ccc2nccn2n1
Cc1ccc(F)c(NC(=O)Nc2cccc(c2)C#Cc2ccc3nccn3n2)c1
Cc1ccc(F)c(NC(=O)Nc2ccccc2C#Cc2ccc3nccn3n2)c1
CC(=O)Nc1cn2nc(ccc2n1)C#Cc1ccc(NC(=O)Nc2cccc(C)c2)cc1
Cc1cccc(NC(=O)Nc2ccc(cc2)C#Cc2ccc3nc(NC(=O)C4CC4)cn3n2)c1
CSc1nc(N)cc(Oc2ccc(cc2)-c2nnc(Nc3cccc(c3)C(F)(F)F)[nH]2)n1
Cc1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccccc32)c1
CCc1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccccc32)c1
CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccccc32)c1
CC(C)c1ccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccccc32)cc1
FC(F)(F)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccccc32)c1
CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2cc(CO)c(CO)cc32)c1
CC(C)c1ccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2cc(CO)c(CO)cc32)cc1
CCc1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccsc32)c1
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S(C)(C)=O
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=S(C)(C)=O
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=S1(=O)CCCC1
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S1(=O)CCCC1
CS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1
Cc1ccc(F)c(c1)C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S(C)(C)=O
Cc1cccc(NC(=O)Nc2cccc(c2)C#Cc2cncc(c2)C(=O)N=S(C)(C)=O)c1
Cc1ccc(NC(=O)Nc2cccc(c2)C#Cc2cncc(c2)C(=O)N=S(C)(C)=O)cc1
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=S(=O)(CCCO)CCCO
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cc(cnc1N)C(=O)N=S(=O)(CCCO)CCCO
Cc1cccc(c1)C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=S(=O)(CCCO)CCCO
Cc1cccc(NC(=O)c2cccc(c2)C#Cc2cc(cnc2N)C(=O)N=S(=O)(CCCO)CCCO)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2occc2C)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2cc(C)ccc2F)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2cccc(C)c2)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2cc(ccc2F)C(F)(F)F)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2ccc(Cl)c(c2)C(F)(F)F)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2cccc(OC)c2)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2ccc(OC)c(OC)c2)c1
COC(=O)CCCC[S@](C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2occc2C)c1 |r|
COC(=O)CCCC[S@@](C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)c2occc2C)c1 |r|
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cccc(C)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)Nc2cc(C)ccc2F)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(NC(=O)Nc2cccc(C)c2)c1
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=S(C)(=O)CCCO
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=[S@@](C)(=O)CCCO |r|
Cc1ccoc1C(=O)Nc1cccc(c1)C#Cc1cncc(c1)C(=O)N=[S@](C)(=O)CCCO |r|
Cc1ccc(F)c(NC(=O)Nc2cccc(c2)C#Cc2cncc(c2)C(=O)N=S(C)(C)=O)c1
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cc(C)ccc1F
COC(=O)CCCCS(C)(=O)=NC(=O)c1cnc(N)c(c1)C#Cc1cccc(c1)C(=O)Nc1cc(on1)C(C)(C)C
COc1ccc(Nc2ncc3CN(CCc3n2)C(=O)c2cccnc2)cc1
COc1ccccc1Nc1ncc2CN(CCc2n1)C(=O)c1cccnc1
Cn1nccc1Nc1ncc2CN(CCc2n1)C(=O)c1cccnc1
Fc1cccc(Nc2ncc3CN(CCc3n2)C(=O)c2cccnc2)c1
COc1cc(Nc2ncc3CN(CCc3n2)C(=O)c2occc2C)cc(OC)c1OC
COc1cc(Nc2ncc3CN(CCc3n2)C(=O)c2cc(C)nn2C)cc(OC)c1OC
COc1cc(Nc2ncc3CN(CCc3n2)C(=O)c2ccccc2)cc(OC)c1OC
COc1cc(Nc2ncc3CN(CCc3n2)C(=O)c2cccnc2)cc(OC)c1OC
O=C(Nc1cccnc1)N1CCc2nc(Nc3ccccc3)ncc2C1
O=C(N1CCc2nc(Nc3ccccc3)ncc2C1)c1cccnc1
COc1cccc(Nc2ncc3CN(CCc3n2)C(=O)c2cccnc2)c1
COc1cc(Nc2ncc3CN(CCc3n2)C(=O)c2ccccn2)cc(OC)c1OC
COc1ccc(Nc2ncc3CN(CCc3n2)C(=O)c2cccnc2)cc1OC
COc1cc(Nc2ncc3CN(CCc3n2)C(=O)c2cccnc2)cc(OC)c1
COC(=O)N1CCc2nc(Nc3cc(OC)c(OC)c(OC)c3)ncc2C1
CC(C)(C)c1ccc(cc1)-n1cccc(N2CCc3nc(N)ncc3C2)c1=O
Cc1cc[nH]c(=O)c1N1CCc2nc(N)ncc2C1
Cc1ccn(-c2ccc(cc2)C(C)(C)C)c(=O)c1N1CCc2nc(N)ncc2C1
CN(C)c1cccc(c1)-n1ccc(C)c(N2CCc3nc(N)ncc3C2)c1=O
Cc1ccoc1C(=O)Nc1ccc(cc1)-n1ccc(C)c(N2CCc3nc(N)ncc3C2)c1=O
Nc1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
CSc1ncc2CN(CCc2n1)c1cc(ccc1C)C(=O)Nc1cccc(c1)C(F)(F)F
CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
FC(F)(F)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
O=C(Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21)c1ccccc1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21
Cc1cccc(NC(=O)Nc2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1NC(=O)c1cccc2c(N)nccc12
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2[nH]c3ccccc3c2C(N)=O)c1
NC(=O)c1c([nH]c2ccccc12)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2[nH]c3ccccc3c2C(N)=O)c1
CCc1cccc(NC(=O)Nc2ccc(cc2)-c2[nH]c3ccccc3c2C(N)=O)c1
Cc1ccoc1C(=O)Nc1cccc(c1)-c1[nH]c2ccccc2c1C(N)=O
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3ccccc3)c21
CC(C)c1ccccc1Nc1nc(N)nc2Cc3ccccc3-c12
CC(C)c1ccc(Nc2nc(N)nc3Cc4ccccc4-c23)cc1
Nc1nc2Cc3ccccc3-c2c(Nc2cccc(Br)c2)n1
Nc1nc2Cc3ccccc3-c2c(Nc2ccc(Cl)cc2F)n1
Nc1nc2Cc3ccccc3-c2c(Nc2ccc(Cl)cc2)n1
Nc1nc2Cc3ccccc3-c2c(Nc2cccc(Cl)c2)n1
CN(C)c1ccc(\C=C2\C(=O)Nc3ccccc23)cc1
Nc1nc2Cc3ccccc3-c2c(Nc2ccccc2)n1
COc1cccc(Nc2nc(N)nc3Cc4ccccc4-c23)c1
Nc1nc2Cc3ccccc3-c2c(Nc2cccc(F)c2)n1
Nc1nc2Cc3ccccc3-c2c(Nc2ccc(F)c(Cl)c2)n1
c1c(cc(c(c1F)COc2c(c(sn2)NC(=O)NCCCCN3CCCC3)C(=O)N)F)Br
Cc1ccc(F)c(NC(=O)Nc2ccc(-c3cncc4[nH]nc(N)c34)c3ccccc23)c1
Cc1cccc(NC(=O)Nc2ccc(-c3cncc4[nH]nc(N)c34)c3ccccc23)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(-c3ccc(OCCCN4CCCC4)c4[nH]nc(N)c34)c3ccccc23)c1
Cc1cccc(NC(=O)Nc2ccc(-c3ccc(OCCCN4CCCC4)c4[nH]nc(N)c34)c3ccccc23)c1
Cc1ccc(F)c(NC(=O)Nc2ccc(-c3ccc(OCCC(C)(C)N)c4[nH]nc(N)c34)c3ccccc23)c1
Cc1cccc(NC(=O)Nc2ccc(-c3ccc(OCCC(C)(C)N)c4[nH]nc(N)c34)c3ccccc23)c1
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)Nc3ccc(F)cc3F)ccc2s1
Cc1ccoc1C(=O)NC(=O)Nc1ccc2sc(cc2c1)-c1cc(cnc1N)C(=O)N=S(C)(C)=O
COC(=O)c1cnc(N)c(c1)-c1cc2cc(NC(=O)c3cc4ccccc4o3)ccc2s1
COC(=O)c5ccc4c(/C(=N\c2ccc(N(C)C(=O)CN1CCN(C)CC1)cc2)c3ccccc3)c(O)[nH]c4c5
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)S(=O)(=O)NCCN3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCC3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCC(CC3)N(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCC(=O)N3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCC(=O)N3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCNC(=O)C3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCC(=O)N3CCN(C)CC3)c3ccccc3)c2cc1C
CNC(=O)CN1CCN(CC1)C(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCC(O)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NC3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCC3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCN(CC(=O)NCCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3cccc(c3)C(=O)N(C)CCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NC3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCN(CCO)CC3)c3ccccc3)c2cc1C
COCCN1CCC(CC1)NC(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCCN3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCC(F)(F)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCN(CC3)C(C)=O)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)S(=O)(=O)NCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)S(=O)(=O)N3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N[C@H]3CCCN(C)C3)c3ccccc3)c2cc1C |r|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCC(F)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCCN3CCOCC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC4(CC3)N(C)CCNC4=O)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC(CC3)C(=O)NCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(CCO)CCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CC[C@@H](CN(C)C)[C@H](O)C3)c3ccccc3)c2cc1C |r|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCCN(CC3)C(C)=O)c3ccccc3)c2cc1C
COCCN(C)CCNC(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCC3(CCOCC3)N(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC(O)(CN4CCCC4)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC(CO)(CN(C)C)CC3)c3ccccc3)c2cc1C
COCCNC(=O)CN1CCN(CC1)C(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCC3(CCC3)N(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)C3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCC(CO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC4(CC3)N(C)CCCNC4=O)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCN(CC3)S(C)(=O)=O)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC(O)(CN4CCOCC4)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCC(CC3)(N3CCCCC3)C(N)=O)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)[C@H]3CN(C)C[C@@H]3O)c3ccccc3)c2cc1C |r|
CNC(=O)CN(C)CCNC(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(C(=O)NCCN4CCNC(=O)C4)c(F)c3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NCCN3CCCNC(=O)C3)c3ccccc3)c2cc1C
COc1ccc(COc2ccc(Nc3ccc4ncc(OC)nc4c3C#N)cc2OC)cc1
COc1cnc2ccc(Nc3ccc(NCc4ccc(cc4)C(F)(F)F)nc3)c(C#N)c2n1
COc1ccc(COc2ccc(Nc3ccc4ncc(OC)nc4c3)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N(C)C)cc2OC)cc1
COc1ccc(COc2ccc(Oc3ccc4ncc(OC)nc4c3C#N)cc2OC)cc1
CNc1cnc2ccc(Nc3ccc(OCc4ccc(OC)cc4)c(OC)c3)c(C#N)c2n1
COc1ccc(COc2ccc(Nc3ccc4ncc(OCCN(C)C)nc4c3C#N)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(NC(C)C)nc4c3C#N)cc2OC)cc1
CCOc1ccc(COc2ccc(Nc3ccc4ncc(OC)nc4c3C#N)cc2OC)cc1
CNc1cnc2ccc(Nc3ccc(OCc4ccc(OC)cc4)c(OC)c3)cc2n1
COc1ccc(COc2ccc(Oc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1
COc1cnc2ccc(Nc3ccc(OCc4ccc(Cl)cc4)c(OC)c3)c(C#N)c2n1
CCOc1cc(Oc2ccc3ncc(OC)nc3c2C#N)ccc1OCc1ccc(OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(C)CC3)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(OC(F)(F)F)cc1
CCc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1
CCOc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCC1CC1
COc1ccc(COc2ncc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2)cc1
COc1ccc(CNc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(F)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cccnc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc2OCCc2c1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccncc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1nccn1C
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(Cl)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnccn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cn2)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)c(F)c2)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(C)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cncn1C
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2F)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccccn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1OC
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCNCC3)cc2OC)cn1
COc1ccc(COc2ccc(cc2OC)N(C)c2ccc3ncc(nc3c2C#N)N2CCOCC2)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cc(C)on1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCCC3)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2Cl)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(cc1)C#N
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cccc(c1)C#N
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(CCO)CC3)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCNCC2)ccc1OCc1ccc(C)nc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC(CC3)OC(C)=O)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC(C)CC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)-n3ccnc3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC(COC(C)=O)CC3)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(CC3)C(C)=O)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(nc1)C(F)(F)F
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(CCOC(C)=O)CC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(CCO)CC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(NCCN5CCOCC5)nc4c3C#N)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(NC5CCN(Cc6ccccc6)CC5)nc4c3C#N)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCN(C)CC2)ccc1OCc1cccc(c1)C#N
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCCC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(CC3)C(C)C)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc2OCOc2c1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC(CC3)N(C)C)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC3)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCC(CC2)N(C)C)ccc1OCc1cccc(c1)C#N
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC(CC3)N(C)C)cc2OC)cc1F
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCC2)ccc1OCc1cccc(c1)C#N
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccccc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCC(CC2)N(C)C)ccc1OCc1cccc(F)c1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCNCC3)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cccc(F)c1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCC#C
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1F
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)c(F)c1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(C)CC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cc1C#N
COCCN1CCN(CC1)c1cnc2ccc(Nc3ccc(OCc4ccc(OC)nc4)c(OC)c3)c(C#N)c2n1
CCCc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(F)c(F)c1
COCCN1CCN(CC1)c1cnc2ccc(Nc3ccc(OCc4ccc(C)nc4)c(OC)c3)c(C#N)c2n1
CCc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCC(CC3)N3CCOCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(nc1)C(C)C
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(nc1)N(C)C
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnn(C)c1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3)C(C)=C)cc2OC)cc1
COCc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)C(C)=C)cc2OC)cc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)C(C)C)cc2OC)cc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(CF)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(nc1)C(F)F
CCOc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)C2=CCOCC2)ccc1OCc1ccc(C)nc1 |t:20|
COc1cc(Nc2ccc3ncc(nc3c2C#N)C2CCOCC2)ccc1OCc1ccc(C)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(CN(C)C)nc1
CCn1cc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnn(c1)C(C)C
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCN(CC3)C3CC3)cc2OC)cn1
COc1ccc(COc2ccc(Nc3ccc4ncc(OC(C)C)nc4c3C#N)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(nc1)C1CC1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccoc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccco1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCC1CCCO1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(C)s1
COCc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccsc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cccs1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnc(C)nc1
COc1cc(ccc1OCc1ccc(C)nc1)N(C)c1ccc2ncc(nc2c1C#N)N1CCOCC1
COc1cc(ccc1OCc1ccc(nc1)C1CC1)N(C)c1ccc2ncc(nc2c1C#N)N1CCOCC1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnn(CCF)c1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N(C)C)ccc1OCc1ccc(C)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnn(c1)C1CC1
COc1cc(Nc2ccc3ncc(nc3c2C(N)=O)N2CCOCC2)ccc1OCc1ccc(C)nc1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CC(C2)N(C)C)ccc1OCc1ccc(C)nc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N(C)C)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CC(C)(C2)OC)ccc1OCc1ccc(C)nc1
COc1ccc(COc2ccc(Nc3ccc4ncc(nc4c3C#N)N(C)C)cc2OC)cc1C#N
COc1cnc2ccc(Nc3ccc(OCc4ccc(OC)c(c4)C#N)c(OC)c3)c(C#N)c2n1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1cnn(CC2CC2)c1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)cnc1OCc1ccc(C)nc1
COc1ccc(COc2ncc(Nc3ccc4ncc(nc4c3C#N)N3CCOCC3)cc2OC)cn1
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2C[C@H](C)O[C@H](C)C2)ccc1OCc1ccc(C)nc1 |r|
COc1cc(Nc2ccc3ncc(nc3c2C#N)N2CCOCC2)ccc1OCc1ccc(C)[n+]([O-])c1
COc1ccc(Sc2sc3nc(N)nc(N)c3c2C)cc1OC
COc1ccccc1Sc1sc2nc(N)nc(N)c2c1C
CN(C)c1ccc(cc1)C1N(C)c2ccccc2N1C
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)S(=O)(=O)NOCCN3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(C(=O)NOCCN(C)C)c(C)c3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCCCC3)c3ccccc3)C(=O)Nc2c1
CNC(=O)CN1CCN(CCON(C)C(=O)c2ccc(N\C(=C3/C(=O)Nc4cc(C(=O)OC)c(C)cc34)c3ccccc3)cc2)CC1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)S(=O)(=O)N(C)OCCN(C)CCO)c3ccccc3)c2cc1C
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCOCC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)N(C)OCCN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)S(=O)(=O)NOCCN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(C(=O)NOCCN4CCOCC4)c(C)c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(C(=O)NOCCN4CCN(C)CC4)c(C)c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(C(=O)N(C)OCCN4CCN(C)CC4)c(C)c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCCN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(C(=O)NOCCN(C)C)c(F)c3)c3ccccc3)C(=O)Nc2c1
CON(C1CCN(C)CC1)C(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)C(=O)OC)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc(C(=O)N(C)OCCN(C)C)c(C)c3)c3ccccc3)C(=O)Nc2c1
CON(CCN(C)C)C(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)C(=O)OC)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)N3CCN(C)CCO3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)S(=O)(=O)N(C)OCCN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(C(=O)NOCCN4CCN(C)CC4)c(C)c3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(C(=O)NOCCCN(C)C)c(C)c3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOC3CCN(C)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(C(=O)NOC4CCN(C)CC4)c(C)c3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(C(=O)NOCCN4CCN(C)CC4)c(F)c3)c3ccccc3)c2cc1C
COC(=O)c1ccc2\C(=C(\Nc3ccc(C(=O)NOCCN4CCN(C)CC4)c(F)c3)c3ccccc3)C(=O)Nc2c1
CON(C1CCN(C)CC1)C(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1C
CON(C1CCN(C)CC1)C(=O)c1ccc(N\C(=C2/C(=O)Nc3cc(C(=O)OC)c(C)cc23)c2ccccc2)cc1
CCN1CCN(CCONC(=O)c2ccc(N\C(=C3/C(=O)Nc4cc(C(=O)OC)c(C)cc34)c3ccccc3)cc2)CC1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)N3CCO3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CC[C@@H](C3)N(C)C)c3ccccc3)C(=O)Nc2c1 |r|
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCN(CCO)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCC(O)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCS(=O)(=O)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCNC(=O)C3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCC(CC3)C#N)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3[C@@H](C)CCC[C@H]3C)c3ccccc3)C(=O)Nc2c1 |r|
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN(C)CCO)c3ccccc3)C(=O)Nc2c1
COCCN1CCN(CCONC(=O)c2ccc(N\C(=C3/C(=O)Nc4cc(ccc34)C(=O)OC)c3ccccc3)cc2)CC1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)C(=O)NOCCN3CCC(CC3)N(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)S(=O)(=O)NOCCN(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CCCCC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CCC(CC3)N(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CC[C@@H](C3)N(C)C)c3ccccc3)c2cc1C |r|
COC1CCN(CCONC(=O)c2ccc(N\C(=C3/C(=O)Nc4cc(C(=O)OC)c(C)cc34)c3ccccc3)cc2)CC1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCCN3CCCCC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CCC(O)CC3)c3ccccc3)c2cc1C
COC1CCN(CCCONC(=O)c2ccc(N\C(=C3/C(=O)Nc4cc(C(=O)OC)c(C)cc34)c3ccccc3)cc2)CC1
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN(C)CCO)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3CCNCC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3CCN(CCO)CC3)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3C[C@@H]4C[C@H]3CN4)c3ccccc3)c2cc1C |r|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3C4CCC3CNC4)c3ccccc3)c2cc1C |TLB:25:26:28.29:31.33.32|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3CC4CCC(C3)N4)c3ccccc3)c2cc1C |THB:25:26:29.30:33|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3CCN[C@@H](C)C3)c3ccccc3)c2cc1C |r|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)NOCCN3CCC(CC3)C#N)c3ccccc3)c2cc1C
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3CCN[C@H](C)C3)c3ccccc3)c2cc1C |r|
COC(=O)c1cc2NC(=O)\C(=C(/Nc3ccc(cc3)C(=O)N(C)OCCN3CC4CC(C3)N4)c3ccccc3)c2cc1C
CNC(=O)CN1CCN(CCONC(=O)c2ccc(N\C(=C3/C(=O)Nc4cc(C(=O)OC)c(C)cc34)c3ccccc3)cc2)CC1
COc1cccc(Sc2sc3nc(N)nc(N)c3c2C)c1
COC(=O)Cc1cc(C)c(cc1[N+]([O-])=O)C(=O)OC
COC(=O)c1cc2N(C(C)=O)C(=O)\C(=C(/Nc3ccc(cc3)C(=O)OC(C)(C)C)c3ccccc3)c2cc1C
COC(=O)c1cc2N(C(C)=O)C(=O)\C(=C(/Nc3ccc(cc3)C(=O)N3CCN(CC(=O)OC(C)(C)C)CC3)c3ccccc3)c2cc1C
CCOC(=O)C1=C(NC2=C(C1c1ccc(cc1)S(=O)(=O)c1ccccc1)C(=O)CC(C)(C)C2)C(F)(F)F |c:8,t:5|
Cc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C1C(C(=O)c2ccccc2)=C(N)NC2=C1C(=O)CC(C)(C)C2 |c:32,t:28|
Clc1ccc2ncc(-c3cccc(NC4CCNCC4)n3)n2c1
Cn1cc(cn1)-c1cn2c(cnc2cc1CO)-c1cccc(NC2CCNC2)n1
COc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cccnc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
Clc1ccc2ncc(-c3cccc(NC4CCCNC4)n3)n2c1
COc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1-c1cn[nH]c1
CN[C@@H]1CC2OC([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCC4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCCCC4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCCC4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCC(F)(F)CC4)C3=O)nc2)ccn1
Cc1nc(NC(=O)N2CCC3(CCC(F)(F)CC3)C2=O)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)N2CCC3(CCC3)C2=O)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCCC(F)(F)C4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCC(=O)C4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCC(O)C4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CCC(F)(F)C4)C3=O)nc2)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCC4(CN(C4)S(C)(=O)=O)C3=O)nc2)ccn1
CCC(NC(=O)c1ccc(C2CC2)c(c1)-c1ccc2nc(Nc3cnn(c3)C3CC3)ncc2c1)c1cccc(c1)C(F)(F)F
CC(NC(=O)c1ccc(C2CC2)c(c1)-c1ccc2nc(Nc3cnn(c3)C3CC3)ncc2c1)c1cccc(c1)C(F)(F)F
CC(NC(=O)c1cccc(c1)C(F)(F)F)c1ccc(C2CC2)c(c1)-c1ccc2nc(Nc3cnn(c3)C3CC3)ncc2c1
CCc1ccc(cc1-c1ccc2nc(Nc3cnn(C)c3)ncc2c1)C(C)NC(=O)c1cccc(c1)C(F)(F)F
FC(F)(F)c1cccc(NC(=O)c2ccc(C3CC3)c(c2)-c2ccc3nc(Nc4cnn(c4)C4CC4)ncc3c2)c1
CN1CCN(CC1)c1ccc(Nc2ncc(C)c(Nc3ccc4cnn(C)c4c3)n2)cc1
CN1CCN(CC1)c1ccc(Nc2ncc(C)c(Nc3ccc4c(C)n[nH]c4c3)n2)cc1
Cc1cnc(Nc2ccc(cc2)N2CCOCC2)nc1Nc1ccc2cn[nH]c2c1
Cc1cnc(Nc2ccc(cc2)N2CCNCC2)nc1Nc1ccc2cn[nH]c2c1
Cc1cnc(Nc2ccc(cc2)N2CCC(F)(F)CC2)nc1Nc1ccc2cn[nH]c2c1
Cc1cnc(Nc2ccc(cc2)N2CCS(=O)(=O)CC2)nc1Nc1ccc2cn[nH]c2c1
COc1cc(ccc1Nc1ncc(C)c(Nc2ccc3cn[nH]c3c2)n1)N1CCN(C)CC1
COc1cc(Nc2ncc(C)c(Nc3ccc4cn[nH]c4c3)n2)ccc1N1CCN(C)CC1
CCN1CCN(CC1)c1ccc(Nc2ncc(C)c(Nc3ccc4cn[nH]c4c3)n2)cc1
CCN1CCN(CC1)c1ccc(Nc2ncc(C)c(Nc3ccc4cn[nH]c4c3)n2)c(OC)c1
CCN1CCN(CC1)c1ccc(Nc2ncc(C)c(Nc3ccc4cn[nH]c4c3)n2)cc1OC
CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(C)c(Nc3ccc4cn[nH]c4c3)n2)cc1
Cc1cnc(Nc2ccc(cc2)C(=O)NCCN2CCOCC2)nc1Nc1ccc2cn[nH]c2c1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC2CCC1CC2 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$,(-1.56,1.25,;-.08,.85,;1.01,1.94,;2.5,1.54,;2.9,.05,;1.81,-1.03,;.32,-.64,;-.77,-1.72,;-2.25,-1.33,;-3.34,-2.41,;-3.02,.01,;-2.47,1.45,;-3.67,2.41,;-4.96,1.58,;-6.5,1.66,;-7.05,.22,;-5.85,-.75,;-4.56,.09,;-8.54,-.18,;-9.09,-1.62,;-10.63,-1.54,;-11.03,-.05,;-12.51,.35,;-9.74,.79,;4.39,-.34,;4.78,-1.83,;5.47,.75,;6.96,.35,;8.05,1.44,;9.54,1.04,;9.94,-.45,;11.43,-.85,;12.51,.24,;12.12,1.73,;10.63,2.13,;11.4,.79,;10.5,.04,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11CC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11CCC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1C2CCCC1CCC2 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC2CC(C2)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$,(-1.7,1.25,;-.21,.85,;.88,1.94,;2.36,1.54,;2.76,.05,;1.67,-1.03,;.19,-.64,;-.9,-1.72,;-2.39,-1.33,;-3.48,-2.41,;-3.16,.01,;-2.61,1.45,;-3.81,2.41,;-5.1,1.58,;-6.63,1.66,;-7.19,.22,;-5.99,-.75,;-4.7,.09,;-8.67,-.18,;-9.58,-1.43,;-11.04,-.95,;-11.04,.59,;-12.38,1.36,;-9.58,1.07,;4.25,-.34,;4.65,-1.83,;5.34,.75,;6.83,.35,;7.92,1.44,;9.4,1.04,;9.8,-.45,;11.29,-.85,;12.38,.24,;11.98,1.73,;10.89,.64,;10.49,2.13,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C1CC1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccncc1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccn(C)n1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(NC(=O)CCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1ccnn1C
Cc1ncc(NC(=O)CCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1ccn(C)n1
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC(F)(F)CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)C1CCOCC1
Cc1ncc(NC(=O)CN2CCCC22CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3cnn(C)c3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC3(COC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC3(CCOC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCCC22COC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC3(CCCO3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3ccncc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCCC3(COC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCCCC22COC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
C[C@@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
Cc1ncc(NC(=O)CN2CCC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CN2CCCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CN2CCC3(CCC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CN2CCC3(CC3)CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CN2CCC3(CC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
C[C@@H]1CCCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(CCO)c2)c1 |r|
C[C@H]1CCCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(CCO)c2)c1 |r|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11CCC1
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cccnc1)C(=O)NCCN1CCCC1(C)C
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11CC1
Cc1ncc(NC(=O)NCCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc2ncc(NC(=O)CN1CC(C)(C)C1)cc2NC(=O)c5cnn6cc(c3cnn4CCCOc34)sc56
COc1ccncc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCCC4(C)C)cnc3C)c2s1
Cc1ncc(NC(=O)CCN2CC3CCC2CC3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |(-1.98,1.13,;-.49,.73,;.59,1.82,;2.08,1.42,;2.48,-.06,;3.97,-.46,;5.06,.63,;4.66,2.11,;6.54,.23,;7.63,1.32,;9.12,.92,;9.52,-.57,;11.01,-.97,;12.1,.12,;11.7,1.61,;10.21,2.01,;11.3,.92,;10.22,-.16,;1.39,-1.15,;-.1,-.75,;-1.18,-1.84,;-2.67,-1.45,;-3.76,-2.53,;-3.07,.04,;-2.17,1.29,;-3.07,2.53,;-4.54,2.06,;-6,2.53,;-6.91,1.29,;-6,.04,;-4.54,.52,;-8.39,.89,;-9.3,-.36,;-10.76,.12,;-10.76,1.66,;-12.1,2.43,;-9.3,2.14,)|
Cc1ncc(NC(=O)CN2C3CCC2COC3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CC3CC(C2)O3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC3(COC3)CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCOCC22CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2Cc3cccnc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCCC(F)(F)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
C[C@@H]1COCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
C[C@@H]1COC[C@@H](C)N1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)C[C@H](C)O1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)C[C@@H](C)O1 |r|
C[C@@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CCO1 |r|
Cc1ncc(NC(=O)CN2CCOCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3c(C2)cnn3C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3ncsc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCS(=O)(=O)CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3cccnc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3scnc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3cnccc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCc3ncccc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CCO1 |r|
CC[C@@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CCO1 |r|
CC[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CCO1 |r|
Cc1ncc(NC(=O)CN2CCOC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCOCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
CC[C@@H]1COCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
CC[C@H]1COCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
C[C@H]1COC[C@@H](C)N1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
CN1CCN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1=O
Cc1ncc(NC(=O)CN2CCC(F)(F)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
C[C@H]1COCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
Cc1ncc(NC(=O)CN2CCn3ccnc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2Cc3ncsc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2Cc3ccncc3C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCOCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
COCC1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1
Cc1ncc(NC(=O)CN2CCCOCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC3(CCO3)CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CN2CCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
COC1CCN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(CCO)c2)c1 |r|
Cc1ncc(NC(=O)CN2CCCCC22CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CN2CCCC22CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCC(C)(C)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCC5(CCC5)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCC5(CC5)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4C[C@@H]5CC[C@H]4C5)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CC(C)(C)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4C[C@H]5CC[C@@H]4C5)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCC44CCC4)cnc3C)c2s1
Cc1ncc(NC(=O)CCN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CCN2CCC3(CC3)CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)CCN2CCCC22CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CC5CCC4CC5)cnc3C)c2s1 |(-14.38,1.41,;-13.05,2.18,;-11.71,1.41,;-10.38,2.18,;-9.03,1.43,;-7.57,1.91,;-6.66,.66,;-7.57,-.58,;-9.03,-.11,;-5.13,.85,;-4.39,2.2,;-2.88,1.91,;-1.48,2.57,;-.43,1.44,;-1.17,.09,;-.52,-1.3,;-1.4,-2.57,;1.01,-1.43,;2.16,-.4,;3.62,-.88,;4.77,.15,;6.23,-.32,;7.38,.71,;7.06,2.21,;8.84,.23,;9.99,1.26,;11.45,.79,;11.77,-.72,;13.24,-1.2,;14.38,-.17,;14.06,1.34,;12.6,1.82,;13.63,.67,;12.25,-.03,;4.45,1.66,;2.98,2.13,;1.84,1.1,;.37,1.58,;-2.69,.38,;-4.08,-.27,)|
COCCn1nc(C)c(c1C)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CC5CCC(C4)O5)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;;$|
COCCn1nc(C)c(c1C)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCC5(CC5)C4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CCN2CCC3(CC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
C[C@H]1CCCN1CCCC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r,$;;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;$|
CN1CCC(CNC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1
CN1CCC(CCNC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1
CC(C)N1CCC(CNC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCOCC11CC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1Cc2ncsc2C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC2COCC2C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC2(CCC2)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11COC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
COCCN(CCNC(=O)c1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)C1CCC1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC2(CCOC2)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCOCC11CCC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC2(CC2)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC(F)(F)CC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC(F)(F)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCOCC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1C2CCC1COC2 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC(F)(F)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC2(CCC2)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC(F)(F)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC(C)(C)C1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;$|
COCCN(CCNC(=O)c1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)C(C)C |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COCCN(CCNC(=O)c1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)CCOC |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CC(=O)N1CCN(CCNC(=O)c2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccc(N)nc1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)n1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccc(cc1)C(O)=O)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cccc(c1)C(O)=O)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cccnc1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ccc(cn1)-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3(C)C)c2s1 |$;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccc(=O)[nH]c1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccc(=O)n(C)c1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cncnc1)C(=O)NCCN1CCCC1(C)C
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)n1)C(=O)NCCN1CCCC1(C)C
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccc(=O)[nH]n1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CC4CCC3CC4)c2s1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;$,(-14.37,1.43,;-13.04,2.2,;-11.71,1.43,;-10.37,2.2,;-9.04,1.43,;-7.57,1.91,;-6.67,.66,;-7.57,-.58,;-9.04,-.11,;-5.14,.85,;-4.4,2.2,;-2.88,1.91,;-1.49,2.56,;-.44,1.44,;-1.18,.09,;-.53,-1.3,;-1.41,-2.56,;1.01,-1.43,;2.15,-.4,;3.62,-.88,;4.76,.15,;4.44,1.66,;2.98,2.13,;1.83,1.1,;.37,1.58,;6.23,-.32,;6.55,-1.83,;7.37,.71,;8.83,.23,;9.98,1.26,;11.44,.79,;11.76,-.72,;13.23,-1.2,;14.37,-.17,;14.05,1.34,;12.59,1.82,;13.62,.67,;12.25,-.03,;-2.69,.38,;-4.09,-.27,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CS(C)(=O)=O)c1)C(=O)NCCN1CC2CCC1CC2 |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$,(-.35,1.56,;1.11,1.08,;2.26,2.11,;3.72,1.64,;4.04,.13,;2.9,-.9,;1.43,-.43,;.29,-1.46,;-1.24,-1.32,;-2.13,-2.59,;-1.9,.07,;-1.15,1.42,;-2.21,2.54,;-3.6,1.89,;-5.11,2.18,;-5.86,.83,;-4.8,-.29,;-3.41,.36,;-7.39,.64,;-8.29,-.61,;-9.76,-.13,;-9.76,1.41,;-11,2.31,;-12.41,1.68,;-11.16,.78,;-12.57,.15,;-13.66,2.59,;-8.29,1.89,;5.51,-.35,;5.83,-1.85,;6.65,.68,;8.12,.21,;9.26,1.24,;10.73,.76,;11.05,-.74,;12.51,-1.22,;13.66,-.19,;13.34,1.32,;11.87,1.79,;12.9,.65,;11.53,-.05,)|
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CN(CCNC(=O)c1cc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)s1)C1CCCC1 |$;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC(O)CC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
CN(CCNC(=O)c1cc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)s1)C1CCOCC1 |$;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC(CO)CC1 |$;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC[C@@H](O)C1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;$|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC[C@H](O)C1 |r|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11CCCC1
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCOCC11CC1
C[C@H]1CCC[C@@H](C)N1CCNC(=O)c1cc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)s1 |r|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CC2CCC1CC2 |(-.92,1.85,;.36,.91,;2.15,1.23,;2.96,-.08,;1.78,-1.2,;.31,-.64,;-.87,-1.77,;-2.39,-1.31,;-3.57,-2.49,;-3.04,.05,;-2.26,1.39,;-3.3,2.49,;-4.75,1.87,;-6.27,2.22,;-7.08,.91,;-6.01,-.32,;-4.61,.37,;-8.65,.72,;-9.4,-.62,;-10.95,-.35,;-11.12,1.2,;-12.48,1.98,;-9.64,1.87,;4.43,-.53,;4.75,-2.17,;5.6,.4,;7.13,-.03,;8.25,1.02,;9.75,.48,;9.75,-1.02,;11.06,-1.71,;10.61,-.8,;11.92,-.03,;11.14,1.28,;12.48,.56,;12.48,-1.02,)|
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC(O)C1
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCCN1CCCC1(C)C
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCC(C)(C)N1CCCC1
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCC2(CCC2)CC1
Cc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCc2ccccc2C1
CCc1cc(sc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC11CCC1
Cn1cc(cn1)-c1cn2ncc(C(=O)Nc3sc(cc3C#N)C(=O)NCCN3CCCC33CCC3)c2s1
Cn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(ccc3F)C(=O)NCCN3CCCC3(C)C)c2s1
Cc1c(cnn1C)-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3C[C@H]4CC[C@@H]3C4)c2s1 |r|
Cc1c(cnn1C)-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC33CCC3)c2s1
CN\C(C)=C(/C=N)c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CC4CCC3C4)c2s1 |TLB:27:28:34:32.31|
Cc1nn(C)cc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3C[C@H]4CC[C@@H]3C4)c2s1 |r|
Cc1nn(C)cc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CC4CCC3C4)c2s1
Cc1nn(C)cc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC33CCC3)c2s1
Cc1nn(C)c(C)c1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC33CCC3)c2s1
Cc1ncc(NC(=O)CCCN2CCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCCN4CCC[C@@H]4C)cnc3C)c2s1 |r|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-n1ncc2cccnc12)C(=O)NCCN1CCCC1(C)C
Cc1nn(C)cc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3)c2s1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN1CCCC1
Cc1c(cnn1C)-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3)c2s1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCC(O)CO)c1)C(=O)NCCN1CCCC1(C)C
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCC(O)CO)c1)C(=O)NCCN1CCCC1
Cc1nn(C)c(C)c1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3)c2s1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cn(C)nc1CO)C(=O)NCCN1CCCC1(C)C
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CC(O)CO)c1)C(=O)NCCN1CCCC1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3(C)C)c2s1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cn(C)nc1C(F)(F)F)C(=O)NCCN1CCCC1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3)c2s1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cncc(c1)S(C)(=O)=O)C(=O)NCCN1CCCC1(C)C
Cc1n[nH]c(C)c1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3(C)C)c2s1
CN1CCN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC4(C)C)cnc3C)c2s1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCNCCO
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NCCN(CCO)CC1CCCCC1
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NC[C@H]1CCCN1CCO |r|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)C(=O)NC1CN(C1)C(C)(C)C
CNc1cccc(-c2cn3ncc(C(=O)Nc4cc(cnc4C)C(=O)NC4CN(C4)C(C)(C)C)c3s2)c1C=N
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cccc2n(C)ncc12)C(=O)N1CC1CNC(C)(C)C
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cccc2n(C)ncc12)C(=O)NCCN1CCCC1(C)C
Cc1ncc(NC(=O)CCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cccc2n(C)ncc12
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCC[C@H]3C)c2s1 |r|
CN1CCC[C@H]1COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
CN1CCC[C@@H]1COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
CC(C)N1CCC[C@H]1COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r|
Cc1ncc(NC(=O)OCCN2CCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)OCCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
CC(COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)N1CCCC1
Cc1ncc(NC(=O)OCC(C)(C)N2CCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
Cc1ncc(NC(=O)OCCN2CC3CCC2C3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
CN(CCOC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)C1CCCCC1
Cc1ncc(NC(=O)OC2CN(C2)C(C)(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)OC[C@@H]4CCCN4C)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)OCCN4CCCC4(C)C)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)OCC(C)N4CCCC4)cnc3C)c2s1
CN1CCC[C@H]1COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cccnc2O)c1 |r|
CN1CCC[C@H]1COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cccc3n(C)ncc23)c1 |r|
CN1CCC[C@H]1COC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cc[nH]c2)c1 |r|
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(Nc3ncccc3C=N)sc12
Cc1ncc(NC(=O)CCN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-n1ncc2cccnc12
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C1CS(=O)(=O)C1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CC2COC2)c1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C1COC1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CS(C)(=O)=O)c1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CC#N)c1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CC(N)=O)c1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CC(F)(F)F)c1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C(F)(F)F
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CC2CC2)c1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cn[nH]c1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccc(cc1)C1(O)COC1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|
CC(=O)Nc1cc(ccn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;$|
CNC(=O)c1cc(ccn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccn(c1)S(C)(=O)=O |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
CC(=O)Nc1cncc(c1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1 |$;;;HN;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccc(CO)s1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;$|
CNC(=O)Cn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C1CCS(=O)(=O)CC1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|
CC(O)Cn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccsc1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccoc1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccnc(c1)N1CCOCC1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cc[nH]c1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cccc2n(C)ncc12 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1c[nH]c2ccccc12 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnc2[nH]ncc2c1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)-c1cccnc1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccc(CO)o1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C1CCNCC1 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(c2)C2CC2)c1)C1CCOCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$|
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(c2)C(F)F)c1)C1CCOCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$|
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(c2)C2CCC2)c1)C1CCOCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CC(C#N)n1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN(C)C4CCOCC4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(CS(C)(=O)=O)c2)c1)C1CCOCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(CC#N)c2)c1)C1CCOCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$|
CN(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(CC(N)=O)c2)c1)C1CCOCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCC[C@@H]3C)c2s1 |r|
Cc1ncc(NC(=O)CC23CCCN2CCC3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |$;;;;;HN;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CCCC(O)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |$;;;;;HN;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;$|
C[C@@H]1C[C@H](N(C)C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r,$;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;$|
CC(C)N1CCCC[C@H]1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |r,$;;;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;$|
CC(N1CCCCCC1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |$;;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;$|
CC(CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1)N1CCCCC1 |$;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)[C@@H]2CCCN3CCCC[C@H]23)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |r,$;;;;;HN;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;$|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)C[C@H]4CCCN4C(C)C)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCOCC44CCC4)cnc3C)c2s1
CC[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cccnc3OC)c2)CCO1 |r|
Cc1ncc(NC(=O)CN2CCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cccnc1O
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC4)cnc3C)c2s1
CC(C)N1CCCCC1C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cccnc2O)c1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)C4CCCCN4C(C)C)cnc3C)c2s1
C[C@H]1C[C@H](N(C)C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cccnc2O)c1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)[C@@H]4C[C@H](C)CN4C)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCO[C@H](C)C4)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCOC(C)(C)C4)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC5(CCOC5)C4)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC5(CC5)C4)cnc3C)c2s1
CC(C)N1CCC[C@H]1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cccnc2O)c1 |r,$;;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)C[C@@H]4CCCN4C(C)C)cnc3C)c2s1 |r,$;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC5(CC5)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC[C@@H]4C)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC5(CC5)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC[C@@H](C)C4)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC[C@H](C)C4)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC4(C)C)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC[C@H]4C)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC5CCC4CC5)cnc3C)c2s1 |(-13.33,.03,;-12.43,1.27,;-10.9,1.11,;-9.99,2.36,;-8.46,2.2,;-7.69,.86,;-6.18,1.18,;-6.02,2.71,;-7.43,3.34,;-5.04,.15,;-5.2,-1.38,;-3.79,-2.01,;-3.02,-3.34,;-1.52,-3.02,;-1.35,-1.49,;-.02,-.72,;-.02,.82,;1.31,-1.49,;2.65,-.72,;3.98,-1.49,;5.31,-.72,;6.65,-1.49,;7.98,-.72,;7.98,.82,;9.31,-1.49,;10.65,-.72,;12,-1.49,;13.33,-.72,;13.33,.82,;12,1.59,;10.67,.82,;12.15,.42,;11.84,-.32,;5.31,.82,;3.98,1.59,;2.65,.82,;1.31,1.59,;-2.76,-.86,;-3.53,.47,)|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC44CCC4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC44CCC4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H]5CC[C@@H]4C5)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC5(CC5)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC(C)(C)C4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCCC4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCCCC4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C5CCC4CC5)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC(C4)C4CC4)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C4CN(C4)C(C)C)cnc3C)c2s1
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)[C@@H]4CCCN4C(C)C)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)[C@H]4CCCN4C(C)C)cnc3C)c2s1 |r|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C4CCN(C4)C(C)C)cnc3C)c2s1
CC(C)N1CCC[C@H]1C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |r,$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
CC(C)N1CCC[C@@H]1C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |r,$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
CC(C)N1CC(C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |$;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
CN1CCC[C@H]1C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |r,$;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
CC(C)N1CCC(C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
CC(C)N1CCC[C@@H]1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |r,$;;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2ccnc(c2)N2CCOCC2)c1 |r,$;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1ccnc(c1)N1CCOCC1 |$;;;;;HN;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$|
CC(C)N1CC(C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cn(C)nc2C)c1 |$;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
CC(C)N1CCC(C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cn(C)nc2C)c1 |$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
CC(C)N1CCC(C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2C)c1 |$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
CC(C)N1CC(C1)C(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2C)c1 |$;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NS(=O)(=O)CCN2CC3CCC2CC3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |(-1.9,1.61,;-.42,1.16,;.7,2.22,;2.18,1.77,;2.53,.27,;4,-.17,;5.32,.62,;4.55,1.96,;6.09,1.96,;6.66,-.15,;7.99,.62,;9.32,-.15,;9.32,-1.69,;10.66,-2.46,;11.99,-1.69,;11.99,-.15,;10.66,.62,;10.26,-.87,;11.43,-1.12,;1.41,-.78,;-.07,-.34,;-1.19,-1.39,;-2.73,-1.29,;-3.59,-2.56,;-3.4,.1,;-2.68,1.46,;-3.75,2.56,;-5.14,1.89,;-6.65,2.15,;-7.37,.79,;-6.3,-.31,;-4.92,.36,;-8.9,.58,;-10.08,1.56,;-11.39,.74,;-11.01,-.75,;-11.99,-1.94,;-9.47,-.85,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1)S(=O)(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
COCCCc1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3(C)C)c2s1 |$;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|
COC\C=C\c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3(C)C)c2s1 |$;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(Cc2cc(OCc3ccccc3)no2)c1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn(Cc2cc(O)no2)c1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;$|
Cc1noc(C)c1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cc[nH]c3)c2)C[C@H](C)O1 |r|
Cc1ncc(NC(=O)CN2CC3CCC(C2)O3)cc1NC(=O)c1cnn2cc(sc12)-c1cc[nH]c1
COC\C=C\c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H](C)O[C@@H](C)C4)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H](C)O[C@@H](C)C4)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3ccc[nH]c3=O)c2)C[C@H](C)O1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3c[nH]nc3C)c2)C[C@H](C)O1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnc(N)c(F)c3)c2)C[C@H](C)O1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3c(C)n[nH]c3C)c2)C[C@H](C)O1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cc[nH]n3)c2)C[C@H](C)O1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn4CCCOc34)c2)C[C@H](C)O1 |r|
Cc1ncc(NC(=O)CN2C[C@H](CO)OC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |r|
Cc1ncc(NC(=O)CN2C[C@@H](CO)OC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(C)c1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)C[C@@H](CO)O1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H](CO)OC(C)(C)C4)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@@H](CO)OC(C)(C)C4)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H](C)O[C@H](CO)C4)cnc3C)c2s1 |r|
C[C@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(c3)C3CC3)c2)C[C@H](C)O1 |r|
COCC1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)CC(C)(C)O1
COc1ccncc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H](C)O[C@@H](C)C4)cnc3C)c2s1 |r|
COc1cccc(n1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4C[C@H](C)O[C@@H](C)C4)cnc3C)c2s1 |r|
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CC(C)(C)C3)c2s1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;$|
CCn1nccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
Cc1cnn(C)c1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cccnc1C
CCc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
COc1ncc(-c2cn3ncc(C(=O)Nc4cc(NC(=O)CN5CC(C)(C)C5)cnc4C)c3s2)c(OC)n1
COc1cc(-c2cn3ncc(C(=O)Nc4cc(NC(=O)CN5CC(C)(C)C5)cnc4C)c3s2)c(OC)nn1
COc1cccc(n1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
COc1ccc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C4)OC)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC4)cnc3C)c2s1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cncnc1C
COc1cnccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
COC1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cccnc3OC)c2)C1
CCOC1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cccnc3OC)c2)C1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(F)C4)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC5(C4)CCOCC5)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC5(COC5)C4)cnc3C)c2s1
COc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)C4)cnc3C)c2s1
Cc1ncc(NC(=O)CN2CC3(C2)CCOCC3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
CC1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn4CCCOc34)c2)C1
Cc1ncc(NC(=O)CN2CCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1ccnnc1C
Cc1ncc(NC(=O)CN2CC3(COC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
Cc1ncc(NC(=O)CN2CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |r|
CC(C)CNCC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |$;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnc2COCCn12
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCc23)c1 |r|
Cc1ncc(NC(=O)CN2CCCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12
Cc1ncc(NC(=O)CN2CCCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnc2COCCn12
Cc1ncc(NC(=O)CN2CCCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
Cc1ncc(NC(=O)CN2CCCCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
Cc1ncc(NC(=O)CNC2CCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CNC2CCCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC3(C2)CCCCO3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12
Cc1ncc(NC(=O)CN2CC3(C2)CCCCO3)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12
Cc1nn(C2COC2)c(C)c1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
Cc1ncc(NC(=O)CC2CNC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12
CN1CC(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn4CCCc34)c2)C1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C(F)F
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cncnc1
Cc1nn(C)cc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
C[C@@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cn(C)nc3C)c2)C[C@@H](C)O1 |r|
C[C@@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(CCS(C)(=O)=O)c3)c2)C[C@@H](C)O1 |r|
C[C@@H]1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3C)c2)C[C@@H](C)O1 |r|
Cc1c(cnn1C)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCS(C)(=O)=O)c1
CCOc1ncccc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cccnc1OC(F)(F)F
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cn(C)nc2C)c1 |r|
COC1CCN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cn(C)nc3C)c2)C1
C[C@@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cn(C)nc2C)c1 |r|
COC1CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cn(C)nc3C)c2)C1
COC1(C)CN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cn(C)nc3C)c2)C1
C[C@@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2nn(C)nc2C)c1 |r|
Cc1nn(C)cc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCCC4(C)C)cnc3C)c2s1
Cc1nn(C)nc1-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CC(C)(C)C4)cnc3C)c2s1
CC1CCN(CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cn(C)nc3C)c2)C1
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(CCO)c1
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cccnc1OCCF
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cccn(CCF)c1=O
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12)C(=O)NCCN1CCCC1(C)C |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C[C@@H]4CCCN4C(C)C)cnc3C)c2s1 |r,$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C4(CN5CCC[C@@H]5C)CC4)cnc3C)c2s1 |r,$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CNCC2CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CNCC2CC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$|
CCCNCC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CCCNCC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCc23)c1 |$;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn(c1)C(C)(C)CO |$;;;;;HN;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12 |$;;;;;HN;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12)C(=O)NCCC1CC2CCC1CC2 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,(-1.78,-.6,;-.45,.17,;.88,-.6,;2.22,.17,;2.22,1.71,;.88,2.48,;-.45,1.71,;-1.78,2.48,;-3.12,1.71,;-3.12,.17,;-4.45,2.48,;-4.61,4.01,;-6.12,4.33,;-6.89,3,;-8.29,2.37,;-8.13,.84,;-6.63,.52,;-5.86,1.85,;-9.28,-.19,;-10.78,.13,;-11.55,-1.21,;-10.52,-2.35,;-10.68,-3.88,;-9.44,-4.79,;-8.03,-4.16,;-7.87,-2.63,;-9.12,-1.72,;3.55,2.48,;3.55,4.02,;4.89,1.71,;6.22,2.48,;7.55,1.71,;8.89,2.48,;10.22,1.71,;11.55,2.48,;11.55,4.02,;10.22,4.79,;8.89,4.02,;10.41,3.8,;10.01,2.48,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12)C(=O)NCCN1CCCC1(C)C |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12)C(=O)NCCN1CCCC11CCC1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCC4CCCN4C)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CCN4CCCC4C(C)C)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;;$|
CC(C)N1CC[C@@H](CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)C1 |r,$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
CC(C)N1CC[C@H](CC(=O)Nc2cnc(C)c(NC(=O)c3cnn4cc(sc34)-c3cnn(C)c3)c2)C1 |r,$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C[C@@H]4CCN(C4)C(C)C)cnc3C)c2s1 |r,$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)CN4CCC4C(C)C)cnc3C)c2s1
CN1CCCC1CNC(=O)c1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCc23)c1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CN1CCCC1CNC(=O)c1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCOc23)c1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CNC2CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12)C(=O)NCCN1CCCC11CCC1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
C[C@H]1CCCN1CC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCOCc23)c1 |r,$;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CCC3(CC3)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12 |$;;;;;HN;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CCC22CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12 |$;;;;;HN;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12 |$;;;;;HN;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12)C(=O)NCCN1CC2CCC1CC2 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,(-1.78,-.6,;-.45,.17,;.88,-.6,;2.22,.17,;2.22,1.71,;.88,2.48,;-.45,1.71,;-1.78,2.48,;-3.12,1.71,;-3.12,.17,;-4.45,2.48,;-4.61,4.01,;-6.12,4.33,;-6.89,3,;-8.29,2.37,;-8.13,.84,;-6.63,.52,;-5.86,1.85,;-9.28,-.19,;-10.78,.13,;-11.55,-1.21,;-10.52,-2.35,;-10.68,-3.88,;-9.44,-4.79,;-8.03,-4.16,;-7.87,-2.63,;-9.12,-1.72,;3.55,2.48,;3.55,4.02,;4.89,1.71,;6.22,2.48,;7.55,1.71,;8.89,2.48,;10.22,1.71,;11.55,2.48,;11.55,4.02,;10.22,4.79,;8.89,4.02,;10.41,3.7,;10.01,2.48,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12)C(=O)NCCN1CCCC11CCC1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12)C(=O)NCCN1CC(C)(C)C1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12)C(=O)NCCN1CC2CCC1CC2 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,(-1.78,-.9,;-.45,-.13,;.88,-.9,;2.22,-.13,;2.22,1.41,;.88,2.18,;-.45,1.41,;-1.78,2.18,;-3.12,1.41,;-3.12,-.13,;-4.45,2.18,;-4.61,3.72,;-6.12,4.04,;-6.89,2.7,;-8.29,2.08,;-8.13,.55,;-6.63,.22,;-5.86,1.56,;-9.28,-.49,;-10.78,-.17,;-11.55,-1.5,;-10.52,-2.64,;-10.36,-4.17,;-8.86,-4.49,;-8.09,-3.16,;-9.12,-2.02,;3.55,2.18,;3.55,3.72,;4.89,1.41,;6.22,2.18,;7.55,1.41,;8.89,2.18,;10.22,1.41,;11.55,2.18,;11.55,3.72,;10.22,4.49,;8.89,3.72,;10.43,3.72,;9.94,2.47,)|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12)C(=O)NCCN1CCCC1(C)C |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12)C(=O)NCCN1CC(C)(C)C1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccnc(c1)N1CCOCC1)C(=O)NCCN1CCCC1(C)C |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1ccnc(c1)N1CCOCC1)C(=O)NCCN1CC2CCC1CC2 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$,(-1.62,.63,;-.28,1.4,;1.05,.63,;2.38,1.4,;2.38,2.94,;1.05,3.71,;-.28,2.94,;-1.62,3.71,;-2.95,2.94,;-2.95,1.4,;-4.28,3.71,;-4.44,5.24,;-5.95,5.56,;-6.72,4.23,;-8.13,3.6,;-7.97,2.07,;-6.46,1.75,;-5.69,3.08,;-9.11,1.04,;-10.58,1.51,;-11.72,.48,;-11.4,-1.02,;-9.94,-1.5,;-8.79,-.47,;-9.62,-3.01,;-10.76,-4.04,;-10.44,-5.54,;-8.98,-6.02,;-7.83,-4.99,;-8.15,-3.48,;3.72,3.71,;3.72,5.25,;5.05,2.94,;6.39,3.71,;7.72,2.94,;9.05,3.71,;10.39,2.94,;11.72,3.71,;11.72,5.25,;10.39,6.02,;9.05,5.25,;10.49,4.93,;10.18,3.71,)|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C[C@H]4CCCN4C(C)C)cnc3C)c2s1 |r,$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C[C@H]4CCN(C4)C(C)C)cnc3C)c2s1 |r,$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C4(CN5CCCC5(C)C)CC4)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;;;$|
COCCn1cc(cn1)-c1cn2ncc(C(=O)Nc3cc(NC(=O)C(C)(C)CN4CCCC4(C)C)cnc3C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;HN;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCOCc12)C(=O)NCCN1CC(C)(C)C1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
CN(C)c1cc(ccn1)-c1cn2ncc(C(=O)Nc3cc(cnc3C)C(=O)NCCN3CCCC3(C)C)c2s1 |$;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCc12)C(=O)NCCNC1CCC1 |$;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;$|
CN1CCCC1CCC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn(C)c2)c1 |$;;;;;;;;;;HN;;;;;;;HN;;;;;;;;;;;;;;;;;$|
CC(C)CNCC(=O)Nc1cnc(C)c(NC(=O)c2cnn3cc(sc23)-c2cnn3CCCc23)c1 |$;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CNC2CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;$|
Cc1ncc(NC(=O)CNC2(C)CCC2)cc1NC(=O)c1cnn2cc(sc12)-c1cnn2CCCOc12 |$;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
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CNN1CCN(CC1)C(=O)Nc1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
Cc2ncc(C(=O)NCCN1CCC(F)(F)CC1)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
Cc2ncc(C(=O)NCCN1CCCC(F)(F)C1)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
Cc2ncc(C(=O)NCCN1CCC[C@@H]1C)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
Cc3ncc(C(=O)NCCN1CCCC12CCC2)cc3Nc5nn(C)c6nc(Nc4cncnc4)ncc56
Cc2ncc(C(=O)NCCN1CCCC[C@@H]1C)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
Cc3ncc(C(=O)NCCN1CC2CCC1CC2)cc3Nc5nn(C)c6nc(Nc4cncnc4)ncc56
Cc3ncc(C(=O)NCCN2CCC1(CCC1)CC2)cc3Nc5nn(C)c6nc(Nc4cncnc4)ncc56
Cc2ncc(C(=O)NCCN1CCC(C)(C)C1)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
Cc1ncc(C(=O)NCCN(C)C2CCCC2)cc1Nc1nn(C)c2nc(Nc3cncnc3)ncc12
Cc1ncc(C(=O)NCCN(C)C2CCOCC2)cc1Nc1nn(C)c2nc(Nc3cncnc3)ncc12
Cc1ncc(C(=O)NCCN2CCCC[C@H]2C)cc1Nc1nn(C)c2nc(Nc3cncnc3)ncc12
Cc2ncc(C(=O)NCCN1CC[C@H](C)C1)cc2Nc4nn(C)c5nc(Cc3cncnc3)ncc45
Cc3ncc(C(=O)NCCN1CCOCC12CC2)cc3Nc5nn(C)c6nc(Nc4cncnc4)ncc56
Cc2ncc(C(=O)NCCN1[C@@H](C)CCC[C@H]1C)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
Cc1ncc(C(=O)NCCN(C(C)C)C(C)C)cc1Nc3nn(C)c4nc(Nc2cncnc2)ncc34
Cc1ncc(NC(=O)NCCN2CCCC2(C)C)cc1Nc1nn(C)c2nc(Nc3cncnc3)ncc12
Cc2ncc(C(=O)NCCN1CCCOCC1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
Cc3ncc(C(=O)NCCN1CCCC12COC2)cc3Nc5nn(C)c6nc(Cc4cnn(C)c4)ncc56
Cc3ncc(C(=O)NCCN2CCC1(CCO1)CC2)cc3Nc5nn(C)c6nc(Cc4cnn(C)c4)ncc56
Cc3ncc(C(=O)NCCN1CCC2(CC1)COC2)cc3Nc5nn(C)c6nc(Cc4cnn(C)c4)ncc56
Cc2ncc(C(=O)NCCN(C)C1CCOCC1)cc2Nc4nn(C)c5nc(Cc3cnn(C)c3)ncc45
COC5CCN(CCNC(=O)c4cnc(C)c(Nc2nn(C)c3nc(Cc1cnn(C)c1)ncc23)c4)CC5
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Cc3ncc(C(=O)NCCN1CCOCC12CC2)cc3Nc5nn(C)c6nc(Cc4cnn(C)c4)ncc56
COCC1CCCN1CCNC(=O)c5cnc(C)c(Nc3nn(C)c4nc(Cc2cnn(C)c2)ncc34)c5
Cc3ncc(C(=O)NCCN2CC1COCC1C2)cc3Nc5nn(C)c6nc(Cc4cnn(C)c4)ncc56
Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc4nn(C)c5nc(Nc3cncnc3)ncc45
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Cc1ncc(C(=O)NCCN2CCCC2(C)C)cc1Nc1nn(C)c2nc(Nc3ccc(=O)[nH]n3)ncc12
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Cc1ncc(C(=O)NCCN2CCCC2(C)C)cc1Nc1nn(C)c2nc(Nc3cccnc3)ncc12
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Cc1ncc(C(=O)NCCN2CC(C)(C)C2)cc1Nc1nn(C)c2nc(Nc3cncnc3)ncc12
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Cc1ncc(C(=O)NCCN2CCCC23CC3)cc1Nc1nn(C)c2nc(Nc3cncnc3)ncc12
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Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2CCC[C@@H]2C)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2CCC(F)(F)CC2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2C[C@H](C)O[C@@H](C)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2CCC3(CC3)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2CCC(F)(F)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2CC(F)(F)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2CC(C)(C)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN2C[C@@H](C)O[C@@H](C)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN(CCO)C2CCCC2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(NC(=O)CN(CCCO)C2CCCC2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
CC[C@H]1COCCN1CCCC(=O)c1cnc(C)c(Nc2nn(C)c3nc(Nc4cnn(C)c4)ncc23)c1
Cc1ncc(C(=O)CCCN2CCCC[C@H]2C)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
Cc1ncc(C(=O)CCCN2CCC3(CCC3)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
COCCN(CCNC(=O)c4cnc(C)c(Nc2nn(C)c3nc(Nc1cnn(C)c1)ncc23)c4)C5CCC5
Cc3ncc(C(=O)NCCN1CC2CCC1CC2)cc3Nc5nn(C)c6nc(Nc4cnn(C)c4)ncc56
Cc2ncc(C(=O)NCCN1CCC(C)(C)C1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
Cc2ncc(C(=O)NCCN1CC(C)CC(C)C1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
CC[C@@H]5CN(CCNC(=O)c4cnc(C)c(Nc2nn(C)c3nc(Nc1cnn(C)c1)ncc23)c4)CCO5
Cc3ncc(C(=O)NCCN1C2CCCC1CCC2)cc3Nc5nn(C)c6nc(Nc4cnn(C)c4)ncc56
Cc3ncc(C(=O)NCCN2CCC1(CC1)C2)cc3Nc5nn(C)c6nc(Nc4cnn(C)c4)ncc56
Cc2ncc(C(=O)NCCN1C[C@H](C)O[C@H](C)C1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
Cc2ncc(C(=O)NCCN1C[C@H](C)O[C@@H](C)C1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
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COCCN(CCNC(=O)c4cnc(C)c(Nc2nn(C)c3nc(Nc1cnn(C)c1)ncc23)c4)C5CCCC5
Cc2ncc(C(=O)NCCN(CCCO)C1CCCC1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
Cc2ncc(C(=O)NCCN(CCO)C1CCCC1)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3)ncc45
CC(=O)Nc5cccc(Nc4ncc3c(Nc2cc(C(=O)NCCN1CCCC1(C)C)cnc2C)nn(C)c3n4)c5
CC(=O)Nc5cncc(Nc4ncc3c(Nc2cc(C(=O)NCCN1CCCC1(C)C)cnc2C)nn(C)c3n4)c5
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Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc5nn(C)c6nc(Nc4ccnc(N3CCOCC3)c4)ncc56
Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc5nn(C)c6nc(Nc4ccc(N3CCOCC3)nc4)ncc56
Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc5nn(C)c6nc(Nc4ccnc(N3CCN(CCO)CC3)c4)ncc56
Cc1ncc(C(=O)NCCC2CCCCC2)cc1Nc1nn(C)c2nc(Nc3ccc(CC(=O)O)cc3)ncc12
Cc2ncc(C(=O)NCCC1CCCCC1)cc2Nc4nn(C)c5nc(Nc3ccc(CC#N)nc3)ncc45
Cc2ncc(C(=O)NCCC1CCCCC1)cc2Nc4nn(C)c5nc(Nc3ccc(CC(=O)O)cc3)ncc45
Cc2ncc(C(=O)NCCC1CCCCC1)cc2Nc4nn(C)c5nc(Nc3cncc(CC(=O)O)c3)ncc45
Cc2ncc(C(=O)NCCC1CCCCC1)cc2Nc4nn(C)c5nc(NCCC3CCCCC3)ncc45
Cc2ncc(C(=O)NCCC1CCCCC1)cc2Nc5nn(C)c6nc(Nc4ccc(N3CCNCC3)nc4)ncc56
Cc1ncc(C(=O)NCCC2CCCCC2)cc1Nc1nn(C)c2nc(Nc3ccnc(N4CCN(CCO)CC4)c3)ncc12
Cc1ncc(C(=O)NCCN2CCCC2(C)C)cc1Nc1nn(C)c2nc(Nc3ccnc(N4CCC(CCO)CC4)c3)ncc12
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Cc2ncc(C(=O)NCCN1C[C@H](C)O[C@@H](C)C1)cc2Nc4nn(C)c5nc(Nc3ccncc3)ncc45
Cc1ncc(NC(=O)C2(C(=O)N3CCN(C)CC3)CC2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
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COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CCC6(CC6)C5)cnc4C)nn(C)c3n2)cn1
COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CCCC5(C)C)cnc4C)nn(C)c3n2)cn1
COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CC(C)(C)C5)cnc4C)nn(C)c3n2)cn1
COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CC6CCC5CC6)cnc4C)nn(C)c3n2)cn1
COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CCC[C@@H]5C)cnc4C)nn(C)c3n2)cn1
COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CCC(C)(C)C5)cnc4C)nn(C)c3n2)cn1
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COCCn1cc(Nc2ncc3c(Nc4cc(NC(=O)CN5CCC6(CC6)C5)cnc4C)nn(C)c3n2)cn1
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COC1CCN(CC(=O)Nc2cnc(C)c(Nc3nn(C)c4nc(Nc5cnn(C)c5)ncc34)c2)CC1
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CO[C@H]1CCN(CC(=O)Nc2cnc(C)c(Nc3nn(C)c4nc(Nc5cnn(C)c5)ncc34)c2)C1
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Cc1ncc(NC(=O)CN2CCCC2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
CO[C@@H]1CCN(CC(=O)Nc2cnc(C)c(Nc3nn(C)c4nc(Nc5cnn(C)c5)ncc34)c2)C1
Cc1ncc(NC(=O)CN2CC[C@H](C)C2)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3)ncc12
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Cc1ncc(NC(=O)CN2CCC[C@@H]2C)cc1Nc1nn(C)c2nc(Nc3ccnn3C)ncc12
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Cc3ncc(C(=O)NCCN1C2CCC1CC2)cc3Nc5nn(C)c6nc(Nc4cnn(C)c4)ncc56
Cc3ncc(C(=O)NCCN2CCC1(CC1)C2)cc3Nc5nn(C)c6nc(Nc4cn(C)nc4C)ncc56
Cc2ncc(C(=O)NCCN1CCC[C@@H]1C)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3C)ncc45
Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc4nn(C)c5nc(Nc3cnn(C)c3C)ncc45
Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc4nn(C)c5nc(Nc3ccnn3C)ncc45
Cc5cc(Nc4ncc3c(Nc2cc(C(=O)NCCN1CCC[C@@H]1C)cnc2C)nn(C)c3n4)n(C)n5
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Cc2ncc(C(=O)NCCN1CCC[C@@H]1C)cc2Nc4nn(C)c5nc(Nc3cn(C)nc3C)ncc45
Cc2ncc(C(=O)NCCN1CCCC1(C)C)cc2Nc4nn(C)c5nc(Nc3cn(C)nc3C)ncc45
Cc1ncc(C(=O)CCCN2CCC[C@@H]2C)cc1Nc1nn(C)c2nc(Nc3cnn(C)c3C)ncc12
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Cc1ncc(C(=O)Nc2cc(C(=O)NCc3ccc(F)c(F)c3)c(F)cc2C)s1
Cc1ncc(C(=O)Nc2cc(C(=O)NCc3ccc(OC(F)(F)F)cc3)c(F)cc2C)s1
Cc1ncc(C(=O)Nc2cc(C(=O)NCc3ccc(C(F)(F)F)cc3)c(F)cc2C)s1
Cc1ncc(C(=O)Nc2cc(C(=O)NCc3ccc(OC(F)(F)F)c(F)c3)c(F)cc2C)s1
Cc1ncc(C(=O)Nc2cc(C(=O)NCc3ccc(OC(F)(F)F)cc3F)c(F)cc2C)s1
OC[C@H](Nc1cnc(-c2cc(Cl)ccc2O)c(c1)-c1ccc2cnccc2c1)c1ccccc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1-c1cc(F)ccc1O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1-c1cc(Cl)ccc1O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1-c1ccc(F)cc1O |r|
CC(c1cc2cc(cnc2cc1F)-c1cnn(C)c1)n1nnc2ncc(nc12)-c1cnn(CCO)c1
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-n2nc(-c3ccc(OCCN4CCOCC4)cc3)c3c(N)ncnc23)no1
Cc1cc(=O)n(nc1C(=O)Nc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1)-c1ccc(F)cc1
CCC(=O)N1CC[C@@H](C1)N1C(=O)N(Cc2cnc(Nc3ccc(N4CCN(CC4)C4COC4)c(C)c3)nc12)c1cc(OC)ccc1Cl |r|
COC(=O)c1ccc2\C(=C(\Nc3ccc4n(C)c(CN(C)C)nc4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4n(cc(CN(C)C)c4c3)C(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4[nH]c(CN5CCN(C)CC5)cc4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4nc(CN(C)C)oc4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4nc(CN5CCN(C)CC5)oc4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4[nH]c(cc4c3)C(=O)N3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4n(C)c(cc4c3)C(=O)N3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4[nH]cc(CN(C)C)c4c3)c3ccccc3)C(=O)Nc2c1
CCn1cc(CN(C)C)c2cc(N\C(=C3/C(=O)Nc4cc(ccc34)C(=O)OC)c3ccccc3)ccc12
COC(=O)c1ccc2\C(=C(\Nc3ccc4[nH]cc(CN5CCN(C)CC5)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4n(C)cc(CN5CCN(C)CC5)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4n(C)cc(CN(C)C)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4n(C)c(CN5CCN(C)CC5)nc4c3)c3ccccc3)C(=O)Nc2c1
CCn1c(cc2cc(N\C(=C3/C(=O)Nc4cc(ccc34)C(=O)OC)c3ccccc3)ccc12)C(=O)N1CCN(C)CC1
COC(=O)c1ccc2\C(=C(\Nc3ccc4[nH]cc(CN5CCOCC5)c4c3)c3ccccc3)C(=O)Nc2c1
COc1cccc(Nc2cc(ncn2)N2CCN(CC2)C(=O)Nc2ccc(cc2)C(F)(F)F)c1
Clc1cccc(NC(=O)Nc2ccc(cc2)-c2ccc(NC(=O)C=C)nc2)c1
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)-c2nnn(C)n2)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc4CCN(C(=O)Cn5cncn5)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N3[C@H](CN4CCN(C)CC4)CCC3=O)c3ccccc3)C(=O)Nc2c1 |r|
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)-c2ncon2)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N3[C@@H](CN4CCN(C)CC4)CCC3=O)c3ccccc3)C(=O)Nc2c1 |r|
COC(=O)c1ccc2\C(=C(\Nc3ccc4CCN(C(=O)CN5CC(C)OC(C)C5)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N3CCC(CN4CCN(C)CC4)C3=O)c3ccccc3)C(=O)Nc2c1
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)-n2nccn2)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc4CCN(C(=O)CN5CCCC5=O)c4c3)c3ccccc3)C(=O)Nc2c1
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)-c2cnco2)c2ccccc2)cc1
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(OC(F)(F)F)ccc23)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N3[C@@H](CN(C)C)CCC3=O)c3ccccc3)C(=O)Nc2c1 |r|
COC(=O)c1ccc2\C(=C(\Nc3ccc4CCN(C(=O)CN5CCOCC5)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4CCN(C(=O)CN(C)C)c4c3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc4CCN(C(=O)Cn5cccn5)c4c3)c3ccccc3)C(=O)Nc2c1
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)-c2ccco2)c2ccccc2)cc1
CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)-c2nnco2)c2ccccc2)cc1
Nc1n[nH]c2cccc(-c3ccc(NC(=S)Nc4cc(Br)ccc4OC(F)(F)F)cc3)c12
CCCNC(=O)c1cc(Oc2ccc(NC(=O)c3cc4cccnc4n(-c4ccc(F)cc4)c3=O)cc2)ccn1
Nc1ncnc2n3C[C@@H](NC(=O)C=C)C(=C)c3c(-c3ccc(Oc4ccccc4)cc3)c12 |r|
Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
COCCOc1cc2ncnc(N3CCN(CC3)c3ncc(Cc4ccccc4)cn3)c2cc1OCCOC
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(cc2)C(=O)NCCCCCCC(=O)NO)n1
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(cc2)C(=O)Nc2ccccc2N)n1
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(cc3)C3=Nc4cscc4NC(=O)C3)cc2C(F)(F)F)CC1 |t:22|
CN(C)CCN(Cc1ccc(cc1)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1)C(=O)c1cccnc1
O=c1n(cnc2ccc(cc12)-c1ccnc2ccccc12)-c1ccc(cc1)N1CCOCC1
CSc1ccc(cc1)N(C)c1ncnc2occ(C)c12
CN(C)c1ccc(Nc2ncnc3occ(C)c23)cc1
CNc1ccc(Nc2ncnc3occ(C)c23)cc1
CN(C)c1ccc(cc1)N(C)c1ncnc2occ(C)c12
CNc1ccc(cc1)N(C)c1ncnc2occ(C)c12
CCCN(c1ccc(OC)cc1)c1ncnc2occ(C)c12
COc1ccc(cc1)N(C(C)C)c1ncnc2occ(C)c12
COc1ccc(Nc2ncnc3occ(C)c23)cc1
COc1ccc(cc1)N(C)c1ncnc2occ(C)c12
Cc1coc2ncnc(Nc3ccc(cc3)[N+]([O-])=O)c12
CCc1ccc(cc1)N(C)c1ncnc2occ(C)c12
CN(c1ccc(cc1)[N+]([O-])=O)c1ncnc2occ(C)c12
CCN(c1ccc(OC)cc1)c1ncnc2occ(C)c12
Nc1onc2nc(cc(-c3ccc(NC(=O)Nc4ccc(Cl)c(c4)C(F)(F)F)cc3)c12)-c1ccccc1
Cc1cc(-c2ccc(NC(=O)Nc3cccc(Cl)c3)cc2)c2c(N)onc2n1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2cc(nc3noc(N)c23)-c2ccccc2)c1
Nc1onc2nc(cc(-c3ccc(NC(=O)Nc4ccc(F)cc4)cc3)c12)-c1ccccc1
Cc1cc(-c2ccc(NC(=O)Nc3ccccc3Cl)cc2)c2c(N)onc2n1
Cc1cc(-c2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)c2c(N)onc2n1
Nc1onc2nc(cc(-c3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12)-c1ccccc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc3noc(N)c23)-c2ccccc2)cc1
Nc1onc2nc(cc(-c3ccc(NC(=O)Nc4ccccc4)cc3)c12)-c1ccccc1
Cc1cccc(NC(=O)Nc2ccc(cc2)-c2cc(C)nc3noc(N)c23)c1
Nc1onc2nc(cc(-c3ccc(NC(=O)Nc4cccc(Cl)c4)cc3)c12)-c1ccccc1
Cc1cc(-c2ccc(NC(=O)Nc3ccc(NC(=O)C(=C)CN4CCOCC4)c(C)c3)cc2)c2c(N)onc2n1
Cc1cc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2)c2c(N)onc2n1
Fc1ccc(cc1)-n1c2ncccc2cc(C(=O)Nc2ccc(Oc3ccnc4[nH]ccc34)c(F)c2)c1=O
COc1cc2c(Oc3ccc(NC(=O)c4cc5cccnc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
COc1cc(O)c(C(O)=O)c(c1)C1=C(C)C[C@@H](O)C1=O |r,wD:16.17,c:13,(10.48,-22.79,;11.26,-21.46,;10.49,-20.12,;11.26,-18.8,;10.49,-17.47,;11.26,-16.14,;8.97,-17.47,;8.2,-16.14,;8.96,-14.8,;6.65,-16.13,;8.21,-18.79,;8.97,-20.12,;6.66,-18.79,;5.76,-17.54,;4.98,-16.2,;4.29,-18.01,;4.29,-19.55,;3.04,-20.45,;5.75,-20.03,;6.22,-21.5,)|
COc1cc(O)c(C(O)=O)c(c1)-c1cc(O)c(O)cc1C
COc1cc(O)c2c(c1)c1c(C)cc(O)c(O)c1oc2=O
Cc1cc(O)cc2oc(=O)c3c(O)cc(OS(O)(=O)=O)cc3c12
COc1cc2c(C(=O)OC22C(C)CC(=O)C2=O)c(O)c1
Cc1cc(O)cc2oc(=O)c3c(O)cc(O)cc3c12
[H][C@]12[C@@H](O)CC(=O)c3c(O)ccc(-c4ccc(O)c5C(=O)CC[C@]1(O)c45)c23 |r|
COc1cc(O)c2c(c1)-c1cc(O)c(O)cc1COC2=O
Cc1cc(O)c(O)cc1-c1cc(O)cc(O)c1C(O)=O
COc1cc(O)c2c(c1)c1c(C)cc(O)cc1oc2=O
Fc1cccc(NC(=O)CC(=O)Nc2ccc3c(\C=C\c4ccccn4)n[nH]c3c2)c1
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1 |r,t:9|
COc1cc(O)c2C(=O)c3c(O)c(O)c(C)cc3C(=O)c2c1
COc1cc(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2c1
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1-c1c(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2cc1OC |r,wU:18.19,11.11,13.13,wD:16.16,t:9,(-6.62,-6.52,;-5.29,-5.75,;-3.96,-6.52,;-3.96,-8.06,;-2.63,-8.83,;-2.63,-10.37,;-1.3,-8.07,;.04,-8.83,;.05,-10.37,;1.38,-8.06,;1.38,-6.5,;2.72,-5.72,;2.71,-4.19,;4.06,-6.5,;4.82,-5.16,;5.38,-7.27,;4.07,-8.06,;5.4,-8.82,;2.72,-8.83,;2.72,-10.37,;.03,-5.73,;.02,-4.19,;-1.3,-6.52,;-2.63,-5.75,;-2.6,-3.5,;-1.27,-2.73,;.06,-3.5,;-1.26,-1.19,;.06,-.41,;1.4,-1.16,;.05,1.13,;1.37,1.91,;1.36,3.45,;2.68,4.23,;.01,4.21,;-.01,5.74,;-1.31,3.42,;-1.29,1.89,;-2.62,1.11,;-3.96,1.87,;-2.6,-.43,;-3.93,-1.19,;-3.93,-2.74,;-5.26,-3.5,;-6.59,-2.73,)|
CC(C)n1c(C)nc2c(F)cc(cc12)-c1nc(Nc2ccc3CN(CCN(C)C)CCc3n2)ncc1F
FC(F)(F)c1ccc(COc2ccc(Nc3ncnc4cc5OCCOCCOCCOCCOc5cc34)cc2)cc1
Cc1c(oc2ccc(C)cc12)-c1n(nc2c1c(N)n[nH]c2=O)-c1ccc(NC(=O)C=C)cc1 |(12.65,-38.72,;11.4,-37.83,;9.94,-38.31,;9.03,-37.07,;9.93,-35.82,;9.6,-34.32,;10.73,-33.29,;12.2,-33.76,;13.34,-32.72,;12.53,-35.26,;11.39,-36.29,;9.47,-39.77,;10.38,-41.01,;9.48,-42.26,;8.02,-41.79,;8.01,-40.26,;6.68,-39.48,;6.68,-37.94,;5.35,-40.26,;5.35,-41.8,;6.68,-42.56,;6.68,-44.1,;11.92,-41,;12.69,-42.33,;14.23,-42.32,;15,-40.98,;16.54,-40.97,;17.3,-39.63,;16.52,-38.3,;18.84,-39.62,;19.6,-38.28,;14.21,-39.65,;12.67,-39.66,)|
[H][C@]12C[C@H]([C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)CCOCCOCCOCCNC(=O)CCC1=[N+]2C(C=C1)=Cc1c(C)cc(C)n1[B-]2(F)F |r,c:63,65,t:60|
[H][C@]12C[C@@H](NCCOCCOCCOCCNC(=O)CCC3=[N+]4C(C=C3)=Cc3c(C)cc(C)n3[B-]4(F)F)[C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r,c:24,26,t:21|
COc1ccc2NC(=O)\C(=N/NC(=O)c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)c2c1
COc1ccc2NC(=O)\C(=N/NC(=O)c3ccc(NC(=O)Nc4ccccc4)cc3)c2c1
COc1ccc2NC(=O)\C(=N/NC(=O)c3ccc(NC(=O)Nc4ccc(Cl)cc4)cc3)c2c1
COc1cccc(NC(=O)Nc2ccc(cc2)C(=O)N\N=C2/C(=O)Nc3ccc(Cl)cc23)c1
COc1ccc2NC(=O)\C(=N/NC(=O)c3ccc(NC(=O)Nc4cccc(OC)c4)cc3)c2c1
COc1ccc2NC(=O)\C(=N/NC(=O)c3ccc(NC(=O)Nc4ccc(Cl)c(c4)C(F)(F)F)cc3)c2c1
COc1ccc(cc1)C(=O)Nc1ccc(cc1)C(=O)N\N=C1/C(=O)Nc2ccc(Br)cc12
COc1ccc(cc1)C(=O)Nc1ccc(cc1)C(=O)N\N=C1/C(=O)Nc2ccc(OC)cc12
COc1ccc(NC(=O)Nc2ccc(cc2)C(=O)N\N=C2/C(=O)Nc3ccc(OC)cc23)cc1
FC(F)(F)c1cc(NC(=O)Nc2ccc(cc2)C(=O)N\N=C2/C(=O)Nc3ccc(Br)cc23)ccc1Cl
COc1ccc(NC(=O)Nc2ccc(cc2)C(=O)N\N=C2/C(=O)Nc3ccc(Br)cc23)cc1
COc1cccc(NC(=O)Nc2ccc(cc2)C(=O)N\N=C2/C(=O)Nc3ccc(Br)cc23)c1
Cc1ccc(cc1NC(=O)C1(CC1)c1ncnc2[nH]cnc12)C(=O)Nc1ccc(Cl)c(c1)C(F)(F)F
COC[C@@H](C)Nc1cc(NC(=O)N2CCCc3cc(CN4CCCCOC4=O)c(C=O)nc23)ncc1C#N |r|
CN(CCc1ccc(cc1)-c1ccccc1)Cc1cn(C)c2ccc(cc12)C(=O)Nc1ccc(F)cc1
COc1cc2c(ccnc2cc1OCCCN3CCOCC3)Oc4ccc(cc4F)NC(=O)C5(CC5)C(=O)Nc6ccc(cc6)F
COc1cc2c(Oc3ccc(NC(=O)NS(=O)(=O)Cc4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Cc1nc2cc3nc(cnc3cc2n1C)-c1cccs1
Brc1ccsc1\C=C1/C(=O)Nc2ccccc12
CC(C)c1cc(\C=C2/C(=O)Nc3ccccc23)cc(C(C)C)c1O
Cc1cccc2NC(=O)\C(=C/c3ccc[nH]3)c12
Clc1ccc2NC(=O)\C(=C/c3ccc(cc3)N3CCOCC3)c2c1
Cc1cc(C)c(\C=C2/C(=O)Nc3cccc(C)c23)[nH]1
CN(C)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
CSc1ccc(\C=C2/C(=O)Nc3ccccc23)s1
C\C(=C1/C(=O)Nc2ccccc12)c1ccc(cc1)N1CCCCC1
CCc1ccc(\C=C2/C(=O)Nc3ccccc23)s1
O=C1Nc2ccccc2\C1=C\c1ccc[nH]1
O=C1Nc2ccccc2\C1=C/c1ccco1
CCc1c(C)c(C)[nH]c1\C=C1/C(=O)Nc2ccccc12
O=CN1CCN(CC1)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
Brc1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
Cn1cc(Cl)c(\C=C2/C(=O)Nc3ccccc23)n1
CN(C)c1ccc(\C=C2/C(=O)Nc3cccc(C)c23)cc1
CCOC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccccc23)c1C
Oc1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
CC(C)(C)c1cc(\C=C2/C(=O)Nc3ccccc23)cc(c1O)C(C)(C)C
O=C1Nc2ccccc2\C1=C\c1ccc(cc1)N1CCCC1
O=C1Nc2ccccc2\C1=C\c1ccc(cc1)N1CCCCC1
CCc1c(C)[nH]c(\C=C2/C(=O)Nc3ccccc23)c1C
Fc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
CN(C)c1ccc(\C=C2/C(=O)N(C)c3ccccc23)cc1
CN(C)c1ccc(\C=C2/C(=O)Nc3cc(F)ccc23)cc1
CC(C)c1ccc(\C=C2\C(=O)Nc3ccccc23)cc1
Cn1cccc1\C=C1/C(=O)Nc2ccccc12
COc1c(Br)cc(\C=C2/C(=O)Nc3ccccc23)cc1C(C)(C)C
Clc1ccc2NC(=O)\C(=C/c3ccc[nH]3)c2c1
CSc1ccc(\C=C2/C(=O)Nc3cccc(C)c23)s1
CC(C)c1cc(\C=C2/C(=O)Nc3ccc(Cl)cc23)cc(C(C)C)c1O
COC(=O)CCc1c[nH]c(\C=C2/C(=O)Nc3ccccc23)c1C
OC(=O)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
CN1C(=O)\C(=C/c2ccc(Br)cc2)c2ccccc12
COc1ccc(\C=C2/C(=O)Nc3ccccc23)cc1C(C)(C)C
Cc1cc(C)c(\C=C2/C(=O)Nc3ccc(C)cc23)[nH]1
Brc1ccc2NC(=O)\C(=C/c3ccc(cc3)N3CCOCC3)c2c1
CCc1ccc(\C=C2\C(=O)Nc3ccccc23)o1
Cc1c[nH]c(\C=C2/C(=O)Nc3ccccc23)c1C
Cc1ccc(o1)/C=C/2\c3ccccc3NC2=O
COc1c(Br)cc(\C=C2/C(=O)Nc3ccc(Cl)cc23)cc1C(C)(C)C
Clc1cn[nH]c1C=C1C(=O)Nc2ccccc12 |w:6.6|
Cc1cc(C)c(\C=C2/C(=O)Nc3cc(F)ccc23)[nH]1
Brc1ccc2NC(=O)\C(=C/c3ccc(cc3)N3CCN(CC3)C=O)c2c1
Cc1cccc2NC(=O)\C(=C/c3ccc(cc3)N3CCN(CC3)C=O)c12
O=C1Nc2ccccc2\C1=C\c1ccc(cc1)N1CCOCC1
[O-][N+](=O)c1ccc2NC(=O)\C(=C/c3ccc[nH]3)c2c1
Cc1cccc2NC(=O)\C(=C/c3ccc(cc3)N3CCOCC3)c12
CCOC(=O)c1c[nH]c(\C=C2/C(=O)Nc3ccccc23)c1C
COc1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
Brc1csc(\C=C2/C(=O)Nc3ccccc23)c1
COc1ccc(\C=C2/C(=O)Nc3ccc(Cl)cc23)cc1C(C)(C)C
Cc1ccc(NC(=O)c2ccnc(c2)C(F)(F)F)cc1-c1cc(OCCO)nc(c1)N1CCOCC1
COc1cc2nccc(Oc3ccc(NC(=O)Cc4ccc(Cl)c(c4)C(F)(F)F)cc3)c2cc1OC
CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1
COc1cc(C)cc2cc(sc12)-c1cn([C@H]2CCN(C2)C(=O)C=C)c2ncnc(N)c12 |r|
CCOC(=O)c1ccc(Nc2ccnc(SCC(=O)c3ccc(cc3)C#N)n2)cc1
Fc1ccc(cc1)C(=O)CSc1nccc(Nc2ccc(cc2)N2CCOCC2)n1
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c(F)c2)ccn1
CN([C@@H]1Cc2ccc(cc2C1)C(=O)Nc1cc(cc(c1)C(F)(F)F)-n1cnc(C)c1)c1cncnc1 |r|
Fc1ccc(cc1)-c1csc(n1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(cc1)N1CCOCC1 |c:15|
Clc1ccc(cc1)C1CC(=NN1c1nc(cs1)-c1ccc(cc1)C#N)c1ccc(cc1)N1CCCCC1 |c:10|
Clc1ccc(cc1)C1CC(=NN1c1nc(cs1)-c1ccc(cc1)C#N)c1ccc(cc1)N1CCOCC1 |c:10|
COc1cc(ccc1OCc2ccc(cc2)C3CC3)C4CN(C4)C(=O)c5cc(ccn5)COC[C@H](CO)O
C[C@@H](c1cc2cccnc2cc1F)n1cnc2ncc(nc12)-c1cnn(C)c1 |r|
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
Fc1ccc(cc1)-n1cc(C(=O)Nc2ccc(Oc3ccnc4[nH]ccc34)c(F)c2)c(=O)c2ccccc12
COc1ccc(cc1OC)-c1cnn2c(N)c(-c3ccccc3)c(OC3CCN(C)CC3)nc12
COC(=O)Nc1ccc(cc1)-c1c(OC2CCN(C)CC2)nc2c(cnn2c1N)-c1ccc(OC)c(OC)c1
COc1ccc(cc1OC)-c1cnn2c(N)c(-c3nccs3)c(OC3CCN(C)CC3)nc12
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn(nn2)-c2ccc(OCCN3CCOCC3)cc2Cl)no1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(c(C)c3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(c(C)c3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(nc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(nc3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3cnc(c(C)c3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3cnc(c(C)c3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3c(C)ccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3c(C)ccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
CCN(CC)Cc1ccc(C)n1-c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)C(=O)OC)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3c(C)ccc3CN3CCOCC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(nc3)-n3c(C)ccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(nc3)-n3c(C)ccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
CN1CCN(CC1)c1cccc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)cc(c1)-c1cc(C)no1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)cc(c1)N1CCOCC1
Cc1cn(cn1)-c1cc(CN2CCCC[C@H]2C(N)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1 |r|
Cc1cn(cn1)-c1cc(CN2CCCC[C@H]2C(O)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1 |r|
Cc1cn(cn1)-c1cc(CN2CCC[C@H](N)C2)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccc(F)cc3)c2)c1 |r|
CCCCc1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)-n1cnc(C)c1
Cc1cn(cn1)-c1cc(CCS(N)(=O)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)c1
Cc1cn(cn1)-c1cc(CCC(O)=O)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)c1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(\C=C\C(O)=O)c1
CN1CCN(Cc2cc(NC(=O)c3ccc(C)c(Nc4nccc(n4)-c4ccccc4)c3)cc(c2)-n2cnc(C)c2)CC1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)-n1cnc(C)c1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)N1CCNCC1
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3ccccc3)c2)cc(c1)C(F)(F)F
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)C(F)(F)F
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)cc2)cc(c1)-n1cnc(C)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)cc(c1)-n1cnc(C)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(Oc3cccc4ccncc34)c2)cc(c1)-n1cnc(C)c1
CN1CCN(CC1)c1cc(NC(=O)c2ccc(C)c(c2)C(=O)c2cccc(c2)C#N)cc(c1)-n1cnc(C)c1
Cc1cn(cn1)-c1cc(CN2CCC[C@H](N)C2)cc(NC(=O)c2ccc(C)c(Oc3ccccc3)c2)c1 |r|
COc1cc2c(Oc3ccc(NC(=O)C(C)c4nnc(o4)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)c4nnc(o4)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCCC1
CC(C)(C)c1ccc(cc1)C(=O)NCc1ccc(cc1)-c1ncnc2[nH]ccc12
CNC(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCOCC4)Cl
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3cccc(c3)[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4cccc5ccccc45)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc4OCOc4c3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Cc4ccncc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccccc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(SC)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Cl)c(c3)[N+]([O-])=O)c2cc1OC
CCCc1ccc(NC(=O)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1ccccc1Oc1ccc(NC(=O)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccccc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)S(C)=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3cc(Cl)cc(Cl)c3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Br)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(O)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccccc3[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Cl)cc3Cl)c2cc1OC
COc1ccc(NC(=S)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3cccc(c3)C(O)=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Nc4ccccc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(F)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(I)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3cccc(Cl)c3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=[SH+])[N-]c3cccc(c3)[N+]([O-])=O)c2cc1OC
COc1ccc(NC(=O)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(C)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=[SH+])[N-]c3ccccc3[N+]([O-])=O)c2cc1OC
CCc1ccc(NC(=O)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(Br)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(N)cc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C(O)=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Cc4ccccc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccncc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=[SH+])[N-]c3ccc(Cl)c(c3)[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(cc3)C(C)(C)C)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)-c3ccccc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc4OCOc4c3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)S(C)(=O)=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(Cl)cc4)cc3)c2cc1OC
CCCCc1ccc(NC(=S)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OCc4ccccc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(I)cc3)c2cc1OC
CCOC(=O)c1ccc(NC(=O)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Cl)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccccc3Cl)c2cc1OC
CCCCc1ccc(NC(=O)N2CCN(CC2)c2ncnc3cc(OC)c(OC)cc23)cc1
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C(C)C)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(Cl)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(cc4)[N+]([O-])=O)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3cccc(Cl)c3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(C)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=[SH+])[N-]c3ccc(cc3)[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C(C)(C)C)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(C)cc4)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(OC(C)C)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(Br)c(Cl)c3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccccc3Cl)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(SC)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(cc3)C(C)C)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3ccc(F)cc3)c2cc1OC
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Cl)c(Cl)c3)c2cc1OC
Cc1nc2ccccc2c(n1)N(C)c3ccc(cc3)OC
COc1ccc2N(CCCc2c1)c1nc(C)nc2ccccc12
CSc1ccc(cc1)N(C)c1nc(C)nc2ccccc12
COc1cccc2cc(ccc12)N(C)c1nc(C)nc2ccccc12
COc1ccc2N(CCCc2c1)c1ncnc2ccccc12
COc1ccc(cc1)N(C)c1nc(Cl)nc2ccccc12
COc1ccc2N(CCCc2c1)c1nc(Cl)nc2ccccc12
Cc1cc(-c2cnc3cc(ccn23)-c2ccc(cc2)N2CCNCC2)c2ccccc2n1
Cc1cc(-c2cnc3cc(ccn23)-c2ccc(cc2)N2CCNCC2)c2cc(F)ccc2n1
Cc1cc(-c2cnc3cc(ccn23)-c2ccc(cc2)N2CCNCC2)c2cc(F)cc(F)c2n1
Cc1cc(-c2cnc3cc(ccn23)-c2ccc(cc2)C2CNCCN2)c2ccccc2n1
Cc1cc(-c2cnc3cc(ccn23)-c2ccc(cc2)C2CNCCN2)c2cc(F)cc(F)c2n1
Nc1nccc(COc2ccc3nc(N[C@@H]4CCCC[C@H]4O)sc3c2)c1Cl |r|
COc1cc(OCc2ccnc(N)c2Cl)cc2sc(N[C@@H]3CCCC[C@H]3O)nc12 |r|
Nc1nccc(COc2cc(Cl)c3nc(N[C@@H]4CCCC[C@H]4O)sc3c2)c1Cl |r|
Nc1nccc(COc2cc(F)c3nc(N[C@@H]4CCCC[C@H]4O)sc3c2)c1Cl |r|
Nc1nccc(COc2ccc3nc(N[C@@H]4CCCC[C@H]4O)sc3c2Cl)c1Cl |r|
COc1cc(OCc2ccnc(N)n2)cc2sc(N[C@@H]3CCCC[C@H]3O)nc12 |r|
COc1cc(OCc2ccnc(N)n2)cc2sc(N[C@H]3CCCC[C@@H]3O)nc12 |r|
COc1cc(OCc2ccnc(N)n2)c(Cl)c2sc(N[C@H]3CCCC[C@@H]3O)nc12 |r|
COc1cc(OCc2ccnc(Nc3cnn(C)c3)n2)cc2sc(N[C@H]3CCCC[C@@H]3O)nc12 |r|
CNC(=O)c1cc(Oc2ccc3nc(N[C@@H]4CCCC[C@H]4O)sc3c2)ccn1 |r|
Nc1nccc(COc2ccc3nc(NC4CCCCC4)sc3c2)c1Cl
Nc1nccc(COc2ccc3nc(N[C@H]4CCCC[C@@H]4O)sc3c2)c1Cl |r|
Nc1nccc(COc2ccc3nc(N[C@H]4CCCC[C@H]4O)sc3c2)c1Cl |r|
Nc1nccc(COc2ccc3nc(N[C@@H]4CCCC[C@@H]4O)sc3c2)c1Cl |r|
Nc1nccc(COc2ccc3nc(N[C@@H]4CCCC[C@H]4O)sc3c2F)c1Cl |r|
Cc1ccc(NC(=O)c2ccc(C)c(c2)C(F)(F)F)cc1C#Cc1nn([C@H]2CC[C@H](O)CC2)c2ncnc(N)c12 |r,wU:26.27,wD:29.31,(-5.46,5.4,;-3.98,5.8,;-3.58,7.29,;-2.09,7.69,;-1,6.6,;.49,7,;1.57,5.91,;1.18,4.42,;3.06,6.31,;3.46,7.79,;4.95,8.19,;6.04,7.1,;7.53,7.5,;5.64,5.62,;4.15,5.22,;6.73,4.53,;8.22,4.93,;6.33,3.04,;7.82,3.44,;-1.4,5.11,;-2.89,4.71,;-3.29,3.22,;-3.68,1.74,;-4.08,.25,;-3.18,-1,;-4.08,-2.24,;-3.68,-3.73,;-2.2,-4.13,;-1.8,-5.62,;-2.89,-6.7,;-2.49,-8.19,;-4.38,-6.31,;-4.77,-4.82,;-5.55,-1.77,;-6.88,-2.54,;-8.22,-1.77,;-8.22,-.23,;-6.88,.54,;-6.88,2.08,;-5.55,-.23,)|
CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4NCCCOc34)cc2)no1
COCC\C(Nc1ccc(Oc2ccnc3cc(OCCCN4CCOCC4)c(OC)cc23)c(F)c1)=N/S(=O)(=O)Cc1ccc(Cl)cc1
COc1cc2ncnc(Oc3ccc(Nc4nccc5[nH]cc(-c6ccc(F)cc6)c(=O)c45)cc3F)c2cc1OC
COc1cc2ncnc(Oc3ccc(Nc4nccc5[nH]cc(-c6ccc(F)cc6)c(=O)c45)cc3)c2cc1OC
CN1CCN(CC(=O)Nc2nc(C)c(s2)-c2ccc3c(\C=C\c4ccccn4)n[nH]c3c2)CC1
COc1cccc(c1)-c1cc(nc(N)c1C#N)-c1c(O)c2ccccc2oc1=O
COc1cc(OC)c(F)c(N2Cc3cnc4[nH]c(cc4c3N(C)C2=O)-c2cnn(C)c2)c1F
COc1cc(OC)c(F)c(N2Cc3cnc4[nH]ccc4c3N(C)C2=O)c1F
CC(C)Oc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COC(=O)c1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COc1cc2nc(Cl)nc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
COc1ccc2c(ncnc2c1OC)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1OC
OC(=O)c1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccc4OCOc4c3)c2cc1OC
[O-][N+](=O)c1ccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
CCNc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1N
[O-][N+](=O)c1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Nc1cc2c(ncnc2cc1Cl)N1CCN(CC1)C(=S)NCc1ccccc1
CCNc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1[N+]([O-])=O
Fc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1F
COc1ccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
Fc1ccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
COc1cc(OC)c2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
CCNc1cc2ncnc(N3CCN(CC3)C(=[SH+])[N-]Cc3ccccc3)c2cc1[N+]([O-])=O
COc1cccc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Brc1ccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
COc1cc2nc(C)nc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
Cc1ccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
Nc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1[N+]([O-])=O
CCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=S)NCc1ccccc1
CCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
COc1cc2nc(nc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC)N1CCOCC1
Ic1ccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
COc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Cc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Clc1ccc2c(ncnc2c1)N1CCN(CC1)C(=S)NCc1ccccc1
CCOc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1OC
[O-][N+](=O)c1cc2c(ncnc2cc1Cl)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2ccccc12
[O-][N+](=O)c1cc2c(ncnc2cc1Cl)N1CCN(CC1)C(=[SH+])[N-]Cc1ccccc1
COc1cc2c(ncnc2c(OC)c1OC)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CC(=O)Nc1cc2c(ncnc2cc1Cl)N1CCN(CC1)C(=S)NCc1ccccc1
Cc1cccc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c12
S=C(NCc1ccccc1)N1CCN(CC1)c1ncnc2ccccc12
COc1cc2ncc(N[C@H]3CC[C@H](O)CC3)nc2cc1OC |wU:12.12,wD:9.8,(-.13,-6.56,;-.13,-5.02,;1.2,-4.25,;2.53,-5.02,;3.88,-4.23,;5.21,-5,;6.54,-4.23,;6.54,-2.69,;7.85,-1.9,;9.2,-2.67,;9.2,-4.21,;10.53,-4.98,;11.86,-4.21,;13.19,-4.98,;11.86,-2.67,;10.53,-1.9,;5.19,-1.92,;3.88,-2.69,;2.53,-1.92,;1.2,-2.71,;-.13,-1.94,;-.13,-.4,)|
[H][C@]12[C@H](C[C@@]3(C)C4=CCC5C(C)(C)[C@]([H])(CC[C@]5(C)[C@]4([H])CC[C@]13C(=O)O[C@@]2(C)CCCC(C)=C)O[C@@H]1OC[C@@H](OS([O-])(=O)=O)[C@H](O)[C@@]1([H])O[C@@H]1O[C@H](C)[C@@H](O[C@]2([H])OC[C@@H](O)[C@H](O[C@]3([H])O[C@H](CO)[C@@H](O)[C@H](OC)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1O)OC(C)=O |r,t:6|
Cn1ncc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Clc1ccc2nccc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
COc1cc2c(ncnc2cc1OC(C)C)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCn1c2cc3ncnc(N4CCN(CC4)C(=O)Nc4ccc(Oc5ccccc5)cc4)c3cc2n(C)c1=O
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ccnc2ccccc12
CCn1c2cc3ncnc(N4CCN(CC4)C(=S)NCc4ccccc4)c3cc2n(C)c1=O
FC(F)(F)c1cc(N2CCN(CC2)C(=O)Nc2ccc(Oc3ccccc3)cc2)c2ccccc2n1
COc1cc2c(ncnc2cc1C)N1CCN(CC1)C(=S)NCc1ccccc1
CCn1c2cc3ncnc(N4CCN(CC4)C(=O)Nc4ccc(Oc5ccccc5)cc4)c3cc2n(CC)c1=O
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OCC#N
COc1cc2c(ncnc2cc1C)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCn1cnc2cc3c(ncnc3cc12)N1CCN(CC1)C(=S)NCc1ccccc1
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2nc[nH]c12
CCOc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1OCC
S=C(NCc1ccccc1)N1CCN(CC1)c1ncnc2nc[nH]c12
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OCC#C
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OCc1ccccc1
Fc1cc2c(ncnc2cn1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2ncccc12
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2cc3ccccc3cc12
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OS(C)(=O)=O
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OCC=C
S=C(NCc1ccccc1)N1CCN(CC1)c1ccnc2ccccc12
CCOC(=O)c1cnc2cc(OC)c(OC)cc2c1N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Clc1cccc2c(ccnc12)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccccc3)c2cc1OS(C)(=O)=O
FC(F)(F)c1ccc2c(ccnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OCC
CCn1nnc2cc3c(ncnc3cc12)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2cc3OCCOc3cc12
COc1cc2cncc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
CCCCn1c2cc3ncnc(N4CCN(CC4)C(=O)Nc4ccc(Oc5ccccc5)cc4)c3cc2n(CCCC)c1=O
COc1cc2nccc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
Cn1c2cc3ncnc(N4CCN(CC4)C(=O)Nc4ccc(Oc5ccccc5)cc4)c3cc2n(C)c1=O
COCCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
S=C(NCc1ccccc1)N1CCN(CC1)c1ncnc2cc3OCCOc3cc12
COCCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=S)NCc1ccc2OCOc2c1
CCOC(=O)c1cnc2cc(OC)c(OC)cc2c1N1CCN(CC1)C(=S)NCc1ccccc1
S=C(NCc1ccccc1)N1CCN(CC1)c1ncnc2cc3ccccc3cc12
Clc1ccc2c(ccnc2c1)N1CCN(CC1)C(=S)NCc1ccccc1
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1O
COc1cc2c(ncnc2cc1OCC#C)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Cn1cnc2c(ncnc12)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
Nc1nc(N2CCN(CC2)C(=O)Nc2ccc(Oc3ccccc3)cc2)c2[nH]cnc2n1
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2cc(OCc3ccccc3)c(OCc3ccccc3)cc12
CCCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
CCCn1c2cc3ncnc(N4CCN(CC4)C(=O)Nc4ccc(Oc5ccccc5)cc4)c3cc2n(CCC)c1=O
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1nncc2ccccc12
COCCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COCCOc1cc2ncnc(N3CCN(CC3)C(=S)NCc3ccc4OCOc4c3)c2cc1OC
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2n[nH]cc12
Clc1nnc(N2CCN(CC2)C(=O)Nc2ccc(Oc3ccccc3)cc2)c2ccccc12
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OCC(O)=O
COc1cc2nncc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
S=C(NCc1ccccc1)N1CCN(CC1)c1ncnc2cc3OCOc3cc12
Clc1ccc2c(ccnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2[nH]c(=O)[nH]c12
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1cncc2ccccc12
COc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OCC(C)=O
COc1cc2c(ncnc2cc1OCC=C)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCCCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
CCCOc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COC(=O)COc1cc2c(ncnc2cc1OC)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
Clc1ccc2nccc(N3CCN(CC3)C(=S)NCc3ccccc3)c2c1
CCOCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OC
CCn1c2cc3ncnc(N4CCN(CC4)C(=O)Nc4ccc(Oc5ccccc5)cc4)c3cc2[nH]c1=O
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1nnc(Cc2ccccc2)c2ccccc12
O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)c1ncnc2cc3OCOc3cc12
CC(C)OCc1ccc2n(CCCO)c3c4Cc5ccccc5-c4c4C(=O)NCc4c3c2c1
CC(C)n1cc(C(=O)Nc2ccc(Oc3ccnc(NC(=O)C4CC4)c3)c(F)c2)c(=O)n(-c2ccc(F)cc2)c1=O
Cc1c(NC(=O)CCN2CCCC2)c[nH]c1\C=C1/C(=O)Nc2ccc(F)cc12
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(N)=O)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC(O)=O)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CC(O)=O)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN(C)C)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(C)CC3)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCC(O)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCOCC3)c2c1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(C)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CCO)CC3)c2c1
CCOC(=O)CN1CCN(CCCc2c3CCCCc3[nH]c2\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NC)CC1
CCS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCN(CCO)CC3)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCC(N)=O)c2c1
CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCC(O)CC3)c2c1
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)[C@@H]1C[C@H](CO)C1 |r,wU:17.19,19.22,(11.65,-9.07,;11.66,-10.61,;12.99,-11.37,;13,-12.92,;11.66,-13.69,;10.32,-12.92,;8.86,-13.4,;7.95,-12.16,;8.85,-10.91,;8.37,-9.46,;6.87,-9.15,;6.38,-7.69,;7.41,-6.53,;8.92,-6.85,;9.95,-5.7,;9.4,-8.31,;10.32,-11.38,;8.4,-14.88,;7.03,-15.58,;7.73,-16.95,;7.26,-18.42,;8.3,-19.56,;9.1,-16.25,)|
Nc1ncnc2n(cc(-c3cccc(O)c3)c12)C1CCCC1
CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cc(O)ccc2F)c2c(N)ncnc12 |r,wU:11.14,9.9,(5.38,-23.19,;6.89,-22.87,;7.92,-24.01,;7.36,-21.4,;6.33,-20.26,;6.8,-18.8,;8.31,-18.48,;9.35,-19.61,;8.87,-21.08,;8.78,-17.01,;8.08,-15.64,;9.45,-14.94,;10.15,-16.31,;9.91,-13.47,;9,-12.23,;9.9,-10.98,;9.42,-9.52,;10.45,-8.37,;9.97,-6.91,;11,-5.76,;8.46,-6.59,;7.43,-7.75,;7.92,-9.21,;6.9,-10.36,;11.37,-11.45,;12.7,-10.67,;12.7,-9.13,;14.04,-11.43,;14.05,-12.98,;12.71,-13.76,;11.37,-12.99,)|
CC(C)n1cc(C(=O)Nc2cc(F)c(cc2F)-c2c[nH]c3ncnc(N)c23)c(=O)c(c1)-c1ccc(F)cc1
CNC(=O)c1cc(COc2nnc(Nc3ccc(Cl)cc3)c3ccoc23)ccn1
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
COc1cc2c(cc1C(=O)N)c(ccn2)Oc3ccc(c(c3)Cl)NC(=O)NC4CC4
Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1Cl |r|
CN(C)c1ccc2c(Oc3ccc(NC(=O)NCc4ccc(nc4)C(F)(F)F)cc3)ncnc2c1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(cc1)-c1ccncc1
COc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=S)Nc1ccc(Br)cc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1cnc(C)cn1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccnc(c1)C#N
COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1)C(F)(F)F
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1nccs1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(Nc1ccncc1)=NC#N |w:36.41|
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(NCc1cc(C)on1)=NC#N |w:37.42|
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=S)Nc1ccc(Br)cc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(Br)cc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(C)nc1Cl
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(NCc1ccc(cc1)C(C)C)=NC#N |w:40.45|
COc1cc2c(N3CCN(CC3)C(=S)NCc3ccc(nc3)-c3ccccc3)c(cnc2cc1OCCCN1CCCCC1)C#N
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(nc1)-c1ccccc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(C)o1
COc1cc2c(N3CCN(CC3)C(=S)NCc3ccc(nc3)C(F)(F)F)c(cnc2cc1OCCCN1CCCCC1)C#N
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1Cl)C(F)(F)F
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccncc1
COc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=S)NCc1ccc2OCOc2c1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccccn1
COc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=S)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1cnc(C)cn1
COc1cc2c(N3CCN(CC3)C(=S)Nc3ccc(cc3)C#N)c(cnc2cc1OCCCN1CCCCC1)C#N
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccnc(Cl)c1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(cc1)-c1ccccn1
COc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=S)NCc1ccco1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(C)nc1
COc1cc2c(N3CCN(CC3)C(=S)Nc3ccc(cc3)-c3ccccn3)c(cnc2cc1OCCCN1CCCCC1)C#N
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1csc(n1)-c1ccc(cc1)C(F)(F)F
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(Cl)nc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(NCc1ccc2OCOc2c1)=NC#N |w:40.46|
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(cc1)-c1ccccn1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=[SH+])[N-]c1ccc(cc1)-c1cccc[n+]1[O-]
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(Cl)nc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccncc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(Cl)nc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(Nc1ccc(cc1)-c1ccccn1)=NC#N |w:42.48|
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc2OCOc2c1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(cc1)-c1ccccn1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1cccnc1
COc1cc2c(N3CCN(CC3)C(=S)Nc3ccc(nc3)-c3ccccc3)c(cnc2cc1OCCCN1CCCCC1)C#N
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(nc1)C(F)(F)F
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=S)NCc1ccc2OCOc2c1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1cccnc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1)C(F)(F)F
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccncc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(cn1)-c1ccccc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccncc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(NCc1ccc(nc1)C(F)(F)F)=NC#N |w:41.46|
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=S)NCc1cnc(C)cn1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccsc1
COc1cc2c(N3CCN(CC3)C(=S)Nc3ccncc3)c(cnc2cc1OCCCN1CCCCC1)C#N
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(cc1)-c1cccnc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1cccnc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1)C(F)(F)F
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)Nc1ccc(Cl)nn1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1csc(C)n1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(N)nc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(Nc1ccc(cc1)C(C)(C)C)=NC#N |w:40.45|
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=S)NCc1ccc(nc1)-c1ccccc1
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=S)Nc1ccc(cc1)C#N
COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)cc(OC)c1
CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)N(C(=O)C(=C4)C#N)C5CCCC5
CNC(=O)c1cccc(c1)-c1cnc2cc(-c3cnn(C)c3)c(OC)nn12
CNC(=O)c1cccc(c1)-c1cnc2cc(-c3cnn(C)c3)c(O[C@H]3CCOC3)nn12 |r|
CNC(=O)c1cncc(c1)-c1cnc2cc(-c3cnn(C)c3)c(OC3CCOC3)nn12
CNC(=O)c1ccc(F)c(c1)-c1cnc2cc(-c3cnn(C)c3)c(OC)nn12
CNC(=O)c1cc(C)cc(c1)-c1cnc2cc(-c3cnn(c3)C(C)C)c(O[C@H]3CCOC3)nn12 |r|
CNC(=O)c1cc(C)c(F)c(c1)-c1cnc2cc(-c3cnn(C)c3)c(O[C@H]3CCOC3)nn12 |r|
CNC(=O)c1cc(C(F)F)c(F)c(c1)-c1cnc2cc(-c3cnn(C)c3)c(O[C@H]3CCOC3)nn12 |r|
CNC(=O)c1cc(F)c(F)c(c1)-c1cnc2cc(-c3cnn(C)c3)c(O[C@H]3CCOC3)nn12 |r|
COc1cc2c(Oc3ccc(Nc4nn(C)cc4C(=O)NC4CCCCC4)cc3F)ccnc2cc1OCCCN1CCOCC1
c1cc(ncc1Cc2c[nH]c3c2cc(cn3)Cl)NCc4ccc(nc4)C(F)(F)F
CN(C)c1ncc(-c2ccc(Oc3ccnc(c3)-c3cnn(C)c3)c(C)n2)c(=O)[nH]1
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc([nH]c1=O)N1CCCC1
Cc1cc(ncc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc([nH]c1=O)N1CCCC1
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc([nH]c1=O)N1CCCCC1
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc([nH]c1=O)N1CCOCC1
CNc1ncc(-c2ccc(Oc3ccnc(c3)-c3cnn(C)c3)c(C)n2)c(=O)[nH]1
CCNc1ncc(-c2ccc(Oc3ccnc(c3)-c3cnn(C)c3)c(C)n2)c(=O)[nH]1
CCNc1ncc(-c2ccc(Oc3ccnc(c3)-c3cnn(C)c3)cn2)c(=O)[nH]1
CC(C)Nc1ncc(-c2ccc(Oc3ccnc(c3)-c3cnn(C)c3)c(C)n2)c(=O)[nH]1
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc(NC2CC2)[nH]c1=O
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc(NC2CCCC2)[nH]c1=O
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc(NC2CCOCC2)[nH]c1=O
CCNc1ncc(-c2ccc(Oc3ccnc(c3)-c3ccc(C)nc3)c(C)n2)c(=O)[nH]1
CCNc1ncc(-c2ccc(Oc3ccnc(c3)-n3cnc(C)c3)c(C)n2)c(=O)[nH]1
CCn1cc(cn1)-c1cc(Oc2ccc(nc2C)-c2cnc(NC(C)C)[nH]c2=O)ccn1
CNC(=O)c1cc(Oc2ccc(nc2)-c2cnc(NC(C)C)[nH]c2=O)ccn1
CC(C)Nc1ncc(-c2ccc(Oc3ccnc(NC(C)=O)c3)c(C)n2)c(=O)[nH]1
Cc1c(ccc(n1)C2=CN=C(N(C2=O)C)NC(C)C)Oc3ccnc(c3)c4cnn(c4)C
Cc1nc(ccc1Oc1ccnc(c1)-c1cnn(C)c1)-c1cnc(NC2CC2)n(C)c1=O
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)NC(=O)Cc3ccc(F)cc3)cc2F)ccn1
Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)NC(=O)Cc3ccc(F)cc3)nc2)ccn1
Cc1nc(NC(=O)NC(=O)Cc2ccc(F)cc2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1cc(NC(=O)NC(=O)Cc2ccc(F)cc2)ncc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)CC2CCCCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2CCCCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2CCCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2CCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2(C)CC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1c(ccc(n1)NC(=O)NC(=O)C(C)(C)C)Oc2ccnc(c2)c3cnn(c3)C
CC(C)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cnn(C)c2)c(C)n1
CCC(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cnn(C)c2)c(C)n1
CCc1nc(NC(=O)NC(=O)C(C)(C)C)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)CC2CCOCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2CCOCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2(C)CCOCC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Cc1nc(NC(=O)NC(=O)C2CCOC2)ccc1Oc1ccnc(c1)-c1cnn(C)c1
COC1(CC1)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cnn(C)c2)c(C)n1
COC(C)(C)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cnn(C)c2)c(C)n1
COCC(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cnn(C)c2)c(C)n1
COC(C)(C)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2ccc(C)nc2)c(C)n1
COC(C)(C)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2ccnc(C)c2)c(C)n1
COC(C)(C)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cnc(C)s2)c(C)n1
COC(C)(C)C(=O)NC(=O)Nc1ccc(Oc2ccnc(c2)-c2cc(C)no2)c(C)n1
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
CN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2cnc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
CN1CCC(CC1)Nc1ccc(cc1)C(=O)Nc1cc([nH]n1)-c1ccc2ncn(Cc3ccccc3)c2c1
Brc1ccccc1\C=C\c1nc2ccccc2[nH]c1=O
O=c1[nH]c2ccccc2nc1\C=C\c1ccccn1
Cn1c2ccccc2nc(\C=C\c2ccccn2)c1=O
Clc1ccccc1\C=C\c1nc2ccccc2n(Cc2ccccc2)c1=O
COCC1CN(C1)C1CCN(CC1)c1cc(OC)c(Nc2ncc(Br)c(Nc3ccc4OCCOc4c3P(C)(C)=O)n2)cc1C
CONC(=O)c1cc(Nc2ncnn3cc(-c4nnc(o4)C(F)(F)S(C)(=O)=O)c(C(C)C)c23)c(F)cc1F
CONC(=O)c1cc(Nc2ncnn3cc(NC(=O)OCC4CCCO4)c(C(C)C)c23)c(F)cc1F
CONC(=O)c1cc(Nc2ncnn3cc(-c4nnc(o4)C(F)F)c(C(C)C)c23)c(F)cc1F
CONC(=O)c1cc(Nc2ncnn3cc(-c4nnc(C)o4)c(C(C)C)c23)c(F)cc1F
CONC(=O)c1cc(Nc2ncnn3cc(NC(=O)OCCCS(C)(=O)=O)c(C(C)C)c23)c(F)cc1F
Nc1nc(Nc2ccc(COc3cccc(F)c3)cc2)c2c(n1)[nH]c1ccc(O)cc21
Cc1ccc(-c2cn([C@@H]3CC[C@H](N)CC3)c3ncnc(N)c23)c(F)c1 |r,wU:8.7,11.11,(2.17,7.19,;1.77,5.71,;.28,5.31,;-.11,3.82,;.97,2.74,;.58,1.25,;1.48,0,;.58,-1.24,;.97,-2.73,;-.11,-3.82,;.28,-5.31,;1.77,-5.71,;2.17,-7.19,;2.86,-4.62,;2.46,-3.13,;-.89,-.77,;-2.22,-1.54,;-3.56,-.77,;-3.56,.77,;-2.22,1.54,;-2.22,3.08,;-.89,.77,;2.47,3.14,;3.56,2.05,;2.86,4.62,)|
CNC(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
CN(CC1OCCO1)C(=O)c1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CC2)c1
CC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
COC(=O)c1c(OCCN2CCCCC2)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
COC(=O)c1c(OCCN2CCCC2)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
COC(=O)c1c(OCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
CCN(CC)CCOc1c(C(=O)OC)c2c3c(oc2c2ccccc12)C(=O)c1ccccc1C3=O
COC(=O)c1c(OCCCN(C)C)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
Oc1cc(C=C(C#N)C(=N)C(C#N)C#N)cc(O)c1O |w:4.3|
CCCOc1c(C(=O)OC)c2c3c(oc2c2ccccc12)C(=O)c1ccccc1C3=O
COC(=O)c1c(OC)c2ccccc2c2oc3c(C(=O)c4ccccc4C3=O)c12
COc1cc2Cc3c([nH]nc3-c3ccccc3)-c2cc1OC
COc1cc2Cc3c(Nc4cccc(C)c4)[nH]nc3-c2cc1OC
COC(=O)c1cccc(Nc2[nH]nc-3c2Cc2cc(OC)c(OC)cc-32)c1
COc1cc2Cc3c(Nc4ccccc4)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4cccc(F)c4)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4cccc(Br)c4)[nH]nc3-c2cc1OC
COc1ccc2Cc3c(Nc4ccccc4)[nH]nc3-c2c1
COc1cc2Cc3c(Nc4cccc(Cl)c4)[nH]nc3-c2cc1OC
COc1cccc(Nc2[nH]nc-3c2Cc2cc(OC)c(OC)cc-32)c1
COc1cc2Cc3c(Nc4cccc(c4)C(F)(F)F)[nH]nc3-c2cc1OC
COc1cccc-2c1Cc1c(Nc3ccccc3)[nH]nc-21
C1c2ccccc2-c2n[nH]c(Nc3ccccc3)c12
COc1cc2Cc3c(Nc4cccc(c4)C#N)[nH]nc3-c2cc1OC
COc1ccc-2c(Cc3c(Nc4ccccc4)[nH]nc-23)c1
COc1cc2Cc3c(Nc4ccc(Cl)cc4Cl)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4cccc(c4)C(O)=O)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4cc(Cl)cc(Cl)c4)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4ccccc4Cl)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4ccc(Cl)c(Cl)c4)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4cc(Cl)ccc4Cl)[nH]nc3-c2cc1OC
COc1cc2Cc3c(Nc4ccc(Cl)cc4)[nH]nc3-c2cc1OC
COc1ccc2NC(=O)\C(=N\Nc3nnc4SCC(=Nn34)c3ccccc3)c2c1 |c:18|
CCN(CC)CCN1Cc2[nH]c(\C=C3/C(=O)Nc4ccc(I)cc34)c(C)c2C1=O
CCN(CC)CCN1Cc2[nH]c(\C=C3/C(=O)Nc4ccc(Br)cc34)c(C)c2C1=O
Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12
Nc1c(-c2nc3ncccc3[nH]2)c(=O)[nH]c2cnccc12
Nc1c(-c2nc3ccc(cc3[nH]2)N2CCOCC2)c(=O)[nH]c2ccncc12
Nc1c(-c2nc3ccc(cc3[nH]2)N2CCOCC2)c(=O)[nH]c2ccccc12
Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2nc[nH]c12
Nc1c(-c2nc3nc(ccc3[nH]2)N2CCOCC2)c(=O)[nH]c2ccccc12
Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2cnccc12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2ncccc2[nH]c1=O
Cn1ncc2c(N)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c12
CN1CCN(CC1)c1ccc2[nH]c(nc2n1)-c1c(N)c2ccccc2[nH]c1=O
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2ccccc2[nH]c1=O
Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2n[nH]cc12
Oc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12
Oc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ncccc12
Nc1c(-c2nc3ncccc3[nH]2)c(=O)[nH]c2ccccc12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2ccncc2[nH]c1=O
Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12
Oc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2cnccc12
Nc1c(-c2nc3ccc(cc3[nH]2)N2CCOCC2)c(=O)[nH]c2cnccc12
COc1cc2c(cc1OCC1CCN(C)CC1)[nH]cn\c2=N/c1ccc(Br)cc1F
COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4CC4)c(Cl)c3)c2cc1C(N)=O
COC(=O)c1ccc2c(C(Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)c(O)[nH]c2c1
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
C1CCN(CC1)C1CCN(CC1)c1ccc2nc([nH]c2c1)-c1n[nH]c2ccc(Oc3ccccc3)cc12
C1CN(CCO1)c1cccc2[nH]c(nc12)-c1n[nH]c2ccccc12
C(Oc1cccc2c(n[nH]c12)-c1nc2ccc(cc2[nH]1)N1CCC(CC1)N1CCCCC1)c1ccccc1
C(Oc1cccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c12)c1ccccc1
CN(C1CCN(C)CC1)c1ccc2nc([nH]c2c1)-c1n[nH]c2ccccc12
CC(C)(C)NC(=O)Nc1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1
c1ccc2[nH]c(nc2c1)-c1n[nH]c2ccccc12
C1CCN(CC1)C1CCN(CC1)c1ccc2nc([nH]c2c1)-c1n[nH]c2ccccc12
FC(F)(F)c1ccc2c(n[nH]c2c1)-c1nc2ccc(cc2[nH]1)N1CCC(CC1)N1CCCCC1
CC(C)(C)NC(=O)Nc1cccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c12
COC(=O)c1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1
C(Nc1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1)C1CCCCC1
C(Oc1ccc2[nH]nc(-c3nc4ccc(cc4[nH]3)N3CCC(CC3)N3CCCCC3)c2c1)c1ccccc1
C(Oc1ccc2c(n[nH]c2c1)-c1nc2ccc(cc2[nH]1)N1CCC(CC1)N1CCCCC1)c1ccccc1
CN1CCN(Cc2ccc3nc([nH]c3c2)-c2n[nH]c3ccccc23)CC1
C(COc1ccc2nc([nH]c2c1)-c1n[nH]c2ccccc12)CN1CCCC1
CC(C)(C)NC(=O)Nc1cccc2c(n[nH]c12)-c1nc2ccc(cc2[nH]1)N1CCC(CC1)N1CCCCC1
Fc1cccc2c(n[nH]c12)-c1nc2ccc(cc2[nH]1)N1CCC(CC1)N1CCCCC1
Fc1ccc2c(n[nH]c2c1)-c1nc2ccc(cc2[nH]1)N1CCC(CC1)N1CCCCC1
c1cn(cn1)-c1ccc2[nH]c(nc2c1)-c1n[nH]c2ccccc12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1n[nH]c2ccccc12
C1CN(CCO1)c1ccc2nc([nH]c2c1)-c1n[nH]c2ccccc12
CN1CCN(CC1)C(=O)c1ccc(Nc2ncc(C)c(Nc3ccc4cn[nH]c4c3)n2)cc1
COc1cc(ccc1Nc1ncc(C)c(Nc2ccc3cn[nH]c3c2)n1)N1CCC(CC1)N1CCN(C)CC1
Brc1c[nH]c2ccc(Nc3ncnc4ccc(NC(=O)C=C)cc34)cc12
ClCCC(=O)Nc1ccc2ncnc(Nc3ccc4[nH]cc(Br)c4c3)c2c1
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
Cc1cc(cc(c1)OCc2ccc(cc2)CN3CCC[C@@H]3CO)CS(=O)(=O)c4ccccc4
Cc1cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)cc(CS(=O)(=O)c2ccccc2)c1Br |r|
COc1ccc2[nH]c(cc2c1)C(=O)c1cc2ccc(Cl)cc2[nH]1
Cc1cccc2[nH]c(cc12)C(=O)c1cc2cc(O)ccc2[nH]1
Cc1cccc2[nH]c(cc12)C(=O)c1cc2cc(OCCN3CCCCC3)ccc2[nH]1
Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2cc(O)ccc2[nH]1
Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
COc1cccc(F)c1-c1nccc(n1)C(=O)Nc1ccc2n(C)cnc2c1N1CC[C@@H](N)C1 |r|
COc1cccc(F)c1-c1nccc(n1)C(=O)Nc1ccc2sc(C)nc2c1N1CC[C@@H](N)C1 |r|
Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Cc1cc(C(=O)Nc2cc(Oc3ccc4nc(NC(=O)C5CC5)cn4n3)ccc2C)n(C)n1
CNC(=O)c1cccc2cc(Oc3ccnc(NC(=O)c4ccc(cc4)N4CCN(CCO)CC4)c3)ccc12
OC(=O)CCc1c(C=C2C(=O)Nc3ccc(F)cc23)[nH]c2CCCC(=O)c12 |w:7.6|
CN1CCN(Cc2ccc(cc2)C(=O)Nc2cccc(Nc3nccc(n3)-c3cccnc3)c2)CC1
CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1
OCc1cc(Oc2ccc3c(cccc3c2)C(=O)Nc2cccc(c2)C(F)(F)F)ncn1
Nc1nccc(Oc2ccc3c(cccc3c2)C(=O)Nc2cccc(c2)C(F)(F)F)n1
COc1ccncc1NC(=O)c2ccnc(c2)NC(=O)C3CC3
O=C(Nc1cc(ccn1)C(=O)Nc1cnccc1-c1ccccc1)C1CC1
Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1
Clc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:13|
COc1cccc2cc(oc12)C(=O)c1cc2cccc(OC)c2o1
Oc1ccc2oc(cc2c1)C(=O)c1cc2cc(O)ccc2o1
COc1ccc2cc(oc2c1)C(=O)c1cc2ccc(OC)cc2o1
O=C(c1cc2ccccc2[nH]1)c1cc2ccccc2o1
CC(=O)Oc1ccc2oc(cc2c1)C(=O)c1cc2cc(OC(C)=O)ccc2o1
COc1ccc2oc(cc2c1)C(=O)c1cc2cc(OC)ccc2o1
Oc1ccc2[nH]c(cc2c1)C(=O)c1cc2cc(O)ccc2o1
Oc1cccc2cc(oc12)C(=O)c1cc2cccc(O)c2o1
Oc1ccc2cc(oc2c1)C(=O)c1cc2ccc(O)cc2o1
O=C(c1cc2ccccc2o1)c1cc2ccccc2o1
Nc1ccc2oc(cc2c1)C(=O)c1cc2cc(N)ccc2o1
COc1cccc2oc(cc12)C(=O)c1cc2c(OC)cccc2o1
CC(=O)Nc1cc(Oc2ccc(NC(=O)Cc3ccccc3C(F)(F)F)cc2)ncn1
CCN1CCN(CCCOc2cc3nccc(Oc4c(F)cc(NC(=O)NN5C(SCC5=O)c5ccc(F)cc5F)cc4F)c3cc2OC)CC1
CCOc1cc(ccc1Nc1ncc2cc(-c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)c(=O)n(C[C@H]3CCCO3)c2n1)N1CCN(C)CC1 |r|
Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(Nc2ccc(cc2)C#N)n1
Fc1ccc(Nc2nccc(n2)C(=O)Nc2cnccc2-c2ccc(F)cc2)cc1
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cc([nH]n2)-c2ccc(OCCN3CCOCC3)cc2)no1
CC(C)(c1cc(NC(=O)Nc2ccc(cc2)-c2cc([nH]n2)-c2ccc(OCCN3CCOCC3)cc2)no1)C(F)(F)F
Cn1ccc2c(Oc3ccc(NC(=O)Cc4ccc(c(F)c4)C(F)(F)F)cc3)ncnc12
CN1CCN(Cc2ccc(NC(=O)CNc3ccc(cc3F)-c3ccc(NC(=O)C4CC4)nc3)cc2C(F)(F)F)CC1
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/CNc3ccc(F)cc23)c1C
Cc1nc2NC(=O)\C(=C/c3ccc4ccccc4n3)c2c(C)c1O
COc1ccc(cc1)C1=Nn2c(N\N=C3/C(=O)Nc4ccc(F)cc34)nnc2SC1 |t:9|
Cn1cc(cn1)-c1ccc(CNc2cc(ncn2)-c2cnc3cc(OCCCN4CCCC4)ccn23)cc1
CO\N=C\c1c(N)ncnc1N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(Nc1ccc2c(c1)CCN2C(=O)CN1CCOCC1)c1ccccc1
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
COc1cc2nccc(Oc3ccc(NC(=S)NC4CC4)c(Cl)c3F)c2cc1C(N)=O
CNC(=O)c1cc2c(Oc3ccc(NC(=S)NC(=O)Cc4ccccc4)cc3F)ccnc2cc1OC
CN1c2ccc(F)cc2SC1C(=O)Nc1cccc2c1N(Cc1ccc(OC3CCNCC3)cc1)CCC2
COc1ccc(cc1)-c1cc2cc(OC)ccc2nc1Nc1ccc(NC(=O)CN2CCN(C)CC2)cc1
COc1ccc(cc1)-c1cc2ccc(OC)cc2nc1Nc1ccc(NC(=O)CN2CCN(C)CC2)cc1
CCOc1ccc(/C=N/Nc2ccnc3ccc(Br)cc23)cc1
CCCOc1ccc(/C=N/Nc2ccnc3ccc(Br)cc23)cc1
CCCCOc1ccc(/C=N/Nc2ccnc3ccc(Br)cc23)cc1
CCCCOc1ccc(/C=N/Nc2ccnc3ccc(Cl)cc23)cc1
O=C1Nc2ccccc2/C1=C/c1ccc(OCC(=O)c2ccc(Br)cc2)cc1
CNC(=O)c1cccc2cc(Oc3ccnc(NC(=O)c4ccc(cc4)N4C[C@H](C)N[C@H](C)C4)c3)ccc12 |r|
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ccnc2cc1OCC1(N)CC1
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
O=C(Nc1ccc(-c2ccc3c(=O)[nH]cnc3c2)cc1)Nc1ccc(F)c(F)c1
CCN(CC)CCOc1ccc(Nc2cc(NC(=O)Nc3c(Cl)cccc3Cl)ncn2)cc1
C[C@@H](C(F)(F)F)N(Cc1ccc(cc1)F)C(=O)CN2C(=O)[C@]3(CCc4c3ccc(c4)NC(=O)NC)OC2=O
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C
Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F
Cc1[nH]c(/C=C2/C(=O)Nc3ccc(S(=O)(=O)N(C)c4cccc(Cl)c4)cc32)c(C)c1C(=O)N1CCN(C)CC1
[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,)|
COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(s3)C(N)=O)c2cc1OC
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
C=CC(=O)Nc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
C[C@H]1CC(=O)Nc2cc(C(=O)NCCC3CC3)ccc2N1C(=O)N1CC2CC2C1
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)N3CC(C3)([C@@H]4CCCCN4)O
O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CC[C@@H]1CN(C[C@@H]1c1cnc2cnc3[nH]ccc3n12)C(=O)NCC(F)(F)F |r|
COc4cc3c(N2CCN(C(=O)Nc1ccc(OC(C)C)cc1)CC2)ncnc3cc4OCCCN5CCCCC5
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc4ccccc4c3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3cccc4ccccc34)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3Cl)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2ccc3[nH]ccc3c2)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2ccc(Cl)cc2)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2ccc(Cl)cc2F)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccc4ccccc4c3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3cccc4ccccc34)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3Cl)[nH]c2n1
COc1ccc(CCc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)cc1
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1)c1cn(C)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(CC(O)CO)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1cn(COC(C)(C)C)c2ccccc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(CNC1=O)c1c[nH]c2ccccc12 |t:13|
CNc1noc2c(c(C)ccc12)-c1ccc2c(nncc2c1)N1CCOC[C@@H]1C |r|
NC(=O)c1ccc(Nc2cc(n[nH]2)-c2ccc(F)cc2)cc1
NC(=N)SCCCn1c(=O)c2c(n3c(cc4ccccc34)c3cccc4ccn2c34)c1=O
CN=C(N)SCCCn1c(=O)c2c(n3c(cc4ccccc34)c3cccc4ccn2c34)c1=O |w:1.0|
Nc1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1Cl
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)C(=O)NNc2ccccc2)c(C)c1CCC(O)=O
COc1cc(OC)cc(c1)-c1ccc2\C(=C\c3[nH]c(C)c(CCC(O)=O)c3C)C(=O)Nc2c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(ccc2[nH]c1=O)C(=O)NCc1ccccc1
CN1CCCC(C1)Oc1cccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N)c12
CCC1CCN(C)C(C1)Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(Cl)cccc2[nH]c1=O
CN1CCN(CC1)c1cccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N)c12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2ccc(F)cc2[nH]c1=O
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(NCc3ccccc3)ccc2[nH]c1=O
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(C)cccc2[nH]c1=O
O=c1[nH]c2ccccc2c(NCC2CCNCC2)c1-c1nc2ccccc2[nH]1
CN1CCN(CC1)C(=O)c1ccc2nc([nH]c2c1)-c1c(N)c2ccccc2[nH]c1=O
CN(C)CC(=O)N(C)c1ccc2nc([nH]c2c1)-c1c(N)c2ccccc2[nH]c1=O
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(F)ccc2[nH]c1=O
CN1CCN(Cc2ccc3nc([nH]c3c2)-c2c(N)c3ccccc3[nH]c2=O)CC1
CNc1cccc2[nH]c(=O)c(-c3nc4ccc(cc4[nH]3)N3CCN(C)CC3)c(N)c12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(F)c(F)cc2[nH]c1=O
CN(C)[C@H]1CCN(C1)c1ccc2nc([nH]c2c1)-c1c(N)c2ccccc2[nH]c1=O |r|
CN1CCCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2ccccc2[nH]c1=O
Nc1c(-c2nc3ccc(OCCN4CCOCC4)cc3[nH]2)c(=O)[nH]c2ccccc12
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cc(F)cc2[nH]c1=O
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(N)ccc2[nH]c1=O
CN(C)c1ccc2[nH]c(=O)c(-c3nc4ccc(cc4[nH]3)N3CCN(C)CC3)c(N)c2c1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(Cl)ccc2[nH]c1=O
CNc1ccc2c(N)c(-c3nc4ccc(cc4[nH]3)N3CCN(C)CC3)c(=O)[nH]c2c1
Cc1cc2nc([nH]c2cc1C)-c1c(N)c2ccccc2[nH]c1=O
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cccc(F)c2[nH]c1=O
CNc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12
Cc1ccc2nc([nH]c2c1)-c1c(N)c2ccccc2[nH]c1=O
CN(C)c1cc2[nH]c(=O)c(-c3nc4ccc(cc4[nH]3)N3CCN(C)CC3)c(N)c2cc1F
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2cc(NC(=O)c3ccccc3)ccc2[nH]c1=O
O=c1[nH]c2ccccc2cc1-c1nc2ccccc2[nH]1
CN(C)c1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12
CN1CCN(CC1)c1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N)c2c1
Cn1c(nc2ccccc12)-c1c(O)c2ccccc2[nH]c1=O |(24.88,1.17,;24.55,2.67,;23.14,3.29,;23.3,4.82,;24.81,5.15,;25.56,6.48,;27.09,6.49,;27.87,5.16,;27.11,3.82,;25.57,3.82,;21.82,2.52,;20.47,3.3,;20.46,4.84,;19.13,2.51,;17.8,3.28,;16.47,2.5,;16.47,.96,;17.8,.19,;19.14,.96,;20.48,.19,;21.83,.97,;23.16,.2,)|
Cn1c2ccccc2c(O)c(-c2nc3ccccc3[nH]2)c1=O
Cn1c(nc2ccccc12)-c1c(O)c2ccccc2n(C)c1=O |(-1.53,-7.9,;-1.86,-6.39,;-3.27,-5.77,;-3.11,-4.24,;-1.61,-3.91,;-.85,-2.58,;.68,-2.57,;1.46,-3.91,;.69,-5.24,;-.84,-5.24,;-4.59,-6.54,;-5.94,-5.76,;-5.95,-4.22,;-7.28,-6.55,;-8.61,-5.79,;-9.94,-6.56,;-9.94,-8.1,;-8.61,-8.87,;-7.27,-8.1,;-5.93,-8.87,;-5.93,-10.41,;-4.58,-8.09,;-3.25,-8.86,)|
COc1cc2nc(Nc3cc(C)n[nH]3)nc(Nc3cccc(c3)-c3nc4ccccc4s3)c2cc1OC
Oc1ccc(NC(=S)NC(=O)c2ccc(cc2)[N+]([O-])=O)cc1-c1nc2ccccc2s1
N(c1cccc(c1)-c1nc2ccccc2s1)c1ncnc2[nH]ccc12
Cc1cc(Nc2ccnc(Nc3cccc(c3)-c3nc4ccccc4s3)n2)[nH]n1
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OC
Cc1ccc(NC(=O)c2ccc(s2)C(=O)Nc2ccccc2N)cc1Nc1ncc(s1)-c1cccnc1
ONC(=O)\C=C\c1ccc(s1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Nc1ccccc1NC(=O)c1ccc(cn1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
ONC(=O)\C=C\c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Nc1ccccc1NC(=O)c1ccc(s1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
ONC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Cc1ccc(NC(=O)c2ccc(nc2)C(=O)Nc2ccccc2N)cc1Nc1ncc(s1)-c1cccnc1
Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(s2)-c2cccnc2)c1
Nc1ccccc1NC(=O)c1ccc(cc1)C(=O)Nc1cccc(Nc2ncc(cn2)-c2cccnc2)c1
Cc1ccc(NC(=O)c2ccc(cc2)C(=O)NO)cc1Nc1ncc(s1)-c1cccnc1
Cc1ccc(NC(=O)c2ccc(cc2)C(=O)Nc2ccccc2N)cc1Nc1ncc(cn1)-c1cccnc1
Cc1ccc(NCc2ccc(cc2)C(=O)Nc2ccccc2N)cc1Nc1nccc(n1)-c1cccnc1
Cc1ccc(NC(=O)c2ccc(\C=C\C(=O)NO)cc2)cc1Nc1ncc(s1)-c1cccnc1
Cc1ccc(NCc2ccc(\C=C\C(=O)NO)cc2)cc1Nc1nccc(n1)-c1cccnc1
Cc1ccc(NC(=O)c2ccc(s2)C(=O)Nc2ccccc2N)cc1Nc1ncc(cn1)-c1cccnc1
Cc1ccc(NC(=O)c2ccc(\C=C\C(=O)NO)s2)cc1Nc1ncc(s1)-c1cccnc1
CN(C(=O)c1ccc(cc1)C(=O)Nc1ccccc1N)c1cccc(Nc2nccc(n2)-c2cccnc2)c1
Cc1ccc(NC(=O)c2ccc(nc2)C(=O)Nc2ccccc2N)cc1Nc1ncc(cn1)-c1cccnc1
Cc1ccc(NC(=O)c2ccc(cc2)C(=O)Nc2ccccc2N)cc1Nc1ncc(s1)-c1cccnc1
COc1cc2nccc(Nc3cccc(Br)c3)c2cc1OC
COc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1OC
COc1cc2nccc(Oc3cccc(OC)c3OC)c2cc1OC
COc1cc2nccc(Oc3cccc(F)c3)c2cc1OC
COc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1
COc1cc2nccc(Oc3cccc(Br)c3)c2cc1OC
CCc1cccc(Oc2ccnc3cc(OC)c(OC)cc23)c1
COc1cc2nccc(Oc3cccc(c3)[N+]([O-])=O)c2cc1OC
COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC
COc1cc2nccc(Oc3cccc(C)c3)c2cc1OC
COc1cc2nccc(Oc3cccc(N)c3)c2cc1OC
COc1cccc(Oc2ccnc3cc(OC)c(OC)cc23)c1
COc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1OC
COc1ccccc1Oc1ccnc2cc(OC)c(OC)cc12
COc1ccc(Nc2ccnc3cc(OC)c(OC)cc23)cc1OC
COc1cc2nccc(Oc3cccc(O)c3)c2cc1OC
COc1ccc(Nc2ncnc3cc(OC)c(OC)cc23)cc1OC
CCOc1cccc(Oc2ccnc3cc(OC)c(OC)cc23)c1
COc1cc(OC)cc(Oc2ccnc3cc(OC)c(OC)cc23)c1
COc1cc2nccc(Oc3ccccc3)c2cc1OC
COc1cc2nccc(Oc3c(OC)cccc3OC)c2cc1OC
COc1cc2ncnc(Oc3cccc(Br)c3)c2cc1OC
Cc1ccc(o1)-c1ccc2occ(-c3ccc(cc3)[S@](C)=O)c2c1 |r|
CC[S@](=O)c1ccc(cc1)-c1coc2ccc(cc12)-c1ccc(C)o1 |r|
COCCOc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
COc1cc2c(Oc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Oc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCCC1
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3C)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3O)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc(ccc1Nc1ncnc2cc(OC)c(OCCCN3CCN(C)CC3)cc12)-c1nc2ccccc2s1
COc1cc2ncnc(Nc3ccc(cc3F)-c3nc4ccccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(O)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(OC)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(F)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(-c4nc5ccccc5s4)c(Cl)c3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4cc(Cl)ccc4s3)c2cc1OCCCN1CCN(C)CC1
COc1cc2ncnc(Nc3ccc(cc3)-c3nc4cc(ccc4s3)C(F)(F)F)c2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3C)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3O)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc(ccc1Nc1ncnc2cc(OCCCN3CCN(C)CC3)c(OC)cc12)-c1nc2ccccc2s1
COc1cc2c(Nc3ccc(cc3OC(F)(F)F)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3F)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(C)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(O)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(OC)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(F)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(-c4nc5ccccc5s4)c(Cl)c3)ncnc2cc1OCCCN1CCN(C)CC1
COc1ccc2nc(sc2c1)-c1ccc(Nc2ncnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)cc1
COc1cc2c(Nc3ccc(cc3)-c3nc4ccc(F)cc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4ccc(Cl)cc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4cc(Cl)ccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3)-c3nc4cc(ccc4s3)C(F)(F)F)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc2c(Nc3ccc(cc3F)-c3nc4ccc(Cl)cc4s3)ncnc2cc1OCCCN1CCN(C)CC1
COc1cc(ccc1-c1nc2ccccc2s1)N(C)c1ncnc2cc(OCCCN3CCN(C)CC3)c(OC)cc12
COc1cc2c(Oc3ccc(cc3F)-c3nc4ccccc4s3)ncnc2cc1OCCCN1CCN(C)CC1
CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cccc4[nH]c(=O)[nH]c34)c2)n(n1)-c1ccccc1
Fc1c(NC(=O)c2cccc(OC(F)(F)F)c2)cc(Oc2cccc3[nH]c(=O)[nH]c23)c(F)c1F
CC(C)(C)c1cc(NC(=O)c2cccc(Oc3cccc4[nH]c(=O)[nH]c34)c2)n(n1)-c1ccccc1
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccc(I)cc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccc(Br)cc12 |t:13|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccc(F)cc12 |t:13|
CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3ncccc3O)cc2)no1
CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3cc4ccccc4cn3)cc2)no1
CC(C)(C)c1cc(NC(=O)Nc2ccc(NC(=O)c3cn4c(n3)sc3ccccc43)cc2)no1
FC(F)(F)c1cccc(NC(=O)Nc2cccc(c2)-c2cn3ccnc3c(NCc3ccncc3)n2)c1
Cc1ccc(NC(=O)c2ccc(\C=C\C(=O)NO)cc2)cc1Nc1nc(cs1)-c1cccnc1
Brc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
C#Cc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
FC(F)(F)c1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1Br
Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1C(F)(F)F
Fc1cc(Cl)ccc1Nc1ncnc2[nH]c(CCc3ccccc3)cc12
C(Cc1ccccc1)c1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2[nH]1
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
Nc1nc(Nc2ccc(Br)cc2Cl)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
Nc1nc(Nc2ccc(Cl)cc2F)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
Nc1nc(Nc2cccc(F)c2)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
Nc1nc(Nc2cccc(c2)C#C)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
Nc1nc(Nc2ccc(c(F)c2)C(F)(F)F)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1
CC(C)c1ccc(Nc2nc(N)nc3[nH]c(Cc4ccc(Cl)cc4Cl)cc23)cc1
CC(C)c1ccccc1Nc1nc(N)nc2[nH]c(Cc3ccc(Cl)cc3Cl)cc12
Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)nc(N)nc2[nH]1
COc1ccc(OC)c(Cc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)c1
Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)ncnc2[nH]1
COc1ccc(OC)c(Cc2cc3c(Nc4cccc(Br)c4)ncnc3[nH]2)c1
Clc1ccc(Cc2cc3c(Nc4cccc(Br)c4)ncnc3[nH]2)c(Cl)c1
FC(F)(F)c1cccc(Nc2ncnc3[nH]c(Cc4ccc(Cl)cc4Cl)cc23)c1
Clc1ccc(Cc2cc3c(Nc4cccc(c4)C#C)ncnc3[nH]2)c(Cl)c1
CN(C)CCCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:8.7|
CCOC(=O)CCc1c(C=C2C(=O)Nc3ccc(NS(=O)(=O)c4ccccc4)cc23)[nH]c2CCCC(=O)c12 |w:9.8|
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
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|
Cn1ccc2c1c(ncn2)Oc3ccc(c(c3)F)NC(=O)Nc4cccc(c4)C(F)(F)F
Cc1cc(C=C2C(=O)Nc3ccc(F)cc23)c2ccccc(OCCN3CCC[C@H]3CO)c12 |r,w:4.3|
CN(c1ccnc(Nc2cc(cc(c2)N2CCOCC2)N2CCOCC2)n1)c1cccc2[nH]ncc12
CCN(CC)CCN1CCc2[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c(C)c2C1=O
CCN(CC)CCN1CCc2[nH]c(\C=C3/C(=O)Nc4ccc(Cl)cc34)c(C)c2C1=O
CCN(CC)CCN1CCc2[nH]c(\C=C3/C(=O)Nc4ccc(Br)cc34)c(C)c2C1=O
CN(C)CCN1CCc2[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c(C)c2C1=O
Cc1c(\C=C2/C(=O)Nc3ccc(F)cc23)[nH]c2CCN(CCN3CCCC3)C(=O)c12
Cc1c(\C=C2/C(=O)Nc3ccc(F)cc23)[nH]c2CCN(CCN3CCOCC3)C(=O)c12
Cc1c(\C=C2/C(=O)Nc3ccc(F)cc23)[nH]c2CCN(C[C@H](O)CN3CCOCC3)C(=O)c12 |r|
CCN(CC)CCN1CCCc2[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c(C)c2C1=O
Cc1c(\C=C2/C(=O)Nc3ccc(F)cc23)[nH]c2CCCN(CCN3CCOCC3)C(=O)c12
Cc1c(\C=C2/C(=O)Nc3ccc(F)cc23)[nH]c2CCCN(C[C@H](O)CN3CCOCC3)C(=O)c12 |r|
CCN(CC)CCN1CCCCc2[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c(C)c2C1=O
COc1ccc2cc([nH]c2c1)-c1n[nH]c2cccnc12
COc1ccc(CNc2ccnc3oc4ccccc4c23)cc1
ONC(=O)\C=C\c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
ONC(=O)\C=C\c1ccc(s1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
ONC(=O)\C=C\c1cccc(c1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
ONC(=O)\C=C\c1ccc(cc1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1ccccc1NC(=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1ccccc1NC(=O)c1ccc(s1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1ccccc1NC(=O)\C=C\c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1ccccc1NC(=O)\C=C\c1cccc(c1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1ccccc1NC(=O)\C=C\c1ccc(cc1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Nc1ccccc1NC(=O)CCc1ccc(cc1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
ONC(=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
ONC(=O)c1ccc(s1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
COc1cc(O)c2c(c1)C=CCCCC(=O)C=CC[C@H](C)OC2=O |r,w:17.18,10.11|
COc1cc(O)c2c(CCCCCC(=O)C=CC[C@H](C)OC2=O)c1 |r,w:15.14|
COc1cc(O)c2c(c1)C=CCCCC(=O)C=CC[C@H](C)OC2=O |r,w:16.16,9.9|
COc1cc(O)c2c(c1)\C=C\CCCC(=O)C[C@H](Br)C[C@H](C)OC2=O |r,t:10|
COc1cc(O)c2c(CCCC(=O)C(=O)C(=O)CCC[C@H](C)OC2=O)c1 |r|
COc1cc(O)c2c(CCCCCC(=O)C=CC[C@H](C)OC2=O)c1 |r,w:16.16|
c1cc(c(cc1[N+](=O)[O-])Cl)NC(=O)c2cc(ccc2O)Cl
CCOC(=O)c1c2c3cccc4cccc(c2nc1=O)c34
CNC(=O)c1ncc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(CCO)CC3)c(c2)C(F)(F)F)n1C
Fc1ccc(cc1)-n1cccc(C(=O)Nc2ccc(Oc3ncnc4scc(-c5ccccc5)c34)c(F)c2)c1=O
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
[O-][n+]1ccc2c(ccnc2c1-c1c(Cl)cccc1Cl)-c1ccc(F)cc1Cl |(12.75,-22.82,;14.08,-22.05,;14.08,-20.51,;15.41,-19.74,;16.75,-20.5,;18.08,-19.73,;19.42,-20.51,;19.42,-22.05,;18.08,-22.82,;16.74,-22.05,;15.42,-22.83,;15.42,-24.36,;14.08,-25.13,;12.75,-24.36,;14.09,-26.67,;15.42,-27.44,;16.76,-26.66,;16.75,-25.12,;18.08,-24.34,;18.08,-18.2,;19.42,-17.43,;19.42,-15.89,;18.08,-15.12,;18.08,-13.58,;16.75,-15.89,;16.75,-17.43,;15.42,-18.2,)|
CC(C)(CC(=O)NCCn1ccc2c1c(ncn2)Nc3ccc(c(c3)Cl)Oc4cccc(c4)C(F)(F)F)O
CC(C)(C)c1cc(c(s1)NC(=O)Nc2cccc(c2Cl)Cl)C(=O)N3CCC(=O)N(CC3)CCN(C)C
Cc1ccccc1Cc1cc2c(Nc3ccc(Cl)cc3F)nc(N)nc2[nH]1
Cc1ccccc1Cc1cc2c(Nc3ccc(Cl)cc3)nc(N)nc2[nH]1
Nc1nc(Nc2ccc(Cl)cc2F)c2cc(Cc3cccc4ccccc34)[nH]c2n1
Nc1nc(Nc2ccc(Cl)cc2)c2cc(Cc3cccc4ccccc34)[nH]c2n1
COc1ccc(OC)c(Cc2cc3c(Nc4ccc(Cl)cc4F)nc(N)nc3[nH]2)c1
COc1ccc(OC)c(Cc2cc3c(Nc4ccc(Cl)cc4)nc(N)nc3[nH]2)c1
Cc1ncnc(Nc2ccc(OCc3cccc(F)c3)c(Cl)c2)c1C#Cc1ccc(CN2CCCC2)c(F)c1
CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
COc1cc2ncnc(Nc3cnn(CC(=O)Nc4cccc(F)c4)c3)c2cc1OC
COc1cccc(NC(=O)Cn2cc(Nc3ncnc4cc(OC)c(OC)cc34)cn2)c1
COc1cc2ncnc(Nc3cnn(CC(=O)Nc4ccc(cc4)N(C)C)c3)c2cc1OC
COc1cc2ncnc(Nc3cnn(CC(=O)Nc4ccc(cn4)N(C)C)c3)c2cc1OC
COc1cc2ncnc(Oc3cnn(CC(=O)Nc4ccc(cn4)N(C)C)c3)c2cc1OC
COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)c(OC)cc34)cn2)c1
COCCOc1cc2ncnc(Oc3cnn(CC(=O)Nc4cccc(OC)c4)c3)c2cc1OC
COCCOc1cc2c(Oc3cnn(CC(=O)Nc4cccc(OC)c4)c3)ncnc2cc1OC
COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)c(OCCN5CCCCC5)cc34)cn2)c1
COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OCCN5CCCC5)c(OC)cc34)cn2)c1
COc1cccc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)cc(OC)c34)cn2)c1
COc1cccc(NC(=O)Cn2cc(Oc3ccnc4cc(OC)c(cc34)C#N)cn2)c1
COc1cccc(NC(=O)Cn2cc(Oc3ccnc4cc(OC)c(OC)cc34)cn2)c1
CCn1cc(NC(=O)Cn2cc(Oc3ncnc4cc(OC)c(OC)cc34)cn2)cn1
CCn1cc(NC(=O)Cc2cc(Oc3ccnc4cc(OC)c(OC)cc34)[nH]n2)cn1
COc1cc2ncnc(Oc3ccc(CC(=O)Nc4ccc(cn4)N(C)C)cc3)c2cc1OC
COc1cccc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
COc1cccc(NC(=O)Cc2ccc(Nc3ncnc4cc(OC)c(OC)cc34)cc2)c1
COc1cccc(NC(=O)Cc2cccc(Oc3ncnc4cc(OC)c(OC)cc34)c2)c1
COc1cccc(NC(=O)NCc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
COc1cccc(c1)S(=O)(=O)NCc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1
COc1cccc(c1)C(=O)NCc1ccc(Oc2ncnc3cc(OC)c(OC)cc23)cc1
COc1cccc(CNC(=O)c2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
COc1cccc(CC(=O)Nc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
COc1cccc(COc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)c1
CCc1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)[nH]n1
CCn1ccc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)n1
COc1cc2ncnc(Oc3ccc(CC(=O)Nc4cn[nH]c4)cc3)c2cc1OC
COc1cc2ncnc(Oc3ccc(CC(=O)Nc4cnn(C)c4)cc3)c2cc1OC
CCn1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2)cn1
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2)cn1
COc1cc2ncnc(Oc3ccc(CC(=O)Nc4cnn(c4)C(C)C)cc3)c2cc1OC
COc1cc2ncnc(Nc3ccc(CC(=O)Nc4cnn(c4)C(C)C)cc3)c2cc1OC
CN(C)CCCc1cnc(C)c(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
CN(C)CCCc1cncc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
CN(C)CCCc1cc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)ccc1C(F)(F)F
COc1ccc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)cc1CCCN(C)C
CN(C)CCCc1cc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)ccc1F
CC(C)c1ccc(CCCN(C)C)cc1Nc1ncc2CC(=S)Nc3cc(Cl)ccc3-c2n1
CN(C)CCCc1ccc(c(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1)C(F)(F)F
CN(C)CCCc1ccc(OC(F)(F)F)c(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
COc1ccc(CCCN(C)C)cc1Nc1ncc2CC(=S)Nc3cc(Cl)ccc3-c2n1
CN(C)CCCc1ccc(Cl)c(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
CN(C)CCCc1ccc(C)c(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
CN(C)CCCc1cccc(Nc2ncc3CC(=S)Nc4cc(Cl)ccc4-c3n2)c1
COc1ccc2[nH]c3c4[nH]c5ccc(OC)cc5c4c4C(=O)NC(=O)c4c3c2c1
Nc1nc(Nc2ccc(cc2)[C@H]2CC[C@@H](CC2)N2CCOCC2)nn1-c1ccccn1 |r,wU:11.11,wD:14.18,(-9.05,.18,;-7.58,.64,;-7.09,2.1,;-5.55,2.08,;-4.8,3.43,;-3.26,3.44,;-2.48,2.12,;-.94,2.14,;-.18,3.48,;-.98,4.81,;-2.52,4.79,;1.35,3.5,;2.1,4.85,;3.65,4.86,;4.44,3.53,;3.68,2.19,;2.14,2.18,;5.97,3.55,;6.75,2.22,;8.29,2.23,;9.05,3.57,;8.27,4.9,;6.73,4.89,;-5.09,.62,;-6.35,-.28,;-6.36,-1.81,;-5.04,-2.59,;-5.05,-4.13,;-6.39,-4.89,;-7.72,-4.11,;-7.71,-2.57,)|
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc(cc3)-c3ccccc3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc(Cl)c(Cl)c3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc(Cl)cc3)[nH]c2n1
COc1cc(Cc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)cc(OC)c1OC
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccc(Cl)cc3)c2n1
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3)c2n1
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccc(Cl)c(Cl)c3)c2n1
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccc4ccccc4c3)c2n1
Cc1ccccc1Cn1ccc2c(Nc3cccc(Br)c3)nc(N)nc12
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3cccc4ccccc34)c2n1
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccc(cc3)-c3ccccc3)c2n1
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccc(Cl)cc3Cl)c2n1
COc1cc(Cn2ccc3c(Nc4cccc(Br)c4)nc(N)nc23)cc(OC)c1OC
Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3Cl)c2n1
CC(C)n1c2CCCC(=O)c2c2C(=O)c3ccccc3-c12
c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O
COc1cc2c(ncnc2cc1OCCCN1CCCCC1C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCN1CCC(=O)CC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4cccc5NCCc45)cc3)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCCN1CCC(C)CC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OCCOC
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4cccc5ncccc45)cc3)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4cccc5cnccc45)cc3)c2cc1OCCOC
CCS(=O)(=O)CCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4cccc5[nH]ccc45)cc3)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCCO)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCC(N)=N)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCN1CCS(=O)(=O)CC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
CCCCS(=O)(=O)CCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC
COCCOc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccc3[nH]ccc3c2)cc1
CCCS(=O)(=O)CCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC
COc1cc2c(ncnc2cc1OCCn1nccn1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCN1CCNCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCn1cccc1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCn1nccn1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCN1CCS(=O)(=O)CC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc5[nH]ccc5c4)cc3)c2cc1OC
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OCCN1CCOCC1
COc1cc2c(ncnc2cc1OCCCn1ccnn1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCN1CCN(C)CC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCS(=O)(=O)CCC(C)C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC
COc1cc2c(ncnc2cc1OCCCS(=O)(=O)CC(F)(F)F)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COCCOc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1
COc1cc2c(ncnc2cc1OCCn1ccnn1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OC
COCCOc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCN1CCCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCN)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCn1nccn1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCC1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OCCN1CCCCC1
COCCOc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCN1CCCC(F)(F)C1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCn1ncnn1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCn1ccnn1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCn1ccnn1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCN1CCC(C)CC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OCCN1CCCCC1
COc1cc2c(ncnc2cc1OCCCN1CCC(F)(F)CC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCN1CCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCN1CCC(F)(F)CC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCn1nccn1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCn1cnnn1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCCS(=O)(=O)CC(C)C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCn1ccnc1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C#N)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCN1CCCCC1C)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc5ccccc5c4)cc3)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCN1CCSCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCN1CCC(O)CC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(C)cc4)cc3)c2cc1OCCOC
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(Br)cc4)cc3)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccc(cc4)C(C)(C)C)cc3)c2cc1OCCOC
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(Oc4ccccc4)cc3)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COCCOc1cc2c(ncnc2cc1OCCN1CCCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OCCN1CCOCC1
COCCOc1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(cc3)C(C)(C)C)c2cc1OCCOC
COc1cc2c(ncnc2cc1OCCCN(C)C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
COc1cc2c(ncnc2cc1OCCN1CCC2(CC1)OCCO2)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
COc1cc2c(ncnc2cc1OCCCC1=NCCN1C)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1 |t:18|
COc1cc2c(ncnc2cc1OCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C#N
O=C(Nc1cccc(c1)-c1cncc2ccccc12)c1ccccc1NCc1ccncc1
c1ccc(c(c1)C(=O)Nc2cccc(c2)C(F)(F)F)NCc3ccncc3
C[C@@H]1C[C@H]2CN1CCn1[nH]c3c(cccc3c1=O)-c1nc3c(O2)cccc3[nH]c1=O
CCc1ccc(cc1)-c1c(-c2c[nH]c(C)n2)c(=O)[nH]c2ccc(Cl)cc12
CCc1ccc(cc1)-c1c(-c2c[nH]c(C)n2)c(=O)[nH]c2ccc(cc12)C#N
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(cc(C(N)=O)c3=O)-c2ccc3CCCc3c2)cc1
CN1CCN(Cc2ccc(Nc3ncc4c(n3)n(cc(C(N)=O)c4=O)-c3ccc4CCCc4c3)cc2)CC1
Nc1nccn2c(nc(-c3ccc4ccc(nc4c3)-c3ccccc3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |wU:26.30,28.33,(7.04,-25.52,;7.05,-27.06,;5.72,-27.83,;5.72,-29.37,;7.05,-30.15,;8.39,-29.37,;9.86,-29.85,;10.77,-28.6,;9.86,-27.34,;10.64,-26.02,;9.88,-24.69,;10.64,-23.36,;12.19,-23.36,;12.96,-22.02,;14.5,-22.04,;15.28,-23.37,;14.5,-24.71,;12.96,-24.7,;12.18,-26.03,;16.82,-23.38,;17.59,-24.72,;19.13,-24.72,;19.9,-23.38,;19.12,-22.05,;17.59,-22.05,;8.39,-27.82,;10.34,-31.32,;9.65,-32.69,;11.02,-33.38,;11.5,-34.85,;10.47,-35.99,;8.93,-36.07,;9.01,-37.61,;10.55,-37.53,;11.72,-32.01,)|
[O-][N+](=O)c1ccc2[nH]c-3c(CC(=O)Nc4ccc(CCC#N)cc-34)c2c1
c1ccc(cc1)-c1[nH]nc2c3ccccc3oc12
BrC1CCc2[nH]c(\C=C3/C(=O)Nc4ccccc34)cc2C1 |w:1.0|
COc1cc2c(ccnc2cc1OC)Oc3ccc4c(c3)cccc4C(=O)Nc5ccc(cc5)Cl
CC(C)c1c(cn2ncnc(Nc3cnc4[nH]c(C)cc4c3)c12)-c1nnc(C)o1
CC(C)c1c(cn2ncnc(Nc3cnc4[nH]ccc4c3)c12)-c1nnc(C)o1
CN1C(=O)N(Cc2cnc(N)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
CCN(CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)n[nH]3)ncnc2c1)CCOP(O)(O)=O
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F
CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
Cc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1
O=C(Nc1ccccc1)Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
NS(=O)(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCOCC2)cc1
CN(c1cccc(Br)c1)c1nc(N)nc2[nH]c(Cc3ccccc3)cc12
Cn1c(Cc2ccccc2)cc2c(Nc3cccc(Br)c3)nc(N)nc12
CN(c1cccc(Br)c1)c1nc(N)nc2n(C)c(Cc3ccccc3)cc12
CN(c1cccc(Br)c1)c1nc(N)nc2[nH]c(Cc3ccccc3C)cc12
Cc1ccccc1Cc1cc2c(Nc3cccc(Br)c3)nc(N)nc2n1C
CN(c1cccc(Br)c1)c1nc(N)nc2n(C)c(Cc3ccccc3C)cc12
COc1ccc(OC)c(Cc2cc3c(nc(N)nc3[nH]2)N(C)c2cccc(Br)c2)c1
COc1ccc(OC)c(Cc2cc3c(Nc4cccc(Br)c4)nc(N)nc3n2C)c1
COc1ccc(OC)c(Cc2cc3c(nc(N)nc3n2C)N(C)c2cccc(Br)c2)c1
CSc1ccccc1Nc2c3c(c(ncn3)NCC4CC4)nc(n2)N5CCNCC5
Nc1ncc(-c2cnn(CCO)c2)c2scc(-c3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4ccc(OC)cc34)cc2OC)cn1
COc1cc(Oc2ccnc3cc(F)ccc23)ccc1CC(=O)Nc1noc(C)c1C
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1CC(=O)Nc1noc(C)c1C
CCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2OC)[nH]n1
COc1ccc2c(Oc3ccc(CC(=O)Nc4ncc(C)s4)c(OC)c3)ccnc2c1
CCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ccc34)cc2OC)no1
CCc1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ccc34)cc2OC)[nH]n1
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)ccc34)cc2OC)cn1
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cc2OC)cn1
COc1ccc2c(Oc3ccc(CC(=O)Nc4noc(C)c4C)c(OC)c3)ccnc2c1
CCc1cn[nH]c1NC(=O)Cc1ccc(Oc2ccnc3cc(OC)ccc23)cc1OC
CCn1cc(NC(=O)Cc2ncc(Oc3ccnc4cc(OC)ccc34)cc2OC)cn1
CCn1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)cc2OC)cn1
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)cn2)cn1
CCOc1cc2nccc(Oc3cnc(CC(=O)Nc4[nH]nc(CC)c4C)c(OC)c3)c2cc1OC
COc1ccc2c(Oc3ccc(CC(=O)Nc4[nH]nc(C)c4C)c(OC)c3)ccnc2c1
COc1ccc2c(Oc3ccc(CC(=O)Nc4cn(C)nc4C)c(OC)c3)ccnc2c1
CCc1n[nH]c(NC(=O)Cc2ncc(Oc3ccnc4cc(OC)c(OC)cc34)cc2OC)c1C
COc1ccc2nccc(Oc3ccc(CC(=O)Nc4noc(C)c4C)c(OC)c3)c2c1
COc1cc(Oc2ccnc3ccc(F)cc23)ccc1CC(=O)Nc1noc(C)c1C
COc1ccc2c(Oc3ccc(CC(=O)Nc4cnn(C)c4)c(OC)c3)ccnc2c1
COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)nn4C)c(OC)c3)ccnc2c1
COc1ccc2c(Oc3ccc(CC(=O)Nc4cc(C)cc(CN(C)C)c4)c(OC)c3)ccnc2c1
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4cc(F)ccc34)cc2OC)cn1
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1CC(=O)Nc1cn(C)nc1C
CCn1cc(NC(=O)Cc2ccc(Oc3ccnc4ccc(F)cc34)cc2OC)cn1
COc1ccc2c(Oc3ccc(CC(=O)Nc4cnn(C)c4C)c(OC)c3)ccnc2c1
COc1cc2nccc(Oc3ccc(CC(=O)Nc4cn(C)nc4C)cc3)c2cc1OC
COc1ccc2c(Oc3cnc(CC(=O)Nc4cn(C)nc4C)c(OC)c3)ccnc2c1
CCn1cc(NC(=O)Cc2ccc(Oc3ncnc4cc(OC)c(OC)cc34)c(OC)c2)cn1
COc1cc(Oc2ncnc3cc(OC)c(OC)cc23)ccc1CC(=O)Nc1cn(C)nc1C
COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C(F)(F)F)c3)c2cc1OC
FC(F)(F)c1cccc(NC(=O)Nc2cccc(Nc3ccc4\C(=C\c5ccc[nH]5)C(=O)Nc4c3)c2)c1
Cc1cn(cn1)-c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1
CN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)c1
Cc1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1Nc1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1
Nc1ncnc(Nc2ccc(OCc3ccccn3)c(Cl)c2)c1-c1nc(CNC(=O)C=C)co1
CC(C)(N)C(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc5sncc45)c(Cl)c3)c12
Cc1ccc(NC(=O)Nc2nnc(Sc3ncnc4cc(OCCCN5CCOCC5)ccc34)s2)cc1
Nc1nc2cc3ccccc3c2c(Nc2ccc(Cl)cc2F)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(F)c(Cl)c2)[nH]1
COc1cccc(Nc2[nH]c(N)nc3cc4ccccc4c23)c1
Nc1nc2cc3ccccc3c2c(Nc2ccc(cc2)C(F)(F)F)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(Br)cc2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2cccc(Br)c2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(Cl)cc2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2cccc(Cl)c2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2ccc(F)cc2)[nH]1
Nc1nc2cc3ccccc3c2c(Nc2cccc(F)c2)[nH]1
CC(C)c1ccc(Nc2[nH]c(N)nc3cc4ccccc4c23)cc1
CC(C)c1ccccc1Nc1[nH]c(N)nc2cc3ccccc3c12
Nc1nc2cc3ccccc3c2c(Nc2ccccc2)[nH]1
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(CC1)C1CCNCC1
CC(C)(C(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc(Cl)c4)c(Cl)c3)c12)S(C)(=O)=O
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
COc1cc2c(Oc3ccc(Nc4ccc(cc4)C(C)(C)C)cc3)ccnc2cc1OCCNCCO
CCN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
CN1C(C)(C)CC(CC1(C)C)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
CCN1CCC(CC1)Oc1ccc(nc1)C(=O)Nc1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
CC(C)(C#N)Oc1cccc(c1Cl)C(=O)Nc2cc(ccc2F)N(C)c3ccc4c(n3)sc(n4)NC(=O)C5CC5
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(Oc2ccc3nccn3n2)c1
O=C(Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1)[C@H]1CCCN1 |r|
CCN1CCC(CC1)Nc1ccc2NC(=O)C(=C(c3ncc[nH]3)c3ccc(Cl)cc3)c2c1
Cc1cn(cn1)-c1cc(F)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)c1
Cc1cn(cn1)-c1cccc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)c1
Cc1cn(cn1)-c1cc(C)cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)c1
NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O |c:3,t:8|
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(Oc3ccc(CCNC(=O)C(Cc4cc(Br)c(O)c(c4)-c4cc(CC(N=O)C(=O)NCCc5ccc(O)c(Br)c5)cc(Br)c4O)N=O)cc3Br)c2)N=O)cc1Br
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(c2)-c2cc(CC(N=O)C(=O)NCCc3ccc(O)c(Br)c3)cc(Br)c2O)N=O)cc1Br
Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O |w:29.29|
FC(F)(F)c1cc(NC(=O)Nc2ccc(Oc3ncnc4n[nH]cc34)cc2)ccc1Cl
CC(C)(C)C(=O)Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccn3)[nH]c2n1
CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccn3)[nH]c2n1
CC(C)(C)C(=O)Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccn3)[nH]c2n1
Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccn3)[nH]c2n1
Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccn3)[nH]c2n1
Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccn3)[nH]c2n1
Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccn3)[nH]c2n1
CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1
Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1
CC(C)(C)C(=O)Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccn3)[nH]c2n1
Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccn3)[nH]c2n1
Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O
COc1cccc(Nc2nc(NC(=O)C(C)(C)C)nc3[nH]c4cccc(Cl)c4c23)c1
CC(C)(C)C(=O)Nc1nc(Nc2cccc(F)c2)c2c(n1)[nH]c1cccc(Cl)c21
CC(C)(C)C(=O)Nc1nc(Nc2ccc(Cl)cc2F)c2c(n1)[nH]c1cccc(Cl)c21
CC(C)(C)C(=O)Nc1nc(Nc2ccc(Cl)cc2)c2c(n1)[nH]c1cccc(Cl)c21
CC(C)c1ccc(Nc2nc(NC(=O)C(C)(C)C)nc3[nH]c4cccc(Cl)c4c23)cc1
CC(C)(C)C(=O)Nc1nc(Nc2ccccc2)c2c(n1)[nH]c1cccc(Cl)c21
COc1cccc(Nc2nc(N)nc3[nH]c4cccc(Cl)c4c23)c1
Nc1nc(Nc2cccc(F)c2)c2c(n1)[nH]c1cccc(Cl)c21
Nc1nc(Nc2ccc(Cl)cc2F)c2c(n1)[nH]c1cccc(Cl)c21
Nc1nc(Nc2ccc(Cl)cc2)c2c(n1)[nH]c1cccc(Cl)c21
CC(C)c1ccc(Nc2nc(N)nc3[nH]c4cccc(Cl)c4c23)cc1
Nc1nc(Nc2ccccc2)c2c(n1)[nH]c1cccc(Cl)c21
[O-][N+](=O)c1ccccc1-c1n[nH]cc1C=C1C(=O)Nc2ccccc12 |w:14.15|
c1cc(c2ccsc2c1)Oc3ccc(cc3Cl)Nc4c5c(ncn4)NCCC(=C5)C(=O)NCCO
CC(C)n1cc(C(=O)c2cccc(NC(=O)Nc3ccc(Cl)cc3)c2)c2c(N)ncnc12
Nc1ncnc2n(cc(C(=O)c3cccc(NC(=O)Nc4c(F)cccc4F)c3)c12)C1CCCC1
Cc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)sc4c3)c2)n(C)n1
Cc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)sc4n3)c2)n(C)n1
Cc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)cn4c3)c2)n(C)n1
Cc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)nn4c3)c2)n(C)n1
Cc1cc(n(n1)C)C(=O)Nc2cccc(c2)Oc3ccc4nc(cn4n3)NC(=O)C5CC5
Cc1cc(C(=O)Nc2cc(Oc3ccc4nc(NC(=O)C5CC5)nn4c3)ccc2F)n(C)n1
CCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(NCCNCCN(C)C)ccc(C1=O)c23
CCCCCCCCCCCCN1C(=O)c2cccc3c(NCCNCCN(C)C)ccc(C1=O)c23
CCCCCCCCN1C(=O)c2cccc3c(NCCNCCN(C)C)ccc(C1=O)c23
CCCCCCN1C(=O)c2cccc3c(NCCNCCN(C)C)ccc(C1=O)c23
CCCCN1C(=O)c2cccc3c(NCCNCCN(C)C)ccc(C1=O)c23
CCN1C(=O)c2cccc3c(NCCNCCN(C)C)ccc(C1=O)c23
CN(C)CCNCCNc1ccc2C(=O)N(C)C(=O)c3cccc1c23
C1COc2cc3c(Nc4cccc(c4)-c4ccccc4)ncnc3cc2O1
C1Oc2cc3ncnc(Nc4cccc(c4)-c4ccccc4)c3cc2O1
CS(=O)(=O)CCCOc1cccc2n(ccc12)-c1ccnc(N[C@H]2CC[C@@H](CC2)C(=O)N2CCC(O)CC2)n1 |r,wU:23.24,wD:26.31,(28.71,-17.43,;28.01,-18.78,;27.59,-20.26,;29.41,-19.4,;26.53,-18.36,;26.13,-16.88,;24.65,-16.47,;24.27,-14.99,;22.78,-14.58,;21.71,-15.67,;20.2,-15.25,;19.81,-13.8,;20.9,-12.71,;20.81,-11.17,;22.23,-10.62,;23.2,-11.81,;22.38,-13.1,;19.48,-10.41,;19.47,-8.86,;18.15,-8.1,;16.81,-8.87,;16.81,-10.41,;15.47,-11.19,;14.13,-10.42,;12.8,-11.2,;11.46,-10.44,;11.44,-8.89,;12.79,-8.11,;14.12,-8.88,;10.09,-8.13,;10.08,-6.58,;8.76,-8.89,;7.43,-8.12,;6.1,-8.9,;6.1,-10.44,;4.77,-11.21,;7.43,-11.21,;8.76,-10.44,;18.15,-11.18,)|
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)N1CCC[C@H]1CN1CCCC1 |r|
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)N1CCC(CC1)N1CCCCC1
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)N1CCOCC1
CCN(CC)CC(O)CNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(F)cc12
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCCN1CCCC1
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCCN1CCOCC1
CCN(CC)CCCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(F)cc12
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCc1ccccn1
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCO
CN(C)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(F)cc12
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCN1CCCC1
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCN1CCCCC1
Cc1[nH]c2c(CCC\C2=C2\C(=O)Nc3ccc(F)cc23)c1C(=O)NCCN1CCOCC1
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2c1cccc2F
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2cccc(F)c12
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(cc12)S(=O)(=O)N(CC)CC
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(cc12)C(=O)OC
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(cc12)[N+]([O-])=O
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(OC)cc12
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(C)cc12
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(Br)cc12
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(Cl)cc12
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccc(F)cc12
CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC\C2=C1\C(=O)Nc2ccccc12
COc1cc2c(Oc3ccc(NC(=O)c4cc(ccn4)-c4ccc(C)cc4)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
C[C@@H](Sc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(CC2)C2CCC3(CC2)OCCO3)cc1
CC(C)Nc1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)c2cc(on2)c3c(cc(cc3Oc4ccc(cc4)[N+](=O)[O-])O)O
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CCNC[C@@H]3F)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@H]3F)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@@H]3F)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OC3CCNCC3)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CC[C@H](N)CC3)c2n1 |r,wU:26.28,wD:23.24,(30.19,-22.56,;31.74,-22.58,;32.49,-23.91,;34.04,-23.93,;34.79,-25.28,;36.34,-25.29,;37.28,-26.52,;38.79,-26.32,;39.38,-24.91,;40.83,-24.4,;40.8,-22.86,;39.33,-22.41,;38.46,-23.68,;36.93,-23.88,;42.17,-25.17,;42.17,-26.71,;43.51,-27.49,;44.84,-26.71,;46.18,-27.48,;47.52,-26.7,;47.51,-25.15,;46.17,-24.39,;46.16,-22.84,;47.48,-22.08,;48.8,-22.86,;50.13,-22.1,;50.15,-20.57,;51.48,-19.81,;48.82,-19.79,;47.48,-20.55,;44.84,-25.16,;43.5,-24.4,)|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@@H]3O)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCNC[C@H]3O)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CCCNC3)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CCCNC3)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3(F)CCNCC3)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3CCNCC3)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OC3CCN(C)CC3)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC(C)(C)CN)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3CCNC3)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CNC[C@H]3OC)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCCN)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCc3cnc[nH]3)c2n1
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@@H]3CN[C@@H](C3)C(=O)OC)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(O[C@H]3CN[C@@H](C3)C(=O)OC)c2n1 |r|
COCCOc1ccn2c(cnc2c1)-c1ccc2cccc(OCC3CNCCO3)c2n1
Fc1ccc(Nc2ncnc3sc(NC(=O)C=C)cc23)cc1Cl
Fc1ccc(Nc2ncnc3sc(NC(=O)\C=C\CN4CC5CCC4C(=O)C5)cc23)cc1Cl
COc1ccc(Oc2cc(C)c(-c3csc(NC(=O)c4ccnc(F)c4)n3)c(C)c2)cc1
Nc1ncnc2scc(-c3ccc4c(cccc4c3)C(=O)Nc3ccccc3)c12
CN1CCN(CCC(=O)Nc2c(C)[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c2C)CC1
COc1cc2c(Oc3ccc(NC(=O)c4nn(-c5ccccc5C(F)(F)F)c(=O)cc4C)cc3F)ccnc2cc1OCCCN1CCOCC1
Cc1cc2c(Nc3cccc(c3)C#C)nc(C)nc2o1
COc1ccc(cc1)N(C)c1nc(C)nc2oc(C)cc12
COc1ccc(cc1)N(C(C)C)c1nc(C)nc2oc(C)cc12
CCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
Cc1cc2c(Nc3cccc4[nH]ccc34)nc(C)nc2o1
CCCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
CCCCN(c1ccc(OC)cc1)c1nc(C)nc2oc(C)cc12
Cc1cc2c(Nc3ccc(cc3)C(F)(F)F)nc(C)nc2o1
COc1ccc(Nc2nc(C)nc3oc(C)cc23)cc1
CN(C)[C@@H](CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
CCCCCCC(=O)ON[C@H](CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
CCCCC(=O)ON[C@H](CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
CCNC(CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CCC(=O)ON[C@H](CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
CN(C)[C@H](CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
CS(=O)(=O)C[C@@H](N)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
CS(=O)(=O)CC(N)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CN(C)C(CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CS(=O)(=O)CCNC(CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CC(C)NC(CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CNC(CS(C)(=O)=O)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CS(=O)(=O)CC(NC1CCCCC1)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CS(=O)(=O)C[C@H](N)c1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 |r|
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(\F)=C\CN(C)C
COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Cc1cc(\C=N\NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3sccc3n2)cc(C)c1O
CC(C)S(=O)(=O)c1ccccc1Nc1nc(Nc2cccc(NC(=O)CN)c2)ncc1Cl
c1cc2c(c(c1)F)c3nc(nn3c(n2)Cc4ccc5c(c4)OCO5)N
Nc1nc2c3ccc(N)cc3nc(Cc3ccc4OCOc4c3)n2n1
OCCCNc1ccc2c3ncnn3c(nc2c1)-c1ccc2OCOc2c1
c1cc2c(cc1Cc3nc4cc(ccc4c5n3nc(n5)N)NCCO)OCO2
CN1CCN(CC1)c1cc(F)c2c3nc(N)nn3c(Cc3ccc4OCOc4c3)nc2c1
Fc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4ccc[nH]4)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(O)=O)c4C)C(=O)Nc3c2)cc1
COc1ccc(NC(=O)CC(=O)Nc2ccc3\C(=C\c4[nH]c(C)c(C(=O)NCCN5CCCC5)c4C)C(=O)Nc3c2)cc1
CCN(CC)CCCNc1nc(nc2ccsc12)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
CN(c1ccc2occc2c1)c1nc(C)nc2oc(C)cc12
COc1ccc2N(CCc2c1)c1nc(C)nc2oc(C)cc12
COc1ccc2n(ccc2c1)-c1nc(C)nc2oc(C)cc12
COc1ccc2N(CCCc2c1)c1nc(C)nc2oc(C)cc12
CC(C)Oc1ccc(cc1)N(C)c1nc(C)nc2oc(C)cc12
CCOc1ccc(cc1)N(C)c1nc(C)nc2oc(C)cc12
CN(c1ccc2OCCc2c1)c1nc(C)nc2oc(C)cc12
CN(c1ccc2OCOc2c1)c1nc(C)nc2oc(C)cc12
COc1cc(cc(OC)c1OC)N(C)c1nc(C)nc2oc(C)cc12
COc1ccc(cc1OC)N(C)c1nc(C)nc2oc(C)cc12
COc1ccc(N(C)c2nc(C)nc3oc(C)cc23)c(OC)c1
Fc1ccc2ccn(-c3ccc(=O)n(CCOc4ccnc5cc(OCCCN6CCOCC6)ccc45)n3)c2c1
COc1cc(cc(OC)c1OC)-c1cnc2c(snc2c1)N1CCOCC1
N#Cc1ccc(cc1)-c1cnc2ccc(NCc3ccccc3)nn12
OC1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(nn12)N1CCC[C@@H]1c1cccc(F)c1 |r|
OC(=O)CN1CCN(CC1)c1cc(ccn1)-c1cnc2ccc(nn12)N1CCC[C@@H]1c1cccc(F)c1 |r|
Fc1ccc(cc1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
O=c1[nH]cc(nc1-c1ccc2OCOc2c1)-c1c[nH]c2ccccc12
O=c1[nH]cc(nc1-c1ccc(cc1)N1CCOCC1)-c1c[nH]c2ccccc12
COc1ccc(cc1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1ccc(cc1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1ccc(c(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
CCOc1ccc(cc1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1cc(OC)cc(c1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1cc(OC)c(c(OC)c1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12 |(3.15,-16.43,;4.49,-17.21,;5.83,-16.43,;5.83,-14.88,;7.16,-14.12,;7.16,-12.58,;5.83,-11.82,;8.5,-14.88,;8.5,-16.42,;9.83,-17.18,;9.84,-18.71,;7.17,-17.2,;9.83,-14.11,;11.16,-14.87,;12.49,-14.11,;12.49,-12.57,;11.16,-11.79,;9.83,-12.57,;8.49,-11.8,;13.81,-14.88,;13.97,-16.42,;15.48,-16.75,;16.25,-15.41,;17.75,-15.08,;18.23,-13.63,;17.2,-12.49,;15.7,-12.81,;15.22,-14.26,)|
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccccc1
COc1cc(cc(OC)c1OC)-c1nc(-c2c[nH]c3ccccc23)c(C)[nH]c1=O
COc1ccc(c(F)c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
COc1cc(ccc1O)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
COc1cc(cc(OC)c1OC)-c1c[nH]c(=O)c(n1)-c1c[nH]c2ccccc12
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccc(O)cc1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccccc1O
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccccc1Cl
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cccnc1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccc[nH]1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccoc1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccsc1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccc(Cl)cc1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cccc(Cl)c1
COc1ccc(cc1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
COc1cccc(c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1ccc2ccccc2c1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cnc2ccccc2c1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cccc2ccccc12
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccc(C)cc12
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1cn(C)c2ccccc12
CCc1ccc(cc1)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccc(O)cc12
O=c1[nH]cc(nc1-c1c[nH]c2ccccc12)-c1c[nH]c2ccccc12
COC(=O)c1ccc2c(c[nH]c2c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1coc2ccccc12
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2cc(F)ccc12
COc1ccc2c(c[nH]c2c1)-c1c[nH]c(=O)c(n1)-c1cc(OC)c(OC)c(OC)c1
c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F
CN(C)CCCNC(=O)c1csc2nc(cn12)-c1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1
Brc1cccc(NC(=O)Nc2ccc(Nc3ncnc4ccccc34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Nc3ncnc4sccc34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Nc3ncnc4sc5CCCCc5c34)cc2)c1
COc1cc2ncnc(Oc3ccc(NC(=O)Nc4cccc(Br)c4)cc3)c2cc1OC
Brc1cccc(NC(=O)Nc2ccc(Oc3ncnc4ccccc34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Oc3ncnc4sccc34)cc2)c1
Brc1cccc(NC(=O)Nc2ccc(Oc3ncnc4sc5CCCCc5c34)cc2)c1
Cn1c(Nc2cccc(c2)C(C)(C)C)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
Cn1c(Nc2cccc(c2)C(C)(C)C)nc2cc(Oc3ccnc(c3)-c3ncc[nH]3)ccc12
CC(=O)Nc1cc(Oc2ccc3n(C)c(Nc4cccc(c4)C(C)(C)C)nc3c2)ccn1
CNC(=O)c1cc(Oc2ccc3n(C)c(Nc4cccc(c4)C(C)(C)C)nc3c2)ccn1
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
Cn1cc(cn1)-c1cnc(Nc2cccc(Cn3nc(ccc3=O)-c3cnn(C)c3)c2)nc1
COc1cc2c(Oc3ccc(NC(=O)c4c(Cl)c5ccccc5n(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
Fc1ccc(cc1)-n1nnc(C(=O)Nc2ccc(Oc3ccnc4[nH]ccc34)c(F)c2)c1C(F)(F)F
CC(NC(=O)c1ccc2[nH]nc(-c3ccncc3)c2c1)c1cccc(Cl)c1
CC(NC(=O)c1ccc2[nH]nc(-c3ccnc(C)c3)c2c1)c1c(Cl)cncc1Cl
CN1CCN(CC1)c2ccc(c(c2)NC3CCOCC3)C(=O)Nc4c5cc(ccc5[nH]n4)Cc6cc(cc(c6)F)F
CCN1CCN(Cc2ccc(NC(=O)CNc3ccc(cc3)-c3ccc(NC(=O)C4CC4)nc3)cc2C(F)(F)F)CC1
Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1OC1CCN(CC1)C(=O)c1ccncc1
CN1C(=O)COc2c1cnc1ccc(Sc3nnc4c(F)cc(cn34)-c3cnn(C)c3)cc21
CC1(C)c2[nH]c3cc(ccc3c2C(=O)c2ccc(cc12)C1CCN(CC2CCOCC2)CC1)C#N
C[C@@H](Oc1ccc2[nH]nc(-c3nc4cc(ccc4[nH]3)N3CCN(C)CC3)c2c1)c1c(Cl)cncc1Cl |r|
Cn1nccc1-c1ccn2c(cnc2c1)C(=O)Nc1cc(ccc1F)C(=O)NCc1ccc(F)c(F)c1
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2cccnc2)c1
Cn1cc(cn1)-c1ccn2c(cnc2c1)C(=O)Nc1cc(ccc1F)C(=O)NCCN1CCCC1(C)C
Cn1nccc1-c1ccn2c(cnc2c1)C(=O)Nc1cc(ccc1F)C(=O)NCC1CCC(C)(C)O1
CN(CCNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2ccnn2C)c1)C(C)(C)C
Cc1ccc(cc1NC(=O)c1cnn2ccccc12)C(=O)NCc1ccccc1
CN1CCN(CC1)c1ccccc1CNC(=O)c1cnc(C)c(NC(=O)c2cnn3cc(ccc23)-c2ccnn2C)c1
C[C@H]1CCC[C@@H](C)N1CCNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2ccnn2C)c1 |r|
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2cnn(C)c2)c1
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2ccnn2C)c1
Cn1nccc1-c1ccn2c(cnc2c1)C(=O)Nc1cc(ccc1F)C(=O)NCCN1CCCC1(C)C
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccc(F)c(NC(=O)c2cnn3cc(ccc23)-c2ccnn2C)c1
CCN(CCNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2ccnn2C)c1)C(C)(C)C
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccc(F)c(NC(=O)c2cnc3cc(ccn23)-c2cc[nH]n2)c1
CN1CCN(CC1)c1ccccc1CNC(=O)c1ccc(F)c(NC(=O)c2cnc3ccccn23)c1
Cc1ncc(cc1NC(=O)c1cnn2cc(ccc12)-c1cnn(C)c1)C(=O)NCCN1CCCC1(C)C
CCc1cc2C(=O)c3c([nH]c4cc(ccc34)C#N)C(C)(C)c2cc1N1CCN(CC2(O)CCOCC2)CC1
CN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(OC3CCN(CC3)C(=O)c3ccc(C)nc3)c2)CC1
COC(=O)c1ccc2\C(=C(\Nc3ccc(Cn4cccc4CN(C)C)cc3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCNCC3)c3ccccc3)C(=O)Nc2c1
CCN(CC)Cc1cccn1-c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)C(=O)OC)c2ccccc2)cc1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCCCC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCCC3)c3ccccc3)C(=O)Nc2c1
COC(=O)c1ccc2\C(=C(\Nc3ccc(Cn4cccc4CN4CCN(C)CC4)cc3)c3ccccc3)C(=O)Nc2c1
COc1ccc2N(CCc2c1)c1nc(C)nc2c(Cc3ccccc3)c[nH]c12
COc1ccc2N(CCCc2c1)c1nc(C)nc2c(Cc3ccccc3)c[nH]c12
COc1ccc(Nc2nc(C)nc3c(Cc4ccccc4)cn(C)c23)cc1
COc1ccc2N(CCCc2c1)c1nc(C)nc2c(Cc3ccccc3)cn(C)c12
COc1ccc(cc1)N(C)c1nc(N)nc2c(Cc3ccccc3)c[nH]c12
COc1ccc(cc1)N(C)c1nc(C)nc2c(Cc3ccccc3)cn(C)c12
COc1ccc2N(CCCc2c1)c1nc(N)nc2c(Cc3ccccc3)c[nH]c12
CCN(CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C)CCOCCOCCNC(=O)c1cc(OCc2cn(CCCCN3C[C@@H]4C[C@H]3C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N4)nn2)cc(OCc2cn(CCCCN3C[C@@H]4C[C@H]3C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N4)nn2)c1 |r|
Cc1ccc(cc1NC(=O)c2ccc3c(c2)ccc(n3)C)NC(=O)c4ccc5c(c4)OCCO5
Cc1ccc(cc1C#Cc2cnc3n2nccc3)C(=O)Nc4ccc(c(c4)C(F)(F)F)CN5CCN(CC5)C
CN1CCN(Cc2ccc(NC(=O)c3ccc(Cl)c(c3)C#Cc3cncc(c3)N3CCOCC3)cc2C(F)(F)F)CC1
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3ccc4ccccc4c3)c21
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3cccc4ccccc34)c21
COc1ccc(OC)c(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)c1
COc1ccc(Sc2cccc3[nH]c4nc(N)nc(N)c4c23)cc1
Nc1nc(N)c2c(n1)[nH]c1cccc(Sc3ccc(Cl)cc3)c21
FC(F)(F)CNc1nc(Nc2ccc(N3CCOCC3)c(Cl)c2)nc2ccoc12
CC1(C)OCC(=O)Nc2cc(Nc3nc(NCC(F)(F)F)c4occc4n3)ccc12
FC(F)(F)CNc1nc(Nc2ccc3cn[nH]c3c2)nc2ccoc12
Cc1c2ccc(cc2[nH]n1)Nc3nc4ccoc4c(n3)NC5CC5
CCCNC(=O)c1ccc(Nc2nc(NCC(F)(F)F)c3cc[nH]c3n2)cc1
Cc1n[nH]c2nccc(-c3ccc(NC(=O)Nc4ccc(N5CCOCC5)c(C)c4)cc3)c12
Cc1n[nH]c2nccc(-c3ccc(NC(=O)Nc4cccc(C)c4)cc3)c12