1411 SMILES Strings for Lysine-specific demethylase 4C

Compound Name
SMILES String
Brc1cn(Cc2ccccc2)nn1
C(C1CCCc2ccccc12)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
C(C1CCc2ccccc2C1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
C(C1Cc2ccccc2C1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
C(Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1)N1CCCC1
C(Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1)c1cccc2ccccc12
C(c1cccc2ccccc12)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
CC(=O)N(O)CCC(O)=O
CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CC(=O)N1CCCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CC(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CC(=O)Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
CC(=O)Nc1ccc(OCc2cc3nccc(C(O)=O)c3[nH]2)cc1
CC(=O)OCn1nnc(n1)-c1ccnc(c1)-c1cn(Cc2ccccc2Cl)cn1
CC(=O)OCn1nnc(n1)-c1ccnc(c1)-c1ncn(Cc2ccccc2Cl)c1-c1ccc(F)cc1
CC(=O)c1ccccc1-c1cc(ccn1)C(O)=O
CC(C)(C)C(=O)OCn1nnc(n1)-c1ccnc(c1)-c1cn(Cc2ccccc2Cl)cn1
CC(C)(C)C(=O)OCn1nnc(n1)-c1ccnc(c1)-c1ncn(Cc2ccccc2Cl)c1-c1ccc(F)cc1
CC(C)(C)c1ccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
CC(C)(Cn1cnc(c1)-c1cc(ccn1)C(O)=O)c1ccccc1Cl
CC(C)(Nc1cnccc1C(O)=O)c1ccccc1
CC(C)(O)c1cc2nccc(C(O)=O)c2[nH]1
CC(C)(c1cc(O)n(n1)-c1cc(ccn1)C(O)=O)c1ccc(Cl)cc1
CC(C)C#Cc1ccc2C(CNc3cnccc3C(O)=O)CCOc2c1
CC(C)C(=O)NC(c1ccco1)c1ccc2cccnc2c1O
CC(C)C(O)c1cc2nccc(C(O)=O)c2[nH]1
CC(C)C(c1ccccc1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
CC(C)C(c1ccccc1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
CC(C)C(c1ccccc1)n1cnc(c1)-c1cc(ccn1)C(O)=O
CC(C)CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
CC(C)CCCCCC(=O)N(O)CCC(O)=O
CC(C)CCCCCCCCC(=O)N(O)CCC(O)=O
CC(C)CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)C
CC(C)CNc1cnccc1C(O)=O
CC(C)COc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CC(C)COc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)COc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
CC(C)Cc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)Cn1nc(Nc2cnccc2C(=O)NC#N)c2cc(F)ccc12
CC(C)Cn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CC(C)N(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)C
CC(C)N1CCN(CC1)c1cccc(c1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)Oc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CC(C)Oc1ccc(CNc2cnccc2C(O)=O)cc1
CC(C)Oc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)Oc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CC(C)Oc1ccc2C(CNc3cnccc3C(O)=O)CCCc2c1
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)[C@@H](C)O)[C@@H](C)O)C(N)=O |r|
CC(C)c1c([nH]c2c(cnn2c1=O)C#N)-c1ccccc1
CC(C)c1c([nH]c2c(cnn2c1=O)C#N)-c1cnn(c1)C(C)(C)C
CC(C)c1cc([nH]n1)C(=O)N1CCC(C1)c1cc(cc(C)n1)-c1cnn(C)c1
CC(C)c1cc([nH]n1)C(=O)N1CC[C@H](C1)NC(=O)C1CC1 |r|
CC(C)c1ccc(Nc2ccc(Oc3nc(O)c4ccncc4n3)cc2)cc1
CC(C)c1ccc(Oc2nc3cnccc3c(=O)[nH]2)cn1
CC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C
CC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C(F)(F)F
CC(C)c1ccc(cc1)N(C)c1ccc2C(CNc3cnccc3C(O)=O)NCCc2c1
CC(C)c1ccc(cc1)N(C)c1ccc2C(CNc3cnccc3C(O)=O)NCc2c1
CC(C)c1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CC(C)c1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCc2c1 |r|
CC(C)c1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CC(C)c1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CC(C)c1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)NCc2c1 |r|
CC(C)c1ccc(cc1)N(C1CCCC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C1CCCN(C)C1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C1CCCNC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C1CCN(C)C1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C1CCN(C)CC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C1CCNC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(C1CCOCC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1)N(CC(F)(F)F)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cc1N1CCOCC1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(cn1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(nc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccc(nc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CC(C)c1cccc(c1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(C)c1ccccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CC(C)c1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CC(C)n1cc(Oc2nc3cnccc3c(=O)[nH]2)cn1
CC(C1CC1)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(CC#N)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(CCN(C)C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(CCN)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(CN)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CC(Cc1ccccc1)n1cnc(c1)-c1cc(ccn1)C(O)=O
CC(Cn1cnc(c1)-c1cc(ccn1)C(O)=O)N1CCCC1
CC(Nc1cnccc1C(O)=O)c1ccccc1
CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1
CC(O)Cn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CC(O)c1cc2nccc(C(O)=O)c2[nH]1
CC(Oc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O)c1ccccc1
CC(Oc1cc(F)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O)c1ccccc1
CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
CC(Oc1ccnn1-c1cc(ccn1)C(O)=O)c1ccc(F)cc1
CC(c1cc(O)n(n1)-c1cc(ccn1)-c1nn[nH]n1)c1ccccc1
CC(c1cc(O)n(n1)-c1cc(ccn1)C(O)=O)c1ccccc1
CC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
CC(c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1)C(F)(F)F
CC(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CC(c1ccccc1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
CC(c1ccccc1)n1cnc(c1)-c1cc(ccn1)C(O)=O
CC(c1ccccc1Cl)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
CC1(C)CCC(CNc2cnccc2C(O)=O)c2ccccc12
CC1(C)CCCN1C(=O)c1cc2nccc(C(O)=O)c2[nH]1
CC1(C)CCN(CC1)C(=O)c1cc2nccc(C(O)=O)c2[nH]1
CC1(C)Cc2cccc(COc3ccnn3-c3cc(ccn3)C(O)=O)c2O1
CC1(CNc2cnccc2C(O)=O)CCCc2ccccc12
CCC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCC(=O)N1CCC(CC1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCC(=O)N1CCCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCC(C)Oc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CCC(C)n1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CCC(O)c1cc2nccc(C(=O)OC)c2[nH]1
CCC(O)c1cc2nccc(C(O)=O)c2[nH]1
CCC(c1ccccc1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
CCC(c1ccccc1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
CCC(c1ccccc1)n1cnc(c1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CCC(CC1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CCCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
CCCCCCCCCC(=O)N(O)CCC(O)=O
CCCCCCCCN(CCCC)CCCCC(=O)N(O)CCC(O)=O
CCCCCCCCOC(=O)c1ccc(O)c2ncccc12
CCCCCCN(C)CCCCC(=O)N(O)CCC(O)=O
CCCCCCN(CCCC)CCCCC(=O)N(O)CCC(O)=O
CCCCCN(C)CCCCC(=O)N(O)CCC(O)=O
CCCCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CCCCN(C)CCC(=O)N(O)CCC(O)=O
CCCCN(C)CCCC(=O)N(O)CCC(O)=O
CCCCN(C)CCCCC(=O)N(O)CCC(O)=O
CCCCN(C)CCCCCC(=O)N(O)CCC(O)=O
CCCCN(C)CCCCCCC(=O)N(O)CCC(O)=O
CCCCN(C)CCCCCCCCC(=O)N(O)CCC(O)=O
CCCCN(CC)CCCCC(=O)N(O)CCC(O)=O
CCCCN(CCCC)CCCCC(=O)N(O)CCC(O)=O
CCCCNc1cnccc1C(O)=O
CCCCOc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CCCCOc1cc(F)ccc1-c1c(ncn1C)-c1cc(ccn1)-c1nn[nH]n1 |(5.19,6.16,;3.85,5.39,;3.85,3.85,;2.52,3.08,;2.52,1.54,;1.18,.77,;-.15,1.54,;-1.48,.77,;-2.82,1.54,;-1.48,-.77,;-.15,-1.54,;1.18,-.77,;2.52,-1.54,;2.52,-3.08,;3.98,-3.56,;4.89,-2.31,;3.98,-1.06,;4.75,.27,;1.18,-3.85,;-.15,-3.08,;-1.48,-3.85,;-1.48,-5.39,;-.15,-6.16,;1.18,-5.39,;-2.82,-3.08,;-2.82,-1.54,;-4.28,-1.06,;-5.19,-2.31,;-4.28,-3.56,)|
CCCCc1ccn(n1)-c1cc(ccn1)C(O)=O
CCCCc1ccnn1-c1cc(ccn1)C(O)=O
CCCN(C)CCCCC(=O)N(O)CCC(O)=O
CCCN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)C
CCCNC(=O)NC(C)(C)C(O)=O
CCCNc1cnccc1C(O)=O
CCCOC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1Cl
CCCOc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CCCOc1ccc2C(CNc3cnccc3C(O)=O)CCCc2c1
CCCc1cc(O)n(n1)-c1cc(ccn1)C(O)=O
CCCc1cc2nccc(C(O)=O)c2[nH]1
CCCc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCCc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C
CCCc1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CCCc1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CCCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CCCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CCCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CCCc1nc2cnccc2c(=O)[nH]1
CCCn1cc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CCCn1cnc(c1)-c1cc(ccn1)C(O)=O
CCCn1cnc(c1-c1ccc(Cl)c(F)c1)-c1cc(ccn1)C(O)=O
CCCn1nc(Nc2cnccc2C(O)=O)c2cc(C)ccc12
CCCn1nc(Nc2cnccc2C(O)=O)c2cc(Cl)ccc12
CCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CCCn1nc(Nc2cnccc2C(O)=O)c2cc(ccc12)C#N
CCCn1nc(Nc2cnccc2C(O)=O)c2cccc(C)c12
CCCn1nc(Nc2cnccc2C(O)=O)c2cccc(F)c12
CCCn1nc(Nc2cnccc2C(O)=O)c2ccccc12
CCN(C)CCCCC(=O)N(O)CCC(O)=O
CCN(CC)CCCCNCc1cc(C=O)ccn1
CCN(CCN(C)C)C(=O)CNCc1cc(CNC(=O)C(F)(F)F)ccn1
CCN(CCN(C)C)C(=O)CNCc1cc(ccn1)C(=O)OC
CCN(CCN(C)C)C(=O)CNCc1cc(ccn1)C(N)=O
CCN(CCN(C)C)C(=O)CNCc1cc(ccn1)C(O)=O
CCN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1ccc(F)cc1
CCN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)C
CCN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCN(C)CC1
CCN(c1ccccc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCN(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CCN(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CCN1CCC(CNCc2cc(ccn2)C(O)=O)C1=O
CCN1CCN(CC1)c1cccc(c1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCNC(=S)Nc1ccc(O)c(c1)C(O)=O
CCNc1nc2cnccc2c(=O)[nH]1
CCOC(=O)N1CCC(CC1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCOC(=O)c1[nH]nnc1C
CCOC(=O)c1ccnc(CNCC(=O)N(CC)CCN(C)C)c1
CCOC(=O)c1nnn(c1NC(C)=O)-c1ccccc1
CCOc1cc(Cl)ccc1-c1c(ncn1C)-c1cc(ccn1)C(O)=O |(3.48,5,;2.15,4.23,;2.15,2.69,;.82,1.93,;-.52,2.69,;-1.85,1.93,;-3.19,2.69,;-1.85,.38,;-.52,-.38,;.82,.38,;2.15,-.38,;2.15,-1.93,;3.61,-2.4,;4.52,-1.15,;3.61,.09,;4.38,1.42,;.82,-2.69,;-.52,-1.93,;-1.85,-2.69,;-1.85,-4.23,;-.52,-5,;.82,-4.23,;-3.19,-1.93,;-3.19,-.38,;-4.52,-2.69,)|
CCOc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CCOc1ccc(cc1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
CCOc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CCOc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CCOc1ccc(cc1N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C)N1CCN(C)CC1
CCOc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
CCOc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
CCOc1nc2cnccc2c(=O)[nH]1
CCS(=O)(=O)N1CC[C@@H](C1)n1cc(Oc2nc(O)c3ccncc3n2)cn1 |r|
CCSc1nc2cnccc2c(=O)[nH]1
CC[C@@H](C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1 |r|
CC[C@H](C)[C@@H]1NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC1=O)C(C)C)C(N)=O)[C@@H](C)O |r|
CC[C@H](C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1 |r|
CCc1c(C)nc2c(cnn2c1OC)C#N
CCc1cc(-c2ccc(C)cc2)n(n1)-c1cc(ccn1)C(O)=O
CCc1cc(C)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CCc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CCc1cc(F)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
CCc1cc(ccc1COc1ccnn1-c1cc(ccn1)C(O)=O)C#N
CCc1ccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
CCc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(Cl)c1
CCc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(F)c1
CCc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1
CCc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1Cl
CCc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1F
CCc1ccc(cc1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
CCc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C
CCc1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CCc1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CCc1ccc(cc1)N(C)c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CCc1ccc(cc1N1CCN(C)CC1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCc1ccc(cc1N1CCOCC1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCc1ccc(cc1OC)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C
CCc1ccc(cc1OCCN(C)C)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCc1ccc(cc1OCCOC)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCc1ccc(nc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CCc1ccc(nc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CCc1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CCc1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CCc1ccccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CCc1ccccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CCc1ccccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CCc1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CCc1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CCc1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CCc1ccccc1CNCCn1cnc(c1)-c1cc(ccn1)C(O)=O
CCc1cnn(c1OCc1ccc(F)cc1)-c1cc(ccn1)C(O)=O
CCn1nc(-c2cc3nccc(C(O)=O)c3[nH]2)c2ccc(Cl)cc12
CCn1nc(Nc2cnccc2C(O)=O)c2cc(C)ccc12
CCn1nc2cc(Cl)ccc2c1-c1cc2nccc(C(O)=O)c2[nH]1
CN(C(=O)Cc1ccccc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(C)C(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
CN(C)CC#CCn1nc(Nc2cnccc2C(O)=O)c2cc(Cl)ccc12
CN(C)CCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCCCCCCCN(O)C(=O)CCC(O)=O
CN(C)CCCCCCNC(=O)c1cccc(c1)-c1cc(O)c2ncccc2c1
CN(C)CCCCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CN(C)CCCCn1nc(Nc2cnccc2C(=O)NC#N)c2cc(F)ccc12
CN(C)CCCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CN(C)CCCn1cnc(c1)-c1cc(ccn1)C(O)=O
CN(C)CCNC(=O)c1ccc2c(C(O)=O)c3ccccn3c2c1
CN(C)CCOCCn1cnc(c1)-c1cc(ccn1)C(O)=O
CN(C)CCOCCn1nc(Nc2cnccc2C(O)=O)c2cc(Cl)ccc12
CN(C)CCOCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
CN(C)CCOCCn1nc(Nc2cnccc2C(O)=O)c2ccccc12
CN(C)CCc1cnn(c1OCc1ccc(F)cc1)-c1cc(ccn1)C(O)=O
CN(C)CCn1cnc(c1)-c1cc(ccn1)C(O)=O
CN(C)CCn1cnc(c1-c1ccc(Cl)c(F)c1)-c1cc(ccn1)C(O)=O
CN(C)C[C@H]1C2CCC(C2)([C@H]1O)c1ccccc1 |r|
CN(C)Cc1ccccc1CNc1cnccc1C(O)=O
CN(C)NC(=O)CCC(O)=O
CN(C)c1ccc(cc1)-c1ccnn1-c1cc(ccn1)C(O)=O
CN(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(C)c1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(C)c1cccc(c1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(C)c1ccccc1-c1nn(C)c2nc(=O)n(C)c(=O)c2n1
CN(C1CCCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(C1CCN(C)CC1)c1cccc(c1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(C1CCOCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(CC1CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(CC1CCCc2ccccc12)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(CC1CCc2ccccc12)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(CCCCCCCCC(=O)N(O)CCC(O)=O)Cc1ccccc1
CN(CCc1ccccc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(CCc1cnn(c1)-c1cc(ccn1)C(=O)NC#N)Cc1ccc(F)cc1
CN(CCc1cnn(c1)-c1cc(ccn1)C(O)=O)Cc1ccc(F)cc1
CN(CCn1cnc(c1)-c1cc(ccn1)C(=O)NC#N)CC1CC1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)CC1CC1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1ccc(C)cc1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1ccc(F)cc1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1ccc(cc1)C(F)(F)F
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1cccc(C)c1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1cccc(F)c1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)Cc1ccccc1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)c1ccc(Cl)cc1
CN(CCn1cnc(c1)-c1cc(ccn1)C(O)=O)c1ccccc1
CN(Cc1ccc2CCCc2c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(Cc1ccc2COCc2c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(Cc1ccccc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(Cc1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(Cc1ccccc1)c1cccc(Oc2nc(O)c3ccncc3n2)c1
CN(c1c(C)noc1C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1cc(C)on1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(C)c(C)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(C)c(F)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(C)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(C)cc1)c1ccc2C(CNc3cnccc3C(O)=O)NCCc2c1
CN(c1ccc(C)cc1)c1ccc2C(CNc3cnccc3C(O)=O)NCc2c1
CN(c1ccc(C)cc1)c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)CCc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)N(C)Cc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
CN(c1ccc(C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)NCc2c1 |r|
CN(c1ccc(C=C)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(CC(F)(F)F)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(CC(F)(F)F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(CC2CC2)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(CC2CC2)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(CCO)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(CO)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(Cl)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(Cl)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(Cl)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(O)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(OC(F)(F)F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(OC(F)(F)F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(OC(F)F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(OC(F)F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(OC2CC2)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(OCC(C)(C)C)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(OCC(F)(F)F)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(OCC(F)(F)F)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(OCC2CC2)cc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccc(OCC2CC2)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(OCC2CC2)cc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cc(C)cc(c1)N1CCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(C)c(C)c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(C)c(F)c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(C)c(c1)N1CCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(C)c(c1)N1CCOCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(C)cn1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(OC(F)(F)F)cc1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(OCC(F)(F)F)c(c1)N1CCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C#N
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)(C)C
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)(C)CO
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)(C)O
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(F)(F)F
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C1(CC1)C(F)(F)F
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C1=CCOCC1 |t:30|
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C1CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C1CCOCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)N1CCC(N)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)N1CCCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)N1CCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)N1CCOCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)S(C)(=O)=O
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc2c(OCC2(C)C)c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc2nn(C)cc2c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(C)c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(CN2CCN(C)CC2)c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(Cl)c1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)C#N
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)C(F)(F)F
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)C1=CCN(C)CC1 |t:30|
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)C1CCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCC(N)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCCC(N)C1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCN(C)C(=O)C1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCN(C)CC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)N1CCOCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cccc(c1)S(C)(=O)=O
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccccc1F
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccccn1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccnc(c1)N1CCOCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1cncc(c1)N1CCOCC1
CN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1C)c1cc(ccc1C)N1CCN(C)CC1
CN(c1ccc(cc1)-n1cccn1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)-n1cccn1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)-n1ccnc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)-n1ccnc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C#C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C#N)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)C#N)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C(=O)C1CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C(C)(C)C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C
CN(c1ccc(cc1)C(F)(F)F)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C1=CCN(C)CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r,t:9|
CN(c1ccc(cc1)C1=CCOCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r,t:9|
CN(c1ccc(cc1)C1=CCOCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r,t:9|
CN(c1ccc(cc1)C1CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)C1CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C1CCN(C)CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)C1CCOCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)C1CCOCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)N1CC(F)(F)C1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)N1CC(F)(F)C1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)N1CC(O)C1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)N1CCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)N1CCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)N1CCCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc(cc1)N1CCCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc(cc1)N1CCOCC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccc2COCc2c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ccc(C)cn1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ccc2ccoc2c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ccc2occc2c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1cccc(C)n1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ccccc1F |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ccccn1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ccn(C)c(=O)c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1)c1ncc(C)cn1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1cc(F)cc(F)c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccc(C)cn1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccc(Cl)cn1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccc(F)cc1F |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccc(cn1)C1CC1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccc2ccoc2c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccc2occc2c1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1cccc(C)n1 |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccccc1C |r|
CN(c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1)c1ccccc1F |r|
CN(c1cccc(C)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1cccc(C)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1cccc(Cl)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1cccc(F)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1cccc(F)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1cccc(c1)C#N)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1cccc(c1)C#N)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1cccc(c1)N1CCN(C)CC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C
CN(c1cccc(c1)N1CCN(C)CC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C(F)(F)F
CN(c1ccccc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN(c1ccccc1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1F
CN(c1ccccc1)c1ccc2C(CNc3cnccc3C(O)=O)CCCc2n1
CN(c1ccccc1)c1ccc2C(CNc3cnccc3C(O)=O)OCCc2c1
CN(c1ccccc1)c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN(c1ccccc1)c1ccc2[C@H](CNc3nnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccccc1)c1ccc2c(-c3cc4nccc(C(O)=O)c4[nH]3)n(C)nc2c1
CN(c1ccccc1)c1cccc(Oc2nc(O)c3ccncc3n2)c1
CN(c1ccccc1)c1cccc2c(-c3cc4nccc(C(O)=O)c4[nH]3)n(C)nc12
CN(c1cccnc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1cccs1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccn(C)n1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1ccncc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1cnn(C)c1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN(c1csc(C)n1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
CN1CCC(CC1)n1cnc(c1)-c1cc(ccn1)C(O)=O
CN1CCC(CCn2nc(Nc3cnccc3C(O)=O)c3cc(F)ccc23)CC1
CN1CCC(CNc2cnccc2C(O)=O)c2ccccc12
CN1CCC(Cn2cnc(c2)-c2cc(ccn2)C(O)=O)CC1
CN1CCCC(Cn2cnc(c2)-c2cc(ccn2)C(O)=O)C1
CN1CCN(CC1)C(=O)c1ccn(CC(O)=O)n1
CN1CCN(CC1)c1cccc(c1)N(CC1CC1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CN1CCOC(CCn2nc(Nc3cnccc3C(O)=O)c3cc(F)ccc23)C1
CN1CCOC(Cn2cnc(c2)-c2cc(ccn2)C(O)=O)C1
CN1CCc2cc(ccc2[C@@H]1CNc1cnccc1C(O)=O)-c1c(C)cccc1C |r|
CN1CCc2cc(ccc2[C@@H]1CNc1cnccc1C(O)=O)-c1ccccc1C |r|
CN1CCc2cc(ccc2[C@H]1CNc1cnccc1C(O)=O)-c1c(C)cccc1C |r|
CN1CCc2cc(ccc2[C@H]1CNc1cnccc1C(O)=O)-c1ccccc1C |r|
CN1CN(Cc2ccccc2)CC1=S
CN1Cc2cc(ccc2[C@@H]1CNc1cnccc1C(O)=O)-c1ccccc1C |r|
CN1Cc2cc(ccc2[C@H]1CNc1cnccc1C(O)=O)-c1ccccc1C |r|
CN1NN(O)C(Br)=C1 |c:6|
CNC(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
CNC(=O)c1cccc(c1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
CNC(=O)c1n[nH]n(C)c1=O
CNCC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CNCCC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
CNCCCCCCCCC(=O)N(O)CCC(O)=O
CNCCCCCn1nc(Nc2cnccc2C(O)=O)c2cc(Cl)ccc12
CNc1cnccc1C(O)=O
COC(=O)CCN(O)C(=O)CCCCCCCCC(C)C
COC(=O)Cc1cc(O)n(n1)-c1nc2ccccc2[nH]1
COC(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
COC(=O)c1ccnc(c1)-c1cc(ccn1)C(O)=O
COC(=O)c1ccnc2cc(CO)[nH]c12
COC(=O)c1ccnc2cc(Cc3ccccc3)[nH]c12
COC(=O)c1ccnc2cc([nH]c12)-c1ccc(OC)cc1C
COC(=O)c1ccnc2cc([nH]c12)C(C)(C)O
COC(=O)c1ccnc2cc([nH]c12)C(C)O
COC(=O)c1ccnc2cc([nH]c12)C(O)c1cccc(C)c1
COC(=O)c1ccnc2cc([nH]c12)C1(O)CCCCC1
COC(=O)c1ccnc2cc([nH]c12)C1CC1
COC(=O)c1ccnc2cc([nH]c12)C1CCCC1
COC(=O)c1n[nH]c(C(=O)OC)c1O
COC(=O)c1n[nH]n(Cc2ccccc2)c1=O
COC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COCC(=O)Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
COCC(=O)Nc1ccc(O)c(c1)C(O)=O
COCC(C)(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COCC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COCC1(CC1)c1ccc(cc1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
COCCCn1cnc(c1-c1ccc(Cl)c(F)c1)-c1cc(ccn1)C(O)=O
COCCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
COCCN(C)CC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COCCN(c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccc(cc1)C(C)C
COCCN(c1ccc(cc1)C1CC1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COCCNCC(C)c1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COCCOc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
COCCOc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COCCn1cnc(c1-c1ccc(Cl)c(F)c1)-c1cc(ccn1)C(O)=O
COCCn1nc(Nc2cnccc2C(O)=O)c2ccccc12
COCc1cc(O)n(n1)-c1cc(ccn1)C(O)=O
COCc1cc2nccc(C(O)=O)c2[nH]1
COCc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CONC(=O)c1ccc2c(C(=O)OCCN(C)C)c3ccccn3c2c1
CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,23,t:15,21,34|
CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,25,t:17,23,36|
CO[C@H]1C[C@H](C)CC2=C(OC)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,21,t:13,19,32|
COc1c(nnn1C)-c1ccccc1
COc1cc(Br)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
COc1cc(C)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
COc1cc(C)nn1-c1cc(ccn1)C(O)=O
COc1cc(COc2cc3nccc(C(O)=O)c3[nH]2)ccc1Cl
COc1cc(Cc2cc3nccc(C(O)=O)c3[nH]2)ccc1Cl
COc1cc(Cl)ccc1CNc1cnccc1C(O)=O
COc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
COc1cc(F)ccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
COc1cc(I)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
COc1cc(ccc1C)-c1ccnn1-c1cc(ccn1)C(O)=O
COc1cc(ccc1Cl)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
COc1cc(ccc1Cl)-c1ccnn1-c1cc(ccn1)C(O)=O
COc1cc(ccc1F)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1cc(ccc1F)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
COc1cc2CCCC(CNc3cnccc3C(O)=O)c2c(OC)c1
COc1cc2CCCC(CNc3cnccc3C(O)=O)c2cc1C
COc1cc2CCC[C@@H](CNc3cnccc3C(O)=O)c2cc1F |r|
COc1cc2CCC[C@H](CNc3cnccc3C(O)=O)c2cc1F |r|
COc1ccc(-c2cc3nccc(C(O)=O)c3[nH]2)c(C)c1
COc1ccc(CC(=O)Nc2ccc(O)c(c2)-c2cc(ccn2)C(O)=O)cc1
COc1ccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
COc1ccc(CCn2cnc(c2)-c2cc(ccn2)C(O)=O)cc1
COc1ccc(CNc2cnccc2C(O)=O)c(OC)c1
COc1ccc(CNc2cnccc2C(O)=O)cc1
COc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1
COc1ccc(Cc2cc3nccc(C(O)=O)c3[nH]2)cc1
COc1ccc(Cl)c(c1)-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
COc1ccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
COc1ccc(Cn2nnc(C(O)=O)c2N)cc1
COc1ccc(F)cc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
COc1ccc(N(C)c2ccc(Oc3nc(O)c4ccncc4n3)cc2)c(OC)c1
COc1ccc(N)cc1-c1cc(ccn1)C(O)=O
COc1ccc(OCc2cc3nccc(C(O)=O)c3[nH]2)cc1
COc1ccc(cc1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
COc1ccc(cc1)-c1nn(C)c2nc(=O)n(C)c(=O)c2n1
COc1ccc(cc1)-n1cc(C(=O)NCC(C)(C)N2CCOCC2)c(n1)-c1ccccc1
COc1ccc(cc1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
COc1ccc(cc1)[C@@H](C)N1CCC[C@@H](CNCc2cc(ccn2)C(O)=O)C1=O |r|
COc1ccc(cc1N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1C)N1CCN(C)CC1
COc1ccc(cn1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1ccc2C(CNc3cnccc3C(O)=O)CCCc2c1
COc1ccc2C(CNc3cnccc3C(O)=O)CCCc2c1F
COc1ccc2C(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)CCCc2c1
COc1ccc2CCCC(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)c2c1
COc1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1C |r|
COc1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1C |r|
COc1ccc2c(-c3cc4nccc(C(O)=O)c4[nH]3)n(C)nc2c1
COc1ccc2c(Nc3cnccc3C(O)=O)nn(C)c2c1
COc1ccc2nn(C)c(-c3cc4nccc(C(O)=O)c4[nH]3)c2c1
COc1cccc(CC(=O)Nc2ccc(O)c(c2)-c2cc(ccn2)C(O)=O)c1
COc1cccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c1
COc1cccc(Cc2cc3nccc(C(O)=O)c3[nH]2)c1
COc1cccc(Cn2cc(Oc3nc4cnccc4c(=O)[nH]3)cn2)c1
COc1cccc(c1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
COc1cccc(c1)N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
COc1cccc(c1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1cccc(n1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1cccc2C(CNc3cnccc3C(O)=O)CCCc12
COc1cccc2C(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)CCCc12
COc1cccc2CCCC(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)c12
COc1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
COc1ccccc1CCn1cnc(c1)-c1cc(ccn1)C(O)=O
COc1ccccc1CNCCn1cnc(c1)-c1cc(ccn1)C(O)=O
COc1ccccc1N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
COc1sc(nc1Cl)-c1ccccc1
COn1nnc(C(O)=O)c1C(O)=O
CS(=O)(=O)c1ccc(cc1)-c1ccnn1-c1cc(ccn1)C(O)=O
CS(=O)(=O)c1ccc(cc1O)-c1ccnn1-c1cc(ccn1)C(O)=O
CSCC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC1=O)C(=O)NCC(=O)NCC(=O)NCC(N)=O)NC(=O)[C@H](C)N |r|
CSc1c(Cl)[n+]([O-])nn1-c1ccccc1
C[C@@H](N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccccc1 |r|
C[C@@H](N1CCC[C@@H](CNCc2cc(ccn2)C(O)=O)C1=O)c1ccccc1 |r|
C[C@@H](N1CCC[C@H](CNCc2cc(ccn2)C(O)=O)C1=O)c1ccccc1 |r|
C[C@@H](N1CC[C@@H](CNCc2cc(ccn2)C(O)=O)C1=O)c1ccccc1 |r|
C[C@@H](NC(=O)c1cc(Cl)ccn1)C(O)=O |r|
C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCn1cc(nn1)C(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)N)C(O)=O |r|
C[C@@H](O)c1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
C[C@H](N(C)c1ccc(Oc2nc(O)c3ccncc3n2)cc1)c1ccccc1 |r|
C[C@H](O)c1ccc(cc1)N(C)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
C[n+]1ccnn1-c1ccccc1
C[n+]1nn(Cc2ccccc2)cc1Cl
Cc1c(Cl)[n+]([O-])nn1-c1ccccc1
Cc1c(F)cccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1c(F)cccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1c(O)c(C=O)nn1-c1ccccc1
Cc1c(O)c(nn1-c1ccc(C)cc1)C(=O)c1ccccc1
Cc1c(O)c(nn1-c1ccccc1)C(=O)c1ccccc1
Cc1c(Oc2nc3cnccc3c(=O)[nH]2)cnn1C
Cc1c(cnn1-c1cc(ccn1)C(O)=O)-c1ccccc1
Cc1c(cnn1C)C(O)=O
Cc1cc(-c2ccc(C)cc2)n(n1)-c1cc(ccn1)C(O)=O
Cc1cc(Br)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
Cc1cc(C)c2CCCC(CNc3cnccc3C(O)=O)c2c1
Cc1cc(C)cc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Cc1cc(Cc2cc3nccc(C(O)=O)c3[nH]2)ccc1Cl
Cc1cc(Cl)ccc1-c1c(ncn1C)-c1cc(ccn1)C(O)=O |(2.15,3.85,;.82,3.08,;-.52,3.85,;-1.85,3.08,;-3.19,3.85,;-1.85,1.54,;-.52,.77,;.82,1.54,;2.15,.77,;2.15,-.77,;3.61,-1.25,;4.52,,;3.61,1.25,;4.38,2.58,;.82,-1.54,;-.52,-.77,;-1.85,-1.54,;-1.85,-3.08,;-.52,-3.85,;.82,-3.08,;-3.19,-.77,;-3.19,.77,;-4.52,-1.54,)|
Cc1cc(Cl)ccc1CNc1cnccc1C(O)=O
Cc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
Cc1cc(F)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
Cc1cc(F)ccc1Cc1cc(O)n(n1)-c1cc(ccn1)C(O)=O
Cc1cc(F)ccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Cc1cc(F)ccc1Oc1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1cc(I)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
Cc1cc(O)c2c(CC(O)=O)cc(=O)oc2c1
Cc1cc(O)n(n1)-c1cc(ccn1)C(O)=O
Cc1cc(OCC(F)(F)F)ccc1-c1ccc2C(CNc3cnccc3C(O)=O)NCCc2c1
Cc1cc(OCC(F)(F)F)ccc1-c1ccc2C(CNc3cnccc3C(O)=O)NCc2c1
Cc1cc(OCC(F)(F)F)ccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
Cc1cc(OCC(F)(F)F)ccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCc2c1 |r|
Cc1cc(OCC(F)(F)F)ccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
Cc1cc(OCC(F)(F)F)ccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)NCc2c1 |r|
Cc1cc(OCC2CC2)ccc1-c1ccc2C(CNc3cnccc3C(O)=O)NCCc2c1
Cc1cc(OCC2CC2)ccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
Cc1cc(OCC2CC2)ccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
Cc1cc(OCc2ccccc2)n(n1)-c1cc(ccn1)C(O)=O
Cc1cc(ccc1COc1ccnn1-c1cc(ccn1)C(O)=O)C#N
Cc1cc(ccn1)-c1ccc2C(CNc3cnccc3C(O)=O)CCCc2c1
Cc1cc(no1)C(=O)Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
Cc1cc2OCCC(CNc3cnccc3C(O)=O)c2cc1C
Cc1ccc(C)c(CNc2cnccc2C(O)=O)c1
Cc1ccc(C2CC2)c(CNc2cnccc2C(O)=O)c1
Cc1ccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
Cc1ccc(CNc2cnccc2C(O)=O)cc1
Cc1ccc(CNc2cnccc2C(O)=O)o1
Cc1ccc(CNc2cnccc2C(O)=O)s1
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(C)c1
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(Cl)c1
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(F)c1
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(F)c1F
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)c(c1)C#N
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1Cl
Cc1ccc(COc2ccnn2-c2cc(ccn2)C(O)=O)cc1F
Cc1ccc(Cc2cc(O)n(n2)-c2cc(ccn2)C(O)=O)c(F)c1
Cc1ccc(Cn2cc(nn2)C(O)=O)cc1
Cc1ccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c(F)c1
Cc1ccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
Cc1ccc(F)cc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccc(OCC2CC2)c(c1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O |(-3.22,-.92,;-2.1,-.28,;-2.1,1.26,;-.77,2.03,;.56,1.26,;1.9,2.03,;1.9,3.57,;3.23,4.34,;4.77,4.34,;4,5.67,;.56,-.28,;-.77,-1.05,;1.9,-1.05,;1.9,-2.59,;3.36,-3.07,;4.27,-1.82,;3.36,-.58,;4.13,.76,;.56,-3.36,;-.77,-2.59,;-2.1,-3.36,;-2.1,-4.9,;-.77,-5.67,;.56,-4.9,;-3.44,-2.59,;-3.44,-1.48,;-4.77,-3.36,)|
Cc1ccc(OCc2cc3nccc(C(O)=O)c3[nH]2)cc1
Cc1ccc(Oc2ccc3[C@H](CNc4cnccc4C(O)=O)CCCc3c2)c(F)c1 |r|
Cc1ccc(Sc2ccc3[C@@H](CNc4cnccc4C(O)=O)CCCc3c2)cc1 |r|
Cc1ccc(Sc2ccc3[C@H](CNc4cnccc4C(O)=O)CCCc3c2)cc1 |r|
Cc1ccc(cc1)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
Cc1ccc(cc1)-c1cc(N)nn1-c1cc(ccn1)C(O)=O
Cc1ccc(cc1)-c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccc(cc1)-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccc(cc1)-c1ccnn1-c1cc(ccn1)C(O)=O
Cc1ccc(cc1)S(=O)(=O)c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccc(cc1)S(=O)(=O)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccc(cc1O)-c1c(ncn1C)-c1cc(ccn1)C(O)=O
Cc1ccc(cc1O)-c1ccnn1-c1cc(ccn1)C(O)=O
Cc1ccc2C(CNc3cnccc3C(O)=O)CCCc2c1C
Cc1ccc2C(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)CCCc2c1
Cc1ccc2CCCC(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)c2c1
Cc1ccc2N(CCc2c1)c1ccc(Oc2nc(O)c3ccncc3n2)cc1
Cc1ccc2OCCC(CNc3cnccc3C(O)=O)c2c1
Cc1ccc2c(Nc3cnccc3C(O)=O)nn(C)c2c1
Cc1ccc2n(C)nc(Nc3cnccc3C(O)=O)c2c1
Cc1ccc2n(CC3CC3)nc(Nc3cnccc3C(O)=O)c2c1
Cc1ccc2n(CCC(F)(F)F)nc(Nc3cnccc3C(O)=O)c2c1
Cc1ccc2n(ccc2c1)-c1ccc(Oc2nc(O)c3ccncc3n2)cc1
Cc1cccc(CNc2cnccc2C(O)=O)c1C
Cc1cccc(CNc2cnccc2C(O)=O)c1C1CC1
Cc1cccc(Cc2cc3nccc(C(O)=O)c3[nH]2)c1
Cc1cccc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Cc1cccc(Oc2ccc3C(CNc4cnccc4C(O)=O)CCCc3c2)n1
Cc1cccc(Sc2ccc3[C@@H](CNc4cnccc4C(O)=O)CCCc3c2)c1 |r|
Cc1cccc(Sc2ccc3[C@H](CNc4cnccc4C(O)=O)CCCc3c2)c1 |r|
Cc1cccc(c1)-c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1cccc(c1)-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1cccc(c1)-c1ccnn1-c1cc(ccn1)C(O)=O
Cc1cccc(c1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Cc1cccc(c1)S(=O)(=O)c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1cccc(c1)S(=O)(=O)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccccc1-c1cc2nccc(C(O)=O)c2[nH]1
Cc1ccccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
Cc1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)NCCc2c1 |r|
Cc1ccccc1CCn1cnc(c1)-c1cc(ccn1)C(O)=O
Cc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Cc1ccccc1OCc1cc2nccc(C(O)=O)c2[nH]1
Cc1ccccc1Oc1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccccc1Oc1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccccc1Sc1ccc2[C@@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccccc1Sc1ccc2[C@@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccccc1Sc1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
Cc1ccccc1Sc1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1ccnn1-c1cc(ccn1)C(O)=O
Cc1ccsc1C(NC(=O)c1ccccc1)c1cc(Cl)c2cccnc2c1O
Cc1ccsc1CNc1cnccc1C(O)=O
Cc1ccsc1CNc1ncccc1C(O)=O
Cc1cn2CCN(Cc3cc(ccn3)C(O)=O)CCc2n1
Cc1cnn(c1OCc1ccc(F)cc1)-c1cc(ccn1)C(O)=O
Cc1csc(CNc2cnccc2C(O)=O)c1
Cc1nn(C)cc1Oc1nc2cnccc2c(=O)[nH]1
Cc1nn(C)n(C)c1=S
Cc1nn(c(O)c1-c1ccccc1)-c1cc(ccn1)C(O)=O
Cc1nn(c(O)c1C)-c1cc(ccn1)C(O)=O
Cc1sccc1-c1ccc2[C@@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cc1sccc1-c1ccc2[C@H](CNc3cnccc3C(O)=O)CCOc2c1 |r|
Cl.COC(=O)c1ccnc(c1)-c1cc(ccn1)C(=O)Nc1ccc(cc1)[C@@H]1C[C@H]1N |r|
Cl.N[C@@H]1C[C@H]1c1ccc(NC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Cl.N[C@H]1C[C@@H]1c1ccc(NC(=O)CCCCCNC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Cl.N[C@H]1C[C@@H]1c1ccc(NC(=O)CCCCNC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Cl.N[C@H]1C[C@@H]1c1ccc(NC(=O)CCCNC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Clc1ccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]n2)cc1
Clc1ccc(N\N=C(/c2ccccc2)c2ccccn2)nc1
Clc1ccc(Oc2nc3cnccc3c(=O)[nH]2)cc1
Clc1ccc(cc1)-c1c(ncn1CC1CC1)-c1cc(ccn1)-c1nn[nH]n1
Clc1ccc(cc1)-c1c(ncn1CCc1ccccc1Cl)-c1cc(ccn1)-c1nn[nH]n1
Clc1ccc2n(CCN3CCCC3)nc(Nc3cnccc3C(=O)NC#N)c2c1
Clc1cccc(Cl)c1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
Clc1cccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]n2)c1
Clc1cccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]n2)c1Cl
Clc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
Clc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
Clc1csc(n1)-c1ccccc1
Clc1ncccc1Nc1ncccc1C#N
Cn1c(=O)[nH]c2ccc(cc2c1=O)-c1ccccc1
Cn1c(=O)nc2[nH]nc(nc2c1=O)-c1ccccc1
Cn1c(Cl)cnc1CO
Cn1c2nc(nn(C)c2nc1=O)-c1ccccc1
Cn1cc(Br)nc1-c1ccccc1
Cn1cc(Cl)nc1Cl
Cn1cc(N)nn1
Cn1cc(Nc2cnccc2C(O)=O)c2cccnc12
Cn1cc(Oc2nc3cnccc3c(=O)[nH]2)cn1
Cn1cc(nn1)C(O)=O
Cn1cc2ccc(COc3ccnn3-c3cc(ccn3)C(O)=O)cc2n1
Cn1ccc(n1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Cn1ccc2cc(Oc3nc(O)c4ccncc4n3)ccc12
Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1)-c1cc(ccn1)-c1nnn[nH]1
Cn1cnc(c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1)-c1nccc2c(O)nc(OCCCC(F)(F)F)nc12
Cn1cnc(c1-c1c(F)cccc1OCC1CC1)-c1cc(ccn1)C(O)=O |(4.3,.65,;3.53,-.68,;4.44,-1.93,;3.53,-3.18,;2.07,-2.7,;2.07,-1.16,;.39,-.17,;-.94,-.94,;-.94,-2.12,;-2.28,-.17,;-2.28,1.37,;-.94,2.14,;.39,1.37,;1.73,2.14,;1.73,3.68,;3.06,4.45,;4.6,4.45,;3.83,5.78,;.74,-3.47,;-.6,-2.7,;-1.93,-3.47,;-1.93,-5.01,;-.6,-5.78,;.74,-5.01,;-3.27,-2.7,;-3.27,-1.59,;-4.6,-3.47,)|
Cn1cnc(c1-c1cc(F)c(F)cc1OCC1CC1)-c1cc(ccn1)C(O)=O |(4.3,.65,;3.53,-.68,;4.44,-1.93,;3.53,-3.18,;2.07,-2.7,;2.07,-1.16,;.39,-.17,;-.94,-.94,;-2.28,-.17,;-3.61,-.94,;-2.28,1.37,;-3.61,2.14,;-.94,2.14,;.39,1.37,;1.73,2.14,;1.73,3.68,;3.06,4.45,;4.6,4.45,;3.83,5.78,;.74,-3.47,;-.6,-2.7,;-1.93,-3.47,;-1.93,-5.01,;-.6,-5.78,;.74,-5.01,;-3.27,-2.7,;-3.27,-1.59,;-4.6,-3.47,)|
Cn1cnc(c1-c1ccc(Cl)c(Cl)c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(Cl)c(F)c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(Cl)c(OCc2ccccc2)c1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1-c1ccc(Cl)c(c1)C(F)(F)F)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(Cl)cc1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(Cl)cc1C(F)(F)F)-c1cc(ccn1)C(O)=O |(4.38,1.91,;3.61,.58,;4.52,-.67,;3.61,-1.91,;2.15,-1.44,;2.15,.1,;.82,.87,;-.52,.1,;-1.85,.87,;-1.85,2.41,;-3.19,3.18,;-.52,3.18,;.86,2.44,;2.2,3.21,;3.53,3.98,;1.43,4.54,;2.97,1.88,;.82,-2.21,;-.52,-1.44,;-1.85,-2.21,;-1.85,-3.75,;-.52,-4.52,;.82,-3.75,;-3.19,-1.44,;-3.19,.1,;-4.52,-2.21,)|
Cn1cnc(c1-c1ccc(Cl)cc1Cl)-c1cc(ccn1)C(O)=O |(4.38,2.58,;3.61,1.25,;4.52,,;3.61,-1.25,;2.15,-.77,;2.15,.77,;.82,1.54,;-.52,.77,;-1.85,1.54,;-1.85,3.08,;-3.19,3.85,;-.52,3.85,;.82,3.08,;2.15,3.85,;.82,-1.54,;-.52,-.77,;-1.85,-1.54,;-1.85,-3.08,;-.52,-3.85,;.82,-3.08,;-3.19,-.77,;-3.19,.77,;-4.52,-1.54,)|
Cn1cnc(c1-c1ccc(F)c(O)c1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1-c1ccc(F)c(OCC(F)(F)F)c1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1-c1ccc(F)c(OCc2ccccc2)c1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1-c1ccc(F)c(c1)C(=O)NCc1ccccc1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1-c1ccc(F)c(c1)C(=O)Nc1ccccc1)-c1cc(ccn1)-c1nn[nH]n1
Cn1cnc(c1-c1ccc(F)c2ccccc12)-c1cc(ccn1)-c1nn[nH]n1 |(4.9,1.42,;4.13,.09,;5.04,-1.15,;4.13,-2.4,;2.67,-1.93,;2.67,-.38,;1.33,.38,;,-.38,;-1.33,.38,;-1.33,1.93,;-2.67,2.69,;,2.69,;,4.23,;1.33,5,;2.67,4.23,;2.67,2.69,;1.33,1.93,;1.33,-2.69,;,-1.93,;-1.33,-2.69,;-1.33,-4.23,;,-5,;1.33,-4.23,;-2.67,-1.93,;-2.67,-.38,;-4.13,.09,;-5.04,-1.15,;-4.13,-2.4,)|
Cn1cnc(c1-c1ccc(F)cc1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Cn1cnc(c1-c1ccc(F)cc1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(F)cc1OCC1CC1)-c1cc(ccn1)-c1nn[nH]n1 |(4.65,.76,;3.88,-.58,;4.79,-1.82,;3.88,-3.07,;2.42,-2.59,;2.42,-1.05,;1.08,-.28,;-.25,-1.05,;-1.59,-.28,;-1.59,1.26,;-2.92,2.03,;-.25,2.03,;1.08,1.26,;2.42,2.03,;2.42,3.57,;3.75,4.34,;5.29,4.34,;4.52,5.67,;1.08,-3.36,;-.25,-2.59,;-1.59,-3.36,;-1.59,-4.9,;-.25,-5.67,;1.08,-4.9,;-2.92,-2.59,;-2.92,-1.05,;-4.38,-.58,;-5.29,-1.82,;-4.38,-3.07,)|
Cn1cnc(c1-c1ccc(F)cc1OCC1CC1)-c1cc(ccn1)C(O)=O |(4.13,.76,;3.36,-.58,;4.27,-1.82,;3.36,-3.07,;1.9,-2.59,;1.9,-1.05,;.56,-.28,;-.77,-1.05,;-2.1,-.28,;-2.1,1.26,;-3.44,2.03,;-.77,2.03,;.56,1.26,;1.9,2.03,;1.9,3.57,;3.23,4.34,;4.77,4.34,;4,5.67,;.56,-3.36,;-.77,-2.59,;-2.1,-3.36,;-2.1,-4.9,;-.77,-5.67,;.56,-4.9,;-3.44,-2.59,;-3.44,-1.05,;-4.77,-3.36,)|
Cn1cnc(c1-c1ccc(F)cc1OCc1ccccc1)-c1cc(ccn1)-c1nn[nH]n1 |(4.09,.27,;3.32,-1.06,;4.22,-2.31,;3.32,-3.56,;1.85,-3.08,;1.85,-1.54,;.52,-.77,;-.82,-1.54,;-2.15,-.77,;-2.15,.77,;-3.48,1.54,;-.82,1.54,;.52,.77,;1.85,1.54,;1.85,3.08,;3.19,3.85,;4.52,3.08,;5.85,3.85,;5.85,5.39,;4.52,6.16,;3.19,5.39,;.52,-3.85,;-.82,-3.08,;-2.15,-3.85,;-2.15,-5.39,;-.82,-6.16,;.52,-5.39,;-3.48,-3.08,;-3.48,-1.54,;-4.95,-1.06,;-5.85,-2.31,;-4.95,-3.56,)|
Cn1cnc(c1-c1ccc(OC(F)(F)F)cc1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(OCC2CC2)cc1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)-n1cccn1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)C#C)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)C(C)(C)C)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)C(F)(F)F)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)C1(CC1)C(F)(F)F)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)C1(CO)CC1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)C1CC1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc(cc1)N1CCCC1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1ccc2cc[nH]c2c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1cccc(CO)c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1cccc(Cl)c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1-c1cccc(F)c1)-c1cc(ccn1)C(O)=O
Cn1cnc(c1Br)-c1cc(ccn1)C(O)=O
Cn1nc(-c2cc3nccc(C(O)=O)c3[nH]2)c2cc(F)ccc12
Cn1nc(-c2cc3nccc(C(O)=O)c3[nH]2)c2ccc(Cl)cc12
Cn1nc(-c2cc3nccc(C(O)=O)c3[nH]2)c2ccc(F)cc12
Cn1nc(-c2cc3nccc(C(O)=O)c3[nH]2)c2ccccc12
Cn1nc(Cc2ccccc2)nc2c1nc(=O)n(C)c2=O
Cn1nc(Nc2cnccc2C(O)=O)c2c(F)cccc12
Cn1nc(Nc2cnccc2C(O)=O)c2cc(Cl)ccc12
Cn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
Cn1nc(Nc2cnccc2C(O)=O)c2cc(ccc12)C(F)(F)F
Cn1nc(Nc2cnccc2C(O)=O)c2ccc(F)cc12
Cn1nc(Nc2cnccc2C(O)=O)c2ccccc12
Cn1nc(Nc2cnccc2C(O)=O)c2cccnc12
Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(F)cc1
Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(O)cc1
Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(cc1)C#N
Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(cc1)S(N)(=O)=O
Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccc1
Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccncc1
Cn1nc2cc(Cl)ccc2c1-c1cc2nccc(C(O)=O)c2[nH]1
Cn1nc2ccc(Cl)cc2c1-c1cc2nccc(C(O)=O)c2[nH]1
Cn1nc2ccc(OC(F)(F)F)cc2c1-c1cc2nccc(C(O)=O)c2[nH]1
Cn1nc2ccc(cc2c1-c1cc2nccc(C(O)=O)c2[nH]1)C(F)(F)F
Cn1nc2ccc(cc2c1-c1cc2nccc(C(O)=O)c2[nH]1)C1CC1
Cn1nc2ccccc2c1Nc1cnccc1C(O)=O
Cn1ncc2ccc(COc3ccnn3-c3cc(ccn3)C(O)=O)cc12
Cn1nccc1C(O)c1cc2nccc(C(O)=O)c2[nH]1
Cn1nccc1CNc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
Cn1nccc1CNc1ccc(O)c(c1)C(O)=O
Cn1ncnc2c1nc(=O)n(C)c2=O
Cn1nnc(n1)-c1ccnc(c1)-c1cn(Cc2ccccc2Cl)cn1
FC(F)(F)COc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
FC(F)(F)COc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
FC(F)(F)Oc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CC2CCCc3ccccc23)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CC2CCOc3ccccc23)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CC2CCc3ccccc23)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CCc2ccc(Cl)cc2)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CCc2ccc(cc2)C(F)(F)F)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CCc2ccccc2C(F)(F)F)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(CCc2ccccc2Cl)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(Cc2ccc(Cl)cc2)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(Cc2ccccc2)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(Cc2ccccc2Cl)cn1
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(cn1)[C@@H]1CCCN(C1)C(=O)c1ccccc1 |r|
FC(F)(F)c1[nH]nnc1-c1ccnc(c1)-c1cn(cn1)[C@H]1CCCN(C1)C(=O)c1ccccc1 |r|
FC(F)(F)c1cccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]n2)c1Cl
FC(F)(F)c1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]n1
FC(F)(F)c1nc2cnccc2c(=O)[nH]1
Fc1cc(F)c(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c(F)c1
Fc1cc(F)c(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1F
Fc1ccc(-c2c(ncn2Cc2cccc(Cl)c2)-c2cc(ccn2)-c2nn[nH]n2)c(OCC2CC2)c1 |(-4.91,2.03,;-3.58,1.26,;-3.58,-.28,;-2.24,-1.05,;-.91,-.28,;.43,-1.05,;.43,-2.59,;1.89,-3.07,;2.79,-1.82,;1.89,-.58,;2.66,.76,;4.2,.76,;4.97,-.58,;6.51,-.58,;7.28,.76,;6.51,2.09,;7.28,3.43,;4.97,2.09,;-.91,-3.36,;-2.24,-2.59,;-3.58,-3.36,;-3.58,-4.9,;-2.24,-5.67,;-.91,-4.9,;-4.91,-2.59,;-4.91,-1.05,;-6.37,-.58,;-7.28,-1.82,;-6.37,-3.07,;-.91,1.26,;.43,2.03,;.43,3.57,;1.76,4.34,;3.3,4.34,;2.53,5.67,;-2.24,2.03,)|
Fc1ccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c(F)c1
Fc1ccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
Fc1ccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c(F)c1
Fc1ccc(Cn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)cc1
Fc1ccc(F)c(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c1
Fc1ccc(cc1)-c1c(ncn1CC(F)(F)F)-c1cc(ccn1)-c1nn[nH]n1
Fc1ccc(cc1)-c1c(ncn1CC1CC1)-c1cc(ccn1)-c1nn[nH]n1
Fc1ccc(cc1)-c1c(ncn1CCc1ccccc1Cl)-c1cc(ccn1)-c1nn[nH]n1
Fc1ccc(cc1)-c1c(ncn1Cc1ccccc1Cl)-c1cc(ccn1)-c1nn[nH]n1
Fc1ccc2C(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)CCCc2c1
Fc1ccc2CCC(c2c1)n1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Fc1ccc2CCCC(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)c2c1
Fc1ccc2n(CCN3CCC(F)(F)C3)nc(Nc3cnccc3C(=O)NC#N)c2c1
Fc1ccc2n(CCN3CCC(F)(F)CC3)nc(Nc3cnccc3C(=O)NC#N)c2c1
Fc1ccc2n(CCN3CCCC3)nc(Nc3cnccc3C(=O)NC#N)c2c1
Fc1ccc2n(nc(Nc3cnccc3C(=O)NC#N)c2c1)[C@H]1CCOC1 |r|
Fc1cccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c1
Fc1cccc(CCn2cnc(c2)-c2cc(ccn2)-c2nn[nH]c2C(F)(F)F)c1F
Fc1cccc(Cl)c1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Fc1cccc(F)c1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Fc1cccc(F)c1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Fc1cccc2C(Cn3cnc(c3)-c3cc(ccn3)-c3nn[nH]c3C(F)(F)F)CCCc12
Fc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Fc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1nn[nH]c1C(F)(F)F
Fc1cncc(c1)-c1nc2cnccc2c(=O)[nH]1
NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
NC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
NCCCNc1cnccc1C(O)=O
NCCNc1cnccc1C(O)=O
N[C@@H]1C[C@H]1c1ccccc1 |r|
Nc1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
Nc1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)nc1
Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
Nc1ccccc1CNc1cnccc1C(O)=O
Nc1cn(nn1)-c1ccccc1
Nc1cnccc1C(O)=O
O=c1[nH][nH]c2cnccc12
O=c1[nH]c(OC2CCCCC2)nc2cnccc12
O=c1[nH]c(OCC2CCCCC2)nc2cnccc12
O=c1[nH]c(OCc2ccccc2)nc2cnccc12
O=c1[nH]c(Oc2ccccc2)nc2cnccc12
O=c1[nH]c(Oc2cccnc2)nc2cnccc12
O=c1[nH]c(Oc2cn[nH]c2)nc2cnccc12
O=c1[nH]c(Oc2cnn(CC3CCCCC3)c2)nc2cnccc12
O=c1[nH]c(Oc2cnn(Cc3ccccc3)c2)nc2cnccc12
O=c1[nH]c(Oc2cnn(Cc3ccccc3)c2)nc2ncccc12
O=c1[nH]c(Oc2cnn(Cc3cccnc3)c2)nc2cnccc12
O=c1[nH]c(Oc2cnn(c2)-c2ccccc2)nc2cnccc12
O=c1[nH]c(Oc2cnn(c2)C2CCCC2)nc2cnccc12
O=c1[nH]c(Oc2cnn(c2)C2CCCCC2)nc2cnccc12
O=c1[nH]c(Oc2cnn(c2)C2CCCCCC2)nc2cnccc12
O=c1[nH]c(nc2cnccc12)-c1ccccc1
O=c1[nH]c(nc2cnccc12)-c1cccnc1
O=c1[nH]ccc2cnccc12
O=c1[nH]cnc2cnccc12
O=c1[nH]ncc2cnccc12
O=c1c2CCCCc2[nH]c2c(cnn12)C#N
O=c1ncn(Cc2ccccc2)c2cnccc12
OB(O)c1cc[nH]n1
OC(=O)C(F)(F)F.N[C@@H]1C[C@H]1c1ccc(NC(=O)c2ccnc(c2)-c2cc(ccn2)C(O)=O)cc1 |r|
OC(=O)CCNc1cc(nc(n1)-c1ccccn1)N1CCc2ccccc2CC1
OC(=O)CNC(=O)C(O)=O
OC(=O)CNC(=O)c1ccc2ccccc2n1
OC(=O)CNC(=O)c1nc(Nc2ccc(cc2)[N+]([O-])=O)ccc1O
OC(=O)CNC(=O)c1nc(Nc2ccc(cn2)[N+]([O-])=O)ccc1O
OC(=O)CNC(=O)c1nc(ccc1O)-c1cccc2ccccc12
OC(=O)CNC(=O)c1nc(ccc1O)-c1cccc2ncccc12
OC(=O)CNC(=O)c1nc(ccc1O)-c1ccccc1
OC(=O)CNC(=O)c1nc(ccc1O)-c1ccccc1-c1ccccc1
OC(=O)Cn1nnnc1COc1ccccc1
OC(=O)[C@H]1CN(C(=O)C1)c1nccs1 |r|
OC(=O)\C=C\C(=O)NNC(=O)c1cnccc1Cc1ccccc1
OC(=O)c1cc(NCc2ccc(Br)cc2)ccc1O
OC(=O)c1cc(NCc2cccc3OCOc23)ccc1O
OC(=O)c1cc(O)c(=O)c2c(O)c(O)cc(-c3ccccc3)c2c1
OC(=O)c1cc([nH]n1)C(O)=O
OC(=O)c1cc(n[nH]1)[N+]([O-])=O
OC(=O)c1ccc(O)c2ncc(cc12)N1CCCN(CCc2cccc3ccccc23)CC1
OC(=O)c1ccc(O)c2ncccc12
OC(=O)c1cccnc1NCc1ccco1
OC(=O)c1ccn[nH]1
OC(=O)c1ccnc(CN2CCNCC2)c1
OC(=O)c1ccnc(CNCc2nccn2C\C=C\c2ccccc2)c1
OC(=O)c1ccnc(c1)-c1c[nH]nn1
OC(=O)c1ccnc(c1)-c1cc(NC(=O)Cc2cccc(Br)c2)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NC(=O)Cc2ccccc2)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NC(=O)c2ccc(O)cc2)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NC(=O)c2cccc(O)c2)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NC(=O)c2ccccc2O)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NC(=O)c2ccno2)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NCc2ccc(Br)cc2)ccc1O
OC(=O)c1ccnc(c1)-c1cc(NCc2cccc3OCOc23)ccc1O
OC(=O)c1ccnc(c1)-c1cc(ccc1O)C#N
OC(=O)c1ccnc(c1)-c1ccc[nH]1
OC(=O)c1ccnc(c1)-c1ccccn1
OC(=O)c1ccnc(c1)-c1cn(CC2CCCCC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CC2CCCN2)cn1
OC(=O)c1ccnc(c1)-c1cn(CC2CCCO2)cn1
OC(=O)c1ccnc(c1)-c1cn(CC2CCCc3ccccc23)cn1
OC(=O)c1ccnc(c1)-c1cn(CCC2CCCCC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN(Cc2ccc(Cl)c(Cl)c2)C2CC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN(Cc2ccc(Cl)cc2)C2CC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN(Cc2ccc(F)cc2)C2CC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCCC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCCC2=O)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCCc3cc(Cl)ccc23)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCCc3cc(F)ccc23)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCCc3ccccc23)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCOCC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2CCc3cc(F)ccc23)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2Cc3ccc(Cl)cc3C2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2Cc3ccc(F)cc3C2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2Cc3ccc(cc3C2)C(F)(F)F)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2Cc3cccc(C#N)c3C2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2Cc3cccc(Cl)c3C2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCN2Cc3ccccc3C2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCNCC2CC(F)(F)C2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCNCC2CCC(F)(F)CC2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCNCc2ccc(F)cc2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCNCc2ccccc2C(F)(F)F)cn1
OC(=O)c1ccnc(c1)-c1cn(CCNCc2ccccc2Cl)cn1
OC(=O)c1ccnc(c1)-c1cn(CCOc2ccccc2)nn1
OC(=O)c1ccnc(c1)-c1cn(CCc2ccc(F)cc2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCc2cccc(Cl)c2)cn1
OC(=O)c1ccnc(c1)-c1cn(CCc2cccc3ccccc23)cn1
OC(=O)c1ccnc(c1)-c1cn(CCc2ccccc2)nn1
OC(=O)c1ccnc(c1)-c1cn(CCc2ccccc2C(F)(F)F)cn1
OC(=O)c1ccnc(c1)-c1cn(CCc2ccccc2Cl)cn1
OC(=O)c1ccnc(c1)-c1cn(CCc2ccccc2F)cn1
OC(=O)c1ccnc(c1)-c1cn(CCn2cccn2)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2ccc(F)cc2)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2cccc(F)c2)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2cccc(c2)-c2ccccc2)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2cccc(c2)C(F)(F)F)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2ccccc2)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2ccccc2F)cn1
OC(=O)c1ccnc(c1)-c1cn(Cc2ccccn2)cn1
OC(=O)c1ccnc(c1)-c1cn(cn1)C1CCNC1
OC(=O)c1ccnc(c1)-c1cn(cn1)C1CCc2c1cccc2F
OC(=O)c1ccnc(c1)-c1cn(cn1)C1CCc2ccc(F)cc12
OC(=O)c1ccnc(c1)-c1cn(cn1)C1Cc2ccccc2C1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCCN(C1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCCN(C1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCCN(C1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(C1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(C1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(CC1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(CC1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(CC1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CN(C1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CN(C1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CN(C1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)[C@@H]1CCCN(C1)C(=O)c1ccccc1 |r|
OC(=O)c1ccnc(c1)-c1cn(nn1)[C@H]1CCCN(C1)C(=O)c1ccccc1 |r|
OC(=O)c1ccnc(c1)-c1ncn(CC2CC2)c1-c1ccc(Cl)cc1
OC(=O)c1ccnc(c1)-c1ncn(CC2CC2)c1-c1ccc(F)cc1
OC(=O)c1ccnc(c1)-c1ncn(CCc2ccccc2Cl)c1-c1ccc(F)cc1
OC(=O)c1ccnc(c1)-c1ncn(Cc2ccccc2Cl)c1-c1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1ccc(CCc2ccccc2)n1
OC(=O)c1ccnc(c1)-n1ccc(Cc2ccccc2)n1
OC(=O)c1ccnc(c1)-n1nc(COc2ccccc2)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2c(F)cccc2F)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2cc(Cl)cc(Cl)c2)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2ccc(Cl)cc2)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2ccc(F)cc2F)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2cccc(Cl)c2)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2ccccc2)cc1O
OC(=O)c1ccnc(c1)-n1nc(Cc2ccccc2Cl)cc1O
OC(=O)c1ccnc(c1)-n1nc(cc1O)-c1ccc(Cl)cc1
OC(=O)c1ccnc(c1)-n1nc(cc1O)-c1cccc(Cl)c1
OC(=O)c1ccnc(c1)-n1nc(cc1O)-c1ccccc1Cl
OC(=O)c1ccnc(c1)-n1nc(cc1O)-c1ccccc1F
OC(=O)c1ccnc(c1)-n1nc(cc1O)C1(CC1)c1ccc(Cl)cc1
OC(=O)c1ccnc(c1)-n1nc(cc1O)C1CC1
OC(=O)c1ccnc(c1)-n1nc(cc1O)C1CCCC1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(Br)cc1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(Cl)c(O)c1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)c(F)c1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(F)cc1F
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc(O)cc1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccc2cn[nH]c2c1
OC(=O)c1ccnc(c1)-n1nccc1-c1cccc(F)c1
OC(=O)c1ccnc(c1)-n1nccc1-c1cccc(O)c1
OC(=O)c1ccnc(c1)-n1nccc1-c1ccccc1
OC(=O)c1ccnc(c1)-n1nccc1CCc1ccccc1
OC(=O)c1ccnc(c1)-n1nccc1Cc1ccccc1
OC(=O)c1ccnc(c1)-n1nccc1O
OC(=O)c1ccnc(c1)-n1nccc1OC1CCCc2cc(Cl)ccc12
OC(=O)c1ccnc(c1)-n1nccc1OC1CCCc2cc(F)ccc12
OC(=O)c1ccnc(c1)-n1nccc1OC1CCc2cc(Cl)ccc12
OC(=O)c1ccnc(c1)-n1nccc1OC1CCc2cc(F)ccc12
OC(=O)c1ccnc(c1)-n1nccc1OCC1CC(F)(F)C1
OC(=O)c1ccnc(c1)-n1nccc1OCC1CCC(F)(F)CC1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Br)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(C2CC2)c(Cl)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(C2CC2)c(F)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)c(Cl)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)c(F)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)c(OCC(F)(F)F)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)c(OCC2CC2)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)c(OCc2ccc(F)cc2)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)c(c1)C(F)(F)F
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1CCc1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1Cl
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1F
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1OCC(F)(F)F
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1OCC1CC1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1OCc1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1OCc1ccccc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(Cl)cc1\C=C\c1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)c(Cl)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)c(F)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)c(OCc2ccc(F)cc2)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)cc1CCc1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)cc1F
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)cc1OCc1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(F)cc1\C=C\c1ccc(F)cc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(cc1)C#N
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(cc1)C(F)(F)F
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(cc1)C1CC1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(cc1Cl)C1CC1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc(cc1F)C1CC1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccc2cn[nH]c2c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccc(Br)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccc(Cl)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccc(F)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccc(O)c1
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccc(c1)C#N
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccc2CCOc12
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccccc1F
OC(=O)c1ccnc(c1)-n1nccc1OCc1cccnc1
OC(=O)c1ccnc(c1)-n1nccc1OCc1ccncc1
OC(=O)c1ccnc(c1)C(O)=O
OC(=O)c1ccnc2c(Cl)c[nH]c12
OC(=O)c1ccnc2cc(CC3CCCC3)[nH]c12
OC(=O)c1ccnc2cc(CC3CCCCC3)[nH]c12
OC(=O)c1ccnc2cc(CCC#N)[nH]c12
OC(=O)c1ccnc2cc(CCc3ccccc3)[nH]c12
OC(=O)c1ccnc2cc(COc3cc(Cl)cc(Cl)c3)[nH]c12
OC(=O)c1ccnc2cc(COc3cc(F)cc(F)c3)[nH]c12
OC(=O)c1ccnc2cc(COc3ccc(Cl)cc3)[nH]c12
OC(=O)c1ccnc2cc(COc3ccc(F)cc3)[nH]c12
OC(=O)c1ccnc2cc(COc3ccc(F)cc3Cl)[nH]c12
OC(=O)c1ccnc2cc(COc3ccc(cc3)C#N)[nH]c12
OC(=O)c1ccnc2cc(COc3ccc(cc3)C(F)(F)F)[nH]c12
OC(=O)c1ccnc2cc(COc3ccc4OCCc4c3)[nH]c12
OC(=O)c1ccnc2cc(COc3cccc(Cl)c3)[nH]c12
OC(=O)c1ccnc2cc(COc3cccc(F)c3)[nH]c12
OC(=O)c1ccnc2cc(COc3ccccc3)[nH]c12
OC(=O)c1ccnc2cc(COc3ccccc3Cl)[nH]c12
OC(=O)c1ccnc2cc(COc3ccccc3F)[nH]c12
OC(=O)c1ccnc2cc(Cc3cc(F)c(Cl)c(Cl)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(Cl)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(F)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(OC(F)(F)F)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(OCC4CC4)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(c3)C(F)(F)F)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)cc3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(Cl)cc3Cl)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(F)c(Cl)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(F)c(F)c3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(F)cc3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccc(cc3)C(F)(F)F)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccccc3)[nH]c12
OC(=O)c1ccnc2cc(Cc3ccccc3Cl)[nH]c12
OC(=O)c1ccnc2cc(OCc3ccc(Cl)c(OC(F)(F)F)c3)[nH]c12
OC(=O)c1ccnc2cc(OCc3ccc(Cl)c(OCC4CC4)c3)[nH]c12
OC(=O)c1ccnc2cc([nH]c12)-c1cc2ccccc2o1
OC(=O)c1ccnc2cc([nH]c12)-c1ccccc1
OC(=O)c1ccnc2cc([nH]c12)-c1n(CC2CC2)nc2cc(Cl)ccc12
OC(=O)c1ccnc2cc([nH]c12)-c1n(CCN2CCCC2)nc2ccc(Cl)cc12
OC(=O)c1ccnc2cc([nH]c12)-c1nn(CC(F)(F)F)c2cc(Cl)ccc12
OC(=O)c1ccnc2cc([nH]c12)-c1nn(CC2CC2)c2cc(Cl)ccc12
OC(=O)c1ccnc2cc([nH]c12)-c1nn(CCN2CCCC2)c2ccc(Cl)cc12
OC(=O)c1ccnc2cc([nH]c12)-c1nn(CCN2CCOCC2)c2ccc(F)cc12
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCC(C1)c1ccccc1
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCC(C1)c1ccccc1
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCC1
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCCC1
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCCc2ccccc12
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCc2ccccc12
OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCc2ccccc2C1
OC(=O)c1ccnc2cc([nH]c12)C1(O)CCCC1
OC(=O)c1ccnc2cc([nH]c12)C1(O)CCCCC1
OC(=O)c1ccnc2cc([nH]c12)C1CC1
OC(=O)c1ccnc2cc([nH]c12)C1CCCC1
OC(=O)c1ccncc1NC(=O)CCCc1ccccc1
OC(=O)c1ccncc1NC(=O)CCc1ccccc1
OC(=O)c1ccncc1NC(=O)Cc1ccccc1
OC(=O)c1ccncc1NC(=O)c1ccccc1
OC(=O)c1ccncc1NC(c1ccccc1)c1ccccc1
OC(=O)c1ccncc1NCC1(O)CCCc2c(F)cccc12
OC(=O)c1ccncc1NCC1(O)CCCc2cc(Cl)ccc12
OC(=O)c1ccncc1NCC12CC3CC(CC(C3)C1)C2 |TLB:18:13:20:16.17.19,18:17:20:14.13.12,THB:16:15:12:18.17.19,16:17:14.15.20:12|
OC(=O)c1ccncc1NCC1=CCCc2ccc(F)cc12 |t:12|
OC(=O)c1ccncc1NCC1CC1
OC(=O)c1ccncc1NCC1CCCC1
OC(=O)c1ccncc1NCC1CCCCC1
OC(=O)c1ccncc1NCC1CCCc2c(F)cccc12
OC(=O)c1ccncc1NCC1CCCc2c(OCC3CC3)cccc12
OC(=O)c1ccncc1NCC1CCCc2c(Oc3ccccc3)cccc12
OC(=O)c1ccncc1NCC1CCCc2c3OCCc3ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(Cl)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(OC(F)(F)F)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(OCC(F)(F)F)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(OCC3CC3)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(OCC3CCOCC3)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(OCCC(F)(F)F)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(OCCc3ccccc3)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(Oc3cccc(n3)C(F)(F)F)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(Oc3ccccc3)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(Oc3ccccc3C(F)(F)F)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(Sc3ccccn3)ccc12
OC(=O)c1ccncc1NCC1CCCc2cc(ccc12)C1CCOCC1
OC(=O)c1ccncc1NCC1CCCc2cc(ccc12)N1CCCC1=O
OC(=O)c1ccncc1NCC1CCCc2cc(ccc12)N1CCCc2ccccc12
OC(=O)c1ccncc1NCC1CCCc2cc(ccc12)N1CCc2ccccc12
OC(=O)c1ccncc1NCC1CCCc2cc(ccc12)S(=O)(=O)c1cccc(F)c1
OC(=O)c1ccncc1NCC1CCCc2ccc(Cl)cc12
OC(=O)c1ccncc1NCC1CCCc2ccc(F)cc12
OC(=O)c1ccncc1NCC1CCCc2ccc(cc12)-c1ccccc1
OC(=O)c1ccncc1NCC1CCCc2ccc(cc12)C1CC1
OC(=O)c1ccncc1NCC1CCCc2ccccc12
OC(=O)c1ccncc1NCC1CCCc2nc(ccc12)-c1ccccc1
OC(=O)c1ccncc1NCC1CCOc2c(F)cccc12
OC(=O)c1ccncc1NCC1CCOc2cc(Br)ccc12
OC(=O)c1ccncc1NCC1CCOc2cc(CCC3CC3)ccc12
OC(=O)c1ccncc1NCC1CCOc2cc(Cl)ccc12
OC(=O)c1ccncc1NCC1CCOc2cc(F)ccc12
OC(=O)c1ccncc1NCC1CCOc2cc(Nc3ccccc3)ccc12
OC(=O)c1ccncc1NCC1CCOc2cc(Sc3cccs3)ccc12
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)-c1ccc(cc1)C(F)(F)F
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)-c1ccccc1
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)-c1ccoc1
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)C1CC1
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)C1CCCCC1
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)N(CC(F)(F)F)c1ccccc1
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)N1CCCc2ccccc12
OC(=O)c1ccncc1NCC1CCOc2cc(ccc12)N1CCc2ccccc12
OC(=O)c1ccncc1NCC1CCOc2ccccc12
OC(=O)c1ccncc1NCC1CCSc2ccccc12
OC(=O)c1ccncc1NCC1CCc2ccccc12
OC(=O)c1ccncc1NCC1COc2ccccc2O1
OC(=O)c1ccncc1NCC1Cc2ccccc2O1
OC(=O)c1ccncc1NCC1NCCc2ccccc12
OC(=O)c1ccncc1NCC1OCCc2ccccc12
OC(=O)c1ccncc1NCCCCc1ccccc1
OC(=O)c1ccncc1NCCCc1ccccc1
OC(=O)c1ccncc1NCCc1ccccc1
OC(=O)c1ccncc1NC[C@@H]1CCCc2c(F)cccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(OC(F)F)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(OCCC(F)(F)F)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(OCCC3CC3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Oc3ccc(F)cc3F)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Oc3ccccc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Oc3ccccc3Cl)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Sc3ccc(F)cc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Sc3cccc(F)c3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Sc3ccccc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(Sc3ccccc3F)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(ccc12)N1CCCC1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(ccc12)N1CCCCc2ccccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(ccc12)N1CCOc2ccccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2cc(ccc12)S(=O)(=O)c1ccccc1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCCc2ccccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(Oc3ccccc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(Sc3ccc(F)cc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(Sc3cccc(F)c3)ccc12 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1cc(F)ccc1Cl |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccc(F)cc1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1cccc(F)c1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1cccc(F)c1Cl |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccccc1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccccc1C#N |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccccc1Cl |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccccc1F |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccccc1O |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccccc1[B](F)(F)F |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)-c1ccsc1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)C1(CC1)c1ccccc1 |r|
OC(=O)c1ccncc1NC[C@@H]1CCOc2cc(ccc12)C1CC1 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2c(F)cccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(OC(F)F)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(OCCC(F)(F)F)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(OCCC3CC3)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(Sc3ccc(F)cc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(Sc3cccc(F)c3)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(Sc3ccccc3F)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2cc(ccc12)S(=O)(=O)c1ccccc1 |r|
OC(=O)c1ccncc1NC[C@H]1CCCc2ccccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(Oc3ccccc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(Sc3ccc(F)cc3)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(Sc3cccc(F)c3)ccc12 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)-c1ccc(F)cc1 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)-c1cccc(F)c1 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)-c1ccccc1 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)-c1ccccc1Cl |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)-c1ccccc1F |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)-c1ccsc1 |r|
OC(=O)c1ccncc1NC[C@H]1CCOc2cc(ccc12)C1CC1 |r|
OC(=O)c1ccncc1NCc1cc2ccccc2o1
OC(=O)c1ccncc1NCc1cc2ccccc2s1
OC(=O)c1ccncc1NCc1ccc(Br)cc1
OC(=O)c1ccncc1NCc1ccc(Cl)c(Cl)c1
OC(=O)c1ccncc1NCc1ccc(Cl)cc1
OC(=O)c1ccncc1NCc1ccc(Cl)cc1C1CC1
OC(=O)c1ccncc1NCc1ccc(Cl)cc1Cl
OC(=O)c1ccncc1NCc1ccc(Cl)cc1O
OC(=O)c1ccncc1NCc1ccc(F)cc1
OC(=O)c1ccncc1NCc1ccc(Oc2ccccc2)cc1
OC(=O)c1ccncc1NCc1ccc(cc1)-c1ccccc1
OC(=O)c1ccncc1NCc1ccc(cc1)C#N
OC(=O)c1ccncc1NCc1ccc(cc1)C(F)(F)F
OC(=O)c1ccncc1NCc1ccc(cc1)C1CC1
OC(=O)c1ccncc1NCc1ccc(cc1C1CC1)C(F)(F)F
OC(=O)c1ccncc1NCc1cccc(F)c1
OC(=O)c1ccncc1NCc1cccc(OC(F)(F)F)c1
OC(=O)c1ccncc1NCc1cccc(OCC2CC2)c1
OC(=O)c1ccncc1NCc1cccc(c1)-c1ccccc1
OC(=O)c1ccncc1NCc1cccc(c1)C(F)(F)F
OC(=O)c1ccncc1NCc1cccc2cc[nH]c12
OC(=O)c1ccncc1NCc1cccc2ccccc12
OC(=O)c1ccncc1NCc1ccccc1
OC(=O)c1ccncc1NCc1ccccc1C1CC1
OC(=O)c1ccncc1NCc1ccccc1F
OC(=O)c1ccncc1NCc1ccccc1Nc1ccccc1
OC(=O)c1ccncc1NCc1ccccc1O
OC(=O)c1ccncc1NCc1ccccc1Oc1ccccc1
OC(=O)c1ccncc1NCc1ccco1
OC(=O)c1ccncc1NCc1cccs1
OC(=O)c1ccncc1NCc1ccn[nH]1
OC(=O)c1ccncc1NCc1ccsc1
OC(=O)c1ccncc1NCc1cnccc1C1CC1
OC(=O)c1ccncc1NCc1coc2ccccc12
OC(=O)c1ccncc1NCc1cscn1
OC(=O)c1ccncc1Nc1cn(C2CCOC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1cn(CCC(F)(F)F)c2ccc(Cl)cc12
OC(=O)c1ccncc1Nc1nn(C2CCC(F)(F)CC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(C2CCCC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(C2CCCOC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(C2CCOC2)c2CCCCc12
OC(=O)c1ccncc1Nc1nn(C2CCOC2)c2ccc(Cl)cc12
OC(=O)c1ccncc1Nc1nn(C2CCOC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(C2CCOCC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CC(F)(F)F)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CC2CC2)c2ccc(Cl)cc12
OC(=O)c1ccncc1Nc1nn(CC2CC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CC2CCC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CC2CCCC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CC2CCCO2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCC(F)(F)F)c2ccc(Cl)cc12
OC(=O)c1ccncc1Nc1nn(CCC(F)(F)F)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCC2CC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCC2CCCNC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCN2CCC(F)(F)C2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCN2CCC(F)(F)CC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCN2CCCC2)c2ccc(Cl)cc12
OC(=O)c1ccncc1Nc1nn(CCN2CCCC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCN2CCOCC2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(CCc2ccccc2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn(Cc2ccccc2)c2ccc(F)cc12
OC(=O)c1ccncc1Nc1nn([C@@H]2CCNC2)c2ccc(F)cc12 |r|
OC(=O)c1ccncc1Nc1nn([C@@H]2CCOC2)c2ccc(F)cc12 |r|
OC(=O)c1ccncc1Nc1nn([C@H]2CCNC2)c2ccc(F)cc12 |r|
OC(=O)c1ccncc1Nc1nn([C@H]2CCOC2)c2ccc(F)cc12 |r|
OC(=O)c1ccncc1Nc1noc2ccccc12
OC(=O)c1ccnnc1NCC1CCCc2cc(OCCC(F)(F)F)ccc12
OC(=O)c1ccnnc1NCc1ccccc1
OC(=O)c1cn(nn1)-c1ccccc1
OC(=O)c1cnn(n1)-c1ccccc1
OC(=O)c1cnnc(CNCC(=O)N2CCCCC2)c1
OC(=O)c1cnnn1-c1ccccc1
OC(C1CC1)c1cc2nccc(C(O)=O)c2[nH]1
OC(C1CCOCC1)c1cc2nccc(C(O)=O)c2[nH]1
OC(CC1CC1)c1cc2nccc(C(O)=O)c2[nH]1
OC(Cn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12)C(F)(F)F
OC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1
OC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1Cl
OCC(O)Cn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
OCC1C(Cl)N=NN1c1ccccc1 |c:5|
OCCCCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
OCCCn1nc(Nc2cnccc2C(O)=O)c2cc(F)ccc12
OCCN(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
OCCc1cnn(c1OCc1ccc(F)cc1)-c1cc(ccn1)C(O)=O
OCc1c(Cl)[n+]([O-])nn1-c1ccccc1
OCc1cc2nccc(C(O)=O)c2[nH]1
OCc1ccc(CNc2cnccc2C(O)=O)cc1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CC1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CCCC1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CCCCC1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CCCCCC1
ON(CCC(O)=O)C(=O)CCCCCCCCc1ccccc1
ON(CCCCNCc1ccc(COC(=O)Nc2cccc3ccccc23)cc1)C(=O)C=CC(O)=O |w:31.33|
ON(CCCCNCc1ccc(COC(=O)Nc2cccc3ccccc23)cc1)CC(=O)\C=C\C(O)=O
O[C@@H](CCC(O)=O)C(O)=O |r|
O[C@H](CCC(O)=O)C(O)=O |r|
Oc1c(C#N)c(=O)[nH]c2cnccc12
Oc1cc(Cc2ccc(Cl)cc2)nn1-c1cc(ccn1)-c1nn[nH]n1
Oc1cc(Cc2cccc(Cl)c2)nn1-c1cc(ccn1)-c1nn[nH]n1
Oc1cc(Cc2ccccc2Cl)nn1-c1cc(ccn1)-c1nn[nH]n1
Oc1cc(Oc2nc3cnccc3c(=O)[nH]2)ccc1Cl
Oc1cc(cc2cccnc12)-c1cccc(c1)C(=O)NCCCc1ccccc1
Oc1cccc(Oc2nc3cnccc3c(=O)[nH]2)c1
Oc1csc(=O)[nH]1
Oc1nc(OC2=CC3C=NN(Cc4ccccc4)C3C=C2)nc2cnccc12 |c:8,21,t:5|
Oc1nc(Oc2ccc(cc2)N2CCC(C2)c2ccccc2)nc2cnccc12
Oc1nc(Oc2ccc(cc2)N2CCCC(C2)c2ccccc2)nc2cnccc12
Oc1nc(Oc2ccc(cc2)N2CCOC(C2)c2ccccc2)nc2cnccc12
Oc1nc(Oc2ccc3N(CCCc3c2)c2ccccc2)nc2cnccc12
Oc1nc(Oc2ccc3N(CCc3c2)c2ccccc2)nc2cnccc12
Oc1nc(Oc2ccc3ccn(Cc4ccccc4)c3c2)nc2cnccc12
Oc1nc(Oc2ccc3cn(Cc4ccccc4)nc3c2)nc2cnccc12
Oc1nc(Oc2ccc3cnn(Cc4ccccc4)c3c2)nc2cnccc12
Oc1nc(Oc2ccc3n(CCc4ccccc4)ccc3c2)nc2cnccc12
Oc1nc(Oc2ccc3n(Cc4ccccc4)ccc3c2)nc2cnccc12
Oc1nc(Oc2ccc3n(Cc4ccccc4)ncc3c2)nc2cnccc12
Oc1nc(Oc2ccc3n(ccc3c2)-c2ccccc2)nc2cnccc12
Oc1nc(Oc2ccc3n(ccc3c2)C2CCCC2)nc2cnccc12
Oc1nc(Oc2ccc3n(ccc3c2)C2CCNCC2)nc2cnccc12
Oc1nc(Oc2ccc3n(ccc3c2)C2CCOCC2)nc2cnccc12
Oc1nc(Oc2ccc3nn(Cc4ccccc4)cc3c2)nc2cnccc12
Oc1nc(Oc2cnn(CCN3CCOCC3)c2)nc2cnccc12
Oc1nc(Oc2cnn(c2)[C@@H]2CCCN(Cc3ccccc3)C2)nc2cnccc12 |r|
[H][C@]1(NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](N(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](N(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(C)C)C(C)C)[C@@H](C)CC)C(N)=O)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@]([H])(NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC1=O)[C@@H](C)CC)C(C)C)C(N)=O)[C@H](C)O |r|
[H][C@]1(NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(N)=O)C(C)C)C(C)C)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC1=O)C(C)C)C(C)C)C(N)=O)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)C(C)C)[C@@H](C)O |r|
[H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](N(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC1=O)C(C)C)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@]([H])([C@@H](C)CC)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](N(C)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@]([H])([C@@H](C)CC)N(C)C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](CO)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@]([H])(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC1=O)[C@@H](C)CC)C(N)=O)[C@@H](C)CC |r|
[H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)NC(=O)[C@H](C)N)[C@@H](C)O |r|
[K;v0+].[#6]-[#6]-n1cc(nn1)-c1cc(ccn1)-[#6](-[#8-])=O
[K;v0+].[#6]-c1cccc(c1)-n1cc(nn1)-c1cc(ccn1)-[#6](-[#8-])=O
[K;v0+].[#6]-n1cc(nn1)-c1cc(ccn1)-[#6](-[#8-])=O
[K;v0+].[#8-]-[#6](=O)-c1ccnc(c1)-c1cn(-[#6]-c2ccccc2)nn1
[O-][N+](=O)c1ccc2NC(=O)CN=C(c3ccccc3)c2c1 |t:11|
[O-][N+](=O)c1cnn(c1)-c1ccccc1
[O-][n+]1nn(Cc2ccccc2)c(Br)c1Br
[O-][n+]1nn(Cc2ccccc2)c(C(=S)Nc2ccccc2)c1Cl
[O-][n+]1nn(Cc2ccccc2)cc1Br
[O-][n+]1nn(Cc2ccccc2)cc1Cl
[O-][n+]1nn(c(Br)c1Br)-c1ccccc1
[O-][n+]1nn(c(Br)c1Cl)-c1ccccc1
[O-][n+]1nn(c(Cl)c1Br)-c1ccccc1
[O-][n+]1nn(c(Cl)c1Cl)-c1ccccc1
c1cn[nH]c1