5923 SMILES Strings for Serine/threonine-protein kinase mTOR

Compound Name
SMILES String
CCN(CC)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:5.4,t:12|
CCN(CC)C=C1C2C(=O)C(=O)C3=C([C@H](O)C[C@]4(C)[C@@H](O)CCC34)[C@@]2(C)[C@@H](COC)OC1=O |r,w:5.4,t:12|
CCNC=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:3.2,t:10|
COC[C@H]1OC(=O)C(=CN(CCO)C(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:22|
COC[C@H]1OC(=O)C(=CN(C)C(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:20|
COC[C@H]1OC(=O)C(=CNC(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:19|
CCCCN(C)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:6.5,t:13|
COC[C@H]1OC(=O)C(=CN2CCCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:20|
COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C2CC[C@H](O)[C@@]2(C)C[C@H]1OC(C)=O)C3=O |r,t:16|
COC[C@H]1OC(=O)C(=CN(CC=C)CC=C)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)C3CCC4=O)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
COC[C@H]1OC(=O)C(=CN(C)CCCN(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:22|
COC[C@H]1OC(=O)C(=CNCCCN(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
COC[C@H]1OC(=O)C(=CN(C)CCCN(C)C)C2C(=O)C(=O)C3=C([C@H](O)C[C@]4(C)[C@@H](O)CCC34)[C@@]12C |r,w:8.8,t:22|
COC[C@H]1OC(=O)C(=CN(CCN(C)C)C(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:24|
COC[C@H]1OC(=O)C(=CN(CCN(C)C)Cc2ccccc2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:28|
COC[C@H]1OC(=O)C(=CN(C)CCN(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
CCN(CCN(C)C)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:8.7,t:15|
CCN(CCCN(C)C)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:9.8,t:16|
CCN(CC)CCN(C)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:9.8,t:16|
CCN(CC)CCN(CC)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O |r,w:10.9,t:17|
COC[C@H]1OC(=O)C(=CN(CCCN(C)C)CCCN(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:27|
COC[C@H]1OC(=O)C(=CN(C)CCCN2CCN(C)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:27|
COC[C@H]1OC(=O)C(=CN(C)CCCN2CCOCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:26|
COC[C@H]1OC(=O)C(=CN(C)CCCN2CCN(CC2)c2ccc(OC)cc2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:35|
COC[C@H]1OC(=O)C(=CN(C)N2CCC(C)C2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:23|
COC[C@H]1OC(=O)C(=CN(C)CC(=O)OC(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:24|
COC[C@H]1OC(=O)C(=CN(C)CCCC(O)=O)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:22|
COC[C@H]1OC(=O)C(=CN(CCO)CCO)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
COC[C@H]1OC(=O)C(=CN(C)CC(O)CO)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
COC[C@H]1OC(=O)C(=CN(CCC#N)Cc2ccccc2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:27|
COC[C@H]1OC(=O)C(=CN2CCN(CC2)C2CCN(C)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:29|
COC[C@H]1OC(=O)C(=CN2CCN(CC2)C2CCCCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:28|
COC[C@H]1OC(=O)C(=CN2CCN(Cc3ccccc3)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:29|
COC[C@H]1OC(=O)C(=CN2CCN(CC2)c2ccccc2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:28|
COC[C@H]1OC(=O)C(=CN2CCN(C)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:22|
COC[C@H]1OC(=O)C(=CN2CCN(CCCN(C)C)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:27|
COC[C@H]1OC(=O)C(=CN2CCN(CCN3CCOCC3)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:30|
COC[C@H]1OC(=O)C(=CN2CCN(CCCN3CCOCC3)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:31|
COC[C@H]1OC(=O)C(=CN2CCC(CC2)c2ccccc2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:28|
COC[C@H]1OC(=O)C(=CN2CCC(CC2)C(=O)OC)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:25|
COC[C@H]1OC(=O)C(=CN2CCC(CC2)C(O)=O)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:24|
COC[C@H]1OC(=O)C(=CN2CCC(CC2)N2CCCCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:28|
COC[C@H]1OC(=O)C(=CN2CCOCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
COC[C@H]1OC(=O)C(=CN2CCC(=O)CC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:22|
COC[C@H]1OC(=O)C(=CN2CCCCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C |r,w:8.8,t:21|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CC(=O)Nc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CCOC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
OCCOC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(C)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(C)=O)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)NC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)N(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)c3cccnc3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)OCCO)cc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CCOCC1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
CC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1cccc(O)c1)N1CCOCC1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)c3ccccc3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)c3cccnc3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1ccccc1-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cccnc1)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccncc1)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cnc2ccccc2c1)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2ncccc2c1)N1CCOCC1)c1ccccc1
O=c1[nH]c2ccc(cc2[nH]1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cc2ccccc2[nH]1)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cccc2[nH]ccc12)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2cc[nH]c2c1)N1CCOCC1)c1ccccc1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cccc2cc[nH]c12)N1CCOCC1)c1ccccc1
Cn1ccc2cc(ccc12)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
C1CC(CCN1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1
C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1cccnc1
O=C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1cccnc1
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Cn1ncc2c(nc(nc12)-c1cccc(O)c1)N1CCOCC1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C/C=C/C=C(C)/[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O |c:14,29,33,t:31|
Cc1ncnc(N2CCOC(C)(C)C2)c1C#Cc1ccc(N)nc1
COCCN1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCS(=O)CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC2)C2CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCCOCC2)c1C#Cc1ccc(N)nc1
CC(=O)N1CCCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
C[C@H]1CN(C[C@@H](C)O1)c1ncnc(C)c1C#Cc1ccc(N)nc1 |r|
Cc1ncnc(N2CCNC(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)C(C)(C)O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C2CCCCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
[#6]-[#6]-c1ncnc(-[#7]-2-[#6]-[#6]-[#6](-[#6]-[#6]-2)\[#6]=[#6](\[#6])-[#6])c1C#Cc1ccc(-[#7])nc1
CCc1ncnc(N2CCC(O)(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(Cc3ccccc3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CCO)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCC(C2)NC(C)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)NC(C)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CC2)OCCO3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(C)(O)CC2)c1C#Cc1ccc(N)nc1
CC(=O)NC1CCCN(C1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CC(=O)NC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC3(CC2)OCCO3)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(O)(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(O)(Cc3ccccc3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CCO)CC2)c1C#Cc1ccc(C)nc1
Cc1ncnc(N2CCC(CCO)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(F)(F)F)c1C#Cc1ccc(C)nc1
Cc1ncnc(N2CCC(O)(CC2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC)CC2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(O)(CC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(C)C)c1C#Cc1ccc(C)nc1
CCC1(O)CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OCCOC)c1C#Cc1ccc(N)nc1
COC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(COC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(C)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(F)(F)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CO)CC2)c1C#Cc1ccc(N)nc1
CCOC1CCN(CC1)c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCC(CO)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCOC(C)(C)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCS(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCS(=O)(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCNC(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCOC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(C)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(C)(CC2)OC)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC3(CC2)OCCCO3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CC2)OCCCO3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)(CC2)C(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(O)C(C)C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(=O)CC2)c1C#Cc1ccc(N)nc1
CC(C)C1(O)CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CC1CN(CCC1O)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1ccc(C)nc1
CCOC1CCN(CC1)c1ncnc(CC)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCCC(CO)C2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(CO)CC2)c1C#Cc1ccc(C)nc1
CCc1ncnc(N2CCC(C)(O)CC2)c1C#Cc1ccc(C)nc1
Cc1ncnc(N2CCC(O)(CC2)C2CCCCC2)c1C#Cc1ccc(N)nc1
CN1CCC2(CCN(CC2)c2ncnc(C)c2C#Cc2ccc(N)nc2)C1=O
Cc1cnc2CN(CCn12)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(C)C3=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCn3c(C)cnc3C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
CN1CCC2(CC1)CCN(CC2)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC(C)(C)O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CC2)CC(=O)NC(=O)C3)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(C)CC3)CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC3(CCNC3=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCNC3=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC(CC2)OC)c1C#Cc1ccc(NC)nc1
CCc1ncnc(N2CCC(O)CC2)c1C#Cc1ccc(NC)nc1
CN(C)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)CCN(C)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
COCCNC(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCNC(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CC(=O)N3CCOCC3)CC2)c1C#Cc1ccc(N)nc1
CCN(C)C(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)CCNC(=O)CC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCCCCC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CNC(=O)CC3CCCC3)CC2)c1C#Cc1ccc(N)nc1
CN(C)CC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
COCCC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCC(CNC(=O)C3CCCCC3)CC2)c1C#Cc1ccc(N)nc1
CC(C)CC(=O)NCC1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)NC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)c2ccccn2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)CC#N)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)C2CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)OC)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)c2ccco2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC2)C(=O)C2CCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(N2CCN(CC2)C(=O)c2ccno2)c1C#Cc1ccc(N)nc1
Cc1ccc(o1)C(=O)N1CCN(CC1)c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(CC3)C(C)=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(CC3)C(=O)COC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCN(CC3)C(=O)NC)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCCCC2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(N2CCc3ncccc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(CCCCC3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCNC(=O)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCC3(COC3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCn3c(COC)nnc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCN3CCOCC3)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2CCN(C)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3ncncc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(C)C(=O)C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCNS(C)(=O)=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CCCS(C)(=O)=O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3ccccc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3cc(OC)c(OC)cc3C2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccccc2C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC(C)O)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccccn2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccncc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2cccnc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)c2ncccn2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(CC2)C2COC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCc3c(C2)ncnc3N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(N2CCN(Cc3nc(C)c(C)o3)CC2)c1C#Cc1ccc(N)nc1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNCCO)cc1 |r|
COc1ccc(cc1C(N)=O)-c1ccc2c(nc(nc2n1)N1CCSCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1C(N)=O)-c1ccc2c(nc(nc2n1)N1CCN(C)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1C(N)=O)-c1ccc2c(nc(nc2n1)N1CCOCC1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(N)cc1 |r|
CCc1ncnc(-c2ccc(cc2)C(C)(C)C#N)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(C)(C)C#N)c1C#Cc1ccc(N)nc1
CCc1cc(ccn1)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(C)nc(C)c2)c1C#Cc1ccc(N)nc1
CNC(=O)c1ccc(cc1Cl)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cc1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccccc2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cc(ccc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cccc(c1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccccc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(F)c(c2)C(=O)N(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC)c(Cl)c2)c1C#Cc1ccc(C)nc1
CCc1ncnc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(C)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N(C)C)c1C#Cc1ccc(C)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C)c(F)c2)c1C#Cc1ccc(C)nc1
Cc1cc(ccn1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(nc2)C(F)(F)F)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2cnc3ccccc3c2)c1C#Cc1ccc(N)nc1
COc1ccc(cn1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ccc(cn1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(nc2)N2CCCCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(nc2)C2CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccnc(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cnc3ccccc3c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(OC)nc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C)nc2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccnc(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)N(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)C2CC2)c1C#Cc1ccc(N)nc1
CCN(CC)C(=O)c1cccc(c1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2cccc(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cc(Cl)cc(c1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(F)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(Cl)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(F)c(c2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(Cl)c(c2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
CNC(=O)c1cc(ccc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCN(CC)C(=O)c1cccc(c1)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(Cl)c(c2)C(=O)N(C)C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(F)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCN(CC)C(=O)c1cc(ccc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(Cl)c(c2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(Cl)c(c2)C(=O)NC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cccc(c2)C(=O)NC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCOC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCO)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCO)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCOC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(F)(F)F)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCO4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(=O)N(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCCOC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCOC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCO)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCOC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccn3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(F)(F)F)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNC(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)(F)F)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCO)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNC(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)C3CCC(C)(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-2.67,6.06,;-4,5.29,;-4,3.75,;-5.33,2.98,;-5.33,1.44,;-4,.67,;-2.67,1.44,;-1.33,.67,;-1.33,-.87,;0,-1.64,;1.33,-.87,;2.67,-1.64,;4,-.87,;2.67,-3.18,;1.33,-3.95,;1.33,-5.49,;2.67,-6.26,;3.44,-7.6,;1.9,-7.6,;4,-5.49,;4,-3.95,;1.33,.67,;2.67,1.44,;0,1.44,;-2.67,2.98,;-1.33,3.75,;0,4.52,;1.33,5.29,;1.33,6.83,;2.67,7.6,;4,6.83,;5.33,7.6,;4,5.29,;2.67,4.52,)|
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(CC3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)(F)F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CC3CCCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CC3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCC3(O)CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CC(C)(C)O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(F)c2)c1C#Cc1ccc(N)nc1C
CCCCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(=O)N(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCO4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccn3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccncc3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCS(=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)OC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCN(C)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(NC#N)=NC)c(F)c2)c1C#Cc1ccc(N)nc1 |w:23.24|
CCc1ncnc(-c2ccc(C(=O)N3CCCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOC(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC3)C(F)(F)F)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)(CC3)c3ccccc3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCC(C)N1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCC(CC)N1CCN(CC1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC[C@@H]3CO)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC(C)NC(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3[C@H]4C[C@@H]3N4C)c(F)c2)c1C#Cc1ccc(N)nc1 |r,THB:11:13:17:15|
CCc1ncnc(-c2ccc(C(=O)N3CCC[C@H]3CO)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCS(=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)OC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C)(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccncc3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3(C)COC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)c2ccccc2)c1C#Cc1ccc(N)nc1
COCCN1CCN(CC1)C(=O)c1ccc(cc1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN3CCCCC3C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CCS(=O)(=O)C2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CCOCC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CCO)CC2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CCCC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC(O)CN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-5.61,6.32,;-6.94,5.55,;-6.94,4.01,;-8.28,3.24,;-8.28,1.7,;-6.94,.93,;-5.61,1.7,;-4.28,.93,;-4.28,-.61,;-2.94,-1.38,;-1.61,-.61,;-.28,-1.38,;1.06,-.61,;-.28,-2.92,;1.06,-3.69,;1.46,-5.18,;2.94,-4.78,;2.55,-3.29,;4.28,-5.55,;4.28,-7.09,;5.61,-7.86,;6.94,-7.09,;8.28,-7.86,;6.94,-5.55,;5.61,-4.78,;-1.61,.93,;-.28,1.7,;-2.94,1.7,;-5.61,3.24,;-4.28,4.01,;-2.94,4.78,;-1.61,5.55,;-1.61,7.09,;-.28,7.86,;1.06,7.09,;2.39,7.86,;1.06,5.55,;-.28,4.78,)|
CCc1ncnc(-c2ccc(C(=O)NC3CCN(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCC[C@@H]1CNC(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)NC3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C)(C)N(C)C(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](O)C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCN(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-5.61,6.32,;-6.94,5.55,;-6.94,4.01,;-8.28,3.24,;-8.28,1.7,;-6.94,.93,;-5.61,1.7,;-4.28,.93,;-4.28,-.61,;-2.94,-1.38,;-1.61,-.61,;-.28,-1.38,;1.06,-.61,;-.28,-2.92,;1.06,-3.69,;1.46,-5.18,;2.94,-4.78,;2.55,-3.29,;4.28,-5.55,;4.28,-7.09,;5.61,-7.86,;6.94,-7.09,;8.28,-7.86,;6.94,-5.55,;5.61,-4.78,;-1.61,.93,;-.28,1.7,;-2.94,1.7,;-5.61,3.24,;-4.28,4.01,;-2.94,4.78,;-1.61,5.55,;-1.61,7.09,;-.28,7.86,;1.06,7.09,;2.39,7.86,;1.06,5.55,;-.28,4.78,)|
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCCCC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-4.94,6.32,;-6.28,5.55,;-6.28,4.01,;-7.61,3.24,;-7.61,1.7,;-6.28,.93,;-4.94,1.7,;-3.61,.93,;-3.61,-.61,;-2.28,-1.38,;-.94,-.61,;.39,-1.38,;1.72,-.61,;.39,-2.92,;1.72,-3.69,;2.12,-5.18,;3.61,-4.78,;3.21,-3.29,;4.94,-5.55,;4.94,-7.09,;6.28,-7.86,;7.61,-7.09,;7.61,-5.55,;6.28,-4.78,;-.94,.93,;.39,1.7,;-2.28,1.7,;-4.94,3.24,;-3.61,4.01,;-2.28,4.78,;-.94,5.55,;-.94,7.09,;.39,7.86,;1.72,7.09,;3.06,7.86,;1.72,5.55,;.39,4.78,)|
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCC(CC3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-6.8,7.33,;-8.13,6.56,;-8.13,5.02,;-9.46,4.25,;-9.46,2.71,;-8.13,1.94,;-6.8,2.71,;-5.46,1.94,;-5.46,.4,;-4.13,-.37,;-2.79,.4,;-1.46,-.37,;-.13,.4,;-1.46,-1.91,;-.13,-2.68,;.27,-4.17,;1.76,-3.77,;1.36,-2.28,;3.09,-4.54,;3.09,-6.08,;4.43,-6.85,;5.76,-6.08,;5.76,-4.54,;4.43,-3.77,;7.09,-6.85,;7.09,-8.39,;8.56,-8.87,;9.46,-7.62,;8.56,-6.38,;-2.79,1.94,;-1.46,2.71,;-4.13,2.71,;-6.8,4.25,;-5.46,5.02,;-4.13,5.79,;-2.8,6.56,;-2.8,8.1,;-1.46,8.87,;-.13,8.1,;1.21,8.87,;-.13,6.56,;-1.46,5.79,)|
CCc1ncnc(-c2ccc(C(=O)NC3CC(C3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1 |(-4.8,6.17,;-6.13,5.4,;-6.13,3.86,;-7.46,3.09,;-7.46,1.55,;-6.13,.78,;-4.8,1.55,;-3.46,.78,;-3.46,-.76,;-2.13,-1.53,;-.79,-.76,;.54,-1.53,;1.87,-.76,;.54,-3.07,;1.87,-3.84,;2.27,-5.33,;3.76,-4.93,;3.36,-3.44,;5.09,-5.7,;5.09,-7.24,;6.56,-7.71,;7.46,-6.47,;6.56,-5.22,;-.79,.78,;.54,1.55,;-2.13,1.55,;-4.8,3.09,;-3.46,3.86,;-2.13,4.63,;-.79,5.4,;-.79,6.94,;.54,7.71,;1.87,6.94,;3.21,7.71,;1.87,5.4,;.54,4.63,)|
CCc1ncnc(-c2ccc(C(=O)NC3CCN(C3)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCCC3=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3(C)COC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N2CCCO2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N2CCCCO2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N2CC(O)CO2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(cc2)C(=O)N(C)OC)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCCO3)c(F)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(F)c2)c1C#Cc1ccc(N)nc1
CON(C)C(=O)c1ccc(cc1F)-c1ncnc(C)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CCCCO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CON(C)C(=O)c1ccc(cc1Cl)-c1ncnc(C)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCN(CC)C1CCN(C1)C(=O)c1ccc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(nc2)C(=O)N2CCN(C)CC2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1c(F)cc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCCN1CCN(CC1)C(=O)c1c(F)cc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC4CC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NCCN3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3C[C@H]4C[C@@H]3CN4C)c(F)c2)c1C#Cc1ccc(N)nc1 |r,THB:20:19:13.14:16,11:13:18.19:16|
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)OCCCO4)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)CC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(C3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)CC4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)C4)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCCCN1CCN(CC1)C(=O)c1ccc(cc1C)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(O)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC(O)CO3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCO3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCC(C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N3CCC(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)CC4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCS(=O)(=O)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)OC)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCS(=O)(=O)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)S(=O)(=O)CC)c(C)c2)c1C#Cc1ccc(N)nc1
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1C)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)CCN3CCCC3=O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CCN(C)C4)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CCCCC4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ccccc4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)OCCCO4)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)OC)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C3CCN(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NC3CCCN(C)C3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCS(=O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(C)(O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](O)C3)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](O)C3)c(C)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCC(C3)N(C)C)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCNCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)O)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCN(C)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccn3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccncc3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCCOCC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3(C)COC3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)c3ccccc3)c(C)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCC[C@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCCC[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4ccnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4cnnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4c(C)cnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(COC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4ccnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4cnnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4c(C)cnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(COC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CNC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CNC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4c(COC)nnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(COC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC#C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(F)(F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCCN3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)NCC3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N(C)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCn4c(COC)nnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N(C)CCN(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC#C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(F)(F)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NCCN3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)NCC3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N(C)C3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(F)F)CC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(NC)nc1 |r|
CCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC[C@@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN4CCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(C)C(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CC[C@H](C3)N(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1c(Cl)cc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CC(C)(C)O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(CC3)C(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CC(F)F)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(C)(O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CC3)C=O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC(CO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCN(CCC#N)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN4CCC[C@H]4C3)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C(=O)C3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CC[C@H](C3)N(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCN1CCN(CC1)C(=O)c1c(F)cc(cc1F)-c1ncnc(CC)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC(C)(C)O)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)C(C)O)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)C(C)(C)O)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)N3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC(F)F)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(C)(O)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C=O)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CO)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCC#N)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CC[C@H](C3)N(C)C)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1OC(F)(F)F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(OC(F)(F)F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)CC3)c(c2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(c2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1C(F)(F)F)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CC3)C(C)(C)O)c(c2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)C)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1c(F)cc(cc1Cl)-c1ncnc(CC)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)C(C)(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN4CCC[C@H]4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C(=O)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC(C)(C)O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CC3)C(C)O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCC#N)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4c(C)cnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4cnnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4ccnc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CNC4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCNS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4c(C)cnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4cnnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCn4ccnc4C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCCS(C)(=O)=O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCN(CCCS(C)(=O)=O)CC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCC(CC2)N2CCOCC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCn3ccnc3C2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCn3cnnc3C2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCn3c(C)cnc3C2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCC3(COC3)CC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCN(CCNS(C)(=O)=O)CC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCN(CC2)C2CCC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CCC3(CN(C3)C(=O)OC(C)(C)C)CC2)c(F)c1
CCNc1ccc(cn1)C#Cc1c(CC)ncnc1-c1ccc(C(=O)N2CC3(CN(C3)C(=O)OC(C)(C)C)C2)c(F)c1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CNC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC4(CNC4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC4(CNC4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3COC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3COC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC(CN(C)C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3COC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3COC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2ccc(C(=O)N3CCC(CN(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3COC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CN(C)C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCN)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC(CN)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCN)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC4(CN(C)C4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CC4(CN(C)C4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CC4(CN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4cc(C)no4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)COC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)CO)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4nc(C)c(C)o4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCc4ncccc4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(C)O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(Cc4cc(C)no4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)COC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)CO)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(Cc4nc(C)c(C)o4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCCC3O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCOCCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CC(=O)CO4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(Cc4cc(C)no4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)COC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C(C)CO)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(Cc4nc(C)c(C)o4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC3)C3CCCC3O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CC(C)O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(CCOCCO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CC(=O)CO4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4cc(C)no4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)COC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C(C)CO)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4nc(C)c(C)o4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3O)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(C)O)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOCCO)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC(C4)NC(=O)OC(C)(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC(N)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)CN(CCO4)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CC3)CNCCO4)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CN(C4)C(=O)OC(C)(C)C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CNC4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOC4(CCN(CC4)C(=O)OC(C)(C)C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCOC4(CCNCC4)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(C3)CCN(CC4)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(C3)CCNCC4)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CN(C[C@@H]4C3)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CNC[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CCN([C@@H]4C3)C(=O)OC(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3C[C@@H]4CCN[C@@H]4C3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CC4(CN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CC4(CN(C)C4)C3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(Cl)c(C(=O)N3CCC4(CN(C)C4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CN(C)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCC4(CN(C)C4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CN(C)C4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCC4(CN(C)C4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C[C@H]3C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2cc(F)c(C(=O)N3CCN(C)C[C@@H]3C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ncon4)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@H]3C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@@H]3C)c(Cl)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(CCOCCO)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(Cc4ncon4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@H]3C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(C)C[C@@H]3C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1ncnc(-c2ccc(C(=O)N3CCN(CC(C)(C)O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccccn12
Cc1nc2ccc(Br)cn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(Br)cn12
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1ccncc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1cccnc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)N1CCOCC1
COc1cc(cnc1OC)-c1cnc2ccccn12
COc1cc(cnc1OC)-c1cnc2ccc(Br)cn12
COc1cc(cnc1OC)-c1cnc2ccc(cn12)-c1ccncc1
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1CCOC1=O
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1[C@H](Cc2ccccc2)COC1=O |r|
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1[C@@H](Cc2ccccc2)COC1=O |r|
COc1cc(cnc1OC)-c1cnc2ccc(cn12)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccn(Cc3ccccc3)c(=O)n12
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1ccncc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(cn12)-c1ccnc(c1)C(F)(F)F
CS(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(ccn12)-c1cccnc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(ccn12)-c1ccncc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(ccn12)-c1cccnc1
CN(C)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2cc(C)c(cn12)-c1ccncc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ncccn12
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cnc2ccc(Cl)nn12
CC(=O)Nc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cn1
Nc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cn1
N(c1cccc2n[nH]cc12)c1ncccc1-c1ncnc2nc[nH]c12
N(c1cccc2[nH]ccc12)c1ncccc1-c1ncnc2[nH]cnc12
COc1ccc(Nc2ncccc2-c2ncnc3nc[nH]c23)cn1
Nc1cc(nc(n1)C(F)(F)F)-c1cccnc1Nc1cccc2[nH]ncc12
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc2[nH]ccc12
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc(O)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc2[nH]ncc12
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)cc(n1)-c1cccnc1Nc1cccc(O)c1
Cc1nc(N)cc(n1)-c1cccnc1Nc1cccc2[nH]ncc12
Cc1nc(N)c(F)c(n1)-c1cccnc1Nc1cccc2[nH]ncc12
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cccc(O)c1
COc1ccc(Nc2ncc(C)cc2-c2nc(C)nc(N)n2)cn1
Cc1cnc(Nc2cccnc2)c(c1)-c1nc(C)nc(N)n1
COc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2ncnc(C)n2)cn1
Cc1nc(nc(n1)N)c2cc(cnc2Nc3ccc(nc3)OC)CN4CCN(CC4)S(=O)(=O)C
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cccc2[nH]ncc12
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(nc1)C(F)(F)F
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cncnc1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ncoc2c1
COc1ncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
COc1ccc(Nc2ncc(CN3CCNCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cn1
Cc1cnc(Nc2cccc3[nH]ccc23)c(c1)-c1nc(C)nc(N)n1
Cc1cnc(Nc2cccc3[nH]ncc23)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(Br)cc2-c2nc(C)nc(N)n2)cn1
CCOc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(N)nc1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(Cl)nc1
Cc1nc(-c2cccnc2Nc2cccc3n[nH]cc23)c2c[nH]nc2n1
Cc1nc(-c2cccnc2Nc2cccc3[nH]ccc23)c2[nH]cnc2n1
Cc1nc(-c2cccnc2Nc2cccc3n[nH]cc23)c2[nH]cnc2n1
COc1ccc(Nc2ncccc2-c2nc(C)nc3nc[nH]c23)cn1
Cc1nc(-c2cc(Cl)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
Cc1nc(-c2cc(Br)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
Cc1nc(-c2cc(cnc2Nc2cccc3[nH]ncc23)C(F)(F)F)c2nc[nH]c2n1
COc1ncc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(COCc2cnc(Nc3cccc4[nH]ccc34)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
Cc1nc(-c2cc(CO)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
COc1ccc(Nc2ncc(C=C)cc2-c2nc(C)nc3[nH]cnc23)cn1
CCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc2[nH]cnc12
COc1ccc(Nc2ncc(CCO)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(NCc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
COc1cccc(NCc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)c1
Cc1nc(Cl)nc(Cl)n1.Clc1nc(Cl)nc(Cl)n1.COc1ccc(CNc2nc(C)nc(Cl)n2)cc1.COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(Cl)n2)cc1
COc1ccc(Nc2ncc(CNc3cccnn3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNc3ccncc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNc3ccccn3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCNCC3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
COC(=O)N1CCN(Cc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)CC1
COc1ccc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(=O)(=O)N(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)C(C)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
COc1ccc(Nc2ncc(NCc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(Nc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COCCNc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc2[nH]cnc12
CCNc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc2[nH]cnc12
COc1ccc(CNc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)cc1
COc1cccc(Nc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc3[nH]cnc23)c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCOCC2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCC(O)C2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCC[C@H]2CO)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CCC[C@@H]2CO)cn1 |r|
CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cc1
COc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(-c2cc(Cc3ccc(cc3)S(C)(=O)=O)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
CC(=O)Nc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(-c2cc(Cc3ccc(cc3)S(C)(=O)=O)cnc2Nc2ccc(N)nc2)c2nc[nH]c2n1
Cc1nc(N)cc(n1)-c1cnccc1Nc1cccc2[nH]ncc12
CC(=O)Nc1cc(nc(C)n1)-c1cnccc1Nc1cccc2[nH]ccc12
Cc1nc(N)cc(n1)-c1cnccc1Nc1cccc2[nH]ccc12
Cc1nc(-c2cnccc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
COc1ccc(Nc2ccncc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(N)cc(n1)-c1nccnc1Nc1cccc2[nH]ncc12
COc1ccc(Nc2nc3ccccc3cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2nccnc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2cnccc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nccnc2-c2cc(N)nc(C)n2)cn1
COc1ccc(Nc2ncncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nc(N)ncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nc(OC)ncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N2CCOCC2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N(C)C)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N2CCCC2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)N2CCCCC2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)-c2ccncc2)cn1
COc1ccc(Nc2nc(ncc2-c2nc(C)nc(N)n2)-c2ccc(F)cc2)cn1
COc1ccc(Nc2nc(NC3CCCC3)ncc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc3[nH]cnc23)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ocnc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCOCC2)cnc1Nc1ccc2scnc2c1
COc1ncc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(O)C(C)(C)C)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](O)C(C)(C)C)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@H](O)C(C)(C)C)cn1 |r|
COc1ccc(Nc2ncc(CNC(C)(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNC(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNCc3ccccn3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNCc3ccncc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(CNCc3cccnc3)cc2-c2nc(C)nc3[nH]cnc23)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(O)c2ccc(cc2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(CC2)S(C)(=O)=O)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cn1 |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)c2ccc(cc2)S(C)(=O)=O)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)c2ccc(cc2)S(C)(=O)=O)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(=O)N2CCOCC2)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(=O)N2CCN(CC2)S(C)(=O)=O)cc1F
COCCNC(=O)c1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCOCC3=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CC3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(Cc3ccccc3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(C)CC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(C[C@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cc1F
CN(C)C(=O)N1CCN(Cc2cnc(Nc3cnc(O)c(F)c3)c(c2)-c2nc(C)nc(N)n2)CC1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cnc(O)c(F)c1
COc1cncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)c1
CNc1nc(C)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(OC)nc1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cccc(OC(F)F)c1
Cc1nc2cc(Nc3ncccc3-c3nc(C)nc(N)n3)ccc2o1
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1F
COc1cc(Nc2ncccc2-c2nc(C)nc(N)n2)ccc1F
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc2OC(F)(F)Oc2c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccc(OC)nc2)cn1
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1OC
Cc1ccc2cc(Nc3ncccc3-c3nc(C)nc(N)n3)ccc2n1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccccn2)cn1
COc1ncc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1Cl
Cc1cncc(Nc2ncccc2-c2nc(C)nc(N)n2)c1
COc1ncc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2ccncc2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(=O)N2CCC(O)CC2)cc1F
COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2cc(N)nc(C)n2)cn1
COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)cc(n1)-c1nc2ccccc2nc1Nc1cccc2[nH]ncc12
CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cc1Cl
Cc1nc(-c2cccnc2Nc2ccc(NC(=O)C3CC3)cc2)c2nc[nH]c2n1
COc1cncc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)c1
COc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2ncc(F)cc2-c2nc(C)nc(N)n2)cc1F
Cc1nc(N)nc(n1)-c1cc(F)cnc1Nc1cncc(F)c1
COc1ncc(Nc2ncc(C=O)cc2-c2nc(C)nc(N)n2)cc1F
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1NC1CCOCC1
COCCNc1nc(C)nc(n1)-c1cc(Cl)cnc1Nc1cnc(OC)c(F)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(NC(=O)Nc2ccccc2)nc1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(NC(=O)Nc2cccc(F)c2)nc1
CC(C)NC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1
CC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1
COC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1
COCCOc1ccc(NC(=O)Nc2ccc(Nc3ncc(Cl)cc3-c3nc(C)nc(N)n3)cn2)cc1
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2nc(C)ccc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2nc(CN3CCOCC3)ccc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2nc(COCC(F)(F)F)ccc2-c2nc(C)nc(N)n2)cc1F
Cc1ccc(c(Nc2cncc(F)c2)n1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCSCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCS(=O)CC3)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cnc2n(C)cnc2c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CC[C@H](CO)C2)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CC[C@H](O)C2)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)N2CC[C@@H](O)C2)cn1 |r|
COc1ncc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)S(=O)(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCC(O)CC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC[C@@H](CO)C3)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ccc(Nc2ncc(CN3CCOC[C@@H]3C)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ccc(Nc2ncc(CN3CCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCCCC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCC(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CNCCO)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN[C@H](C)CO)cc2-c2nc(C)nc(N)n2)cn1 |r|
COCCNCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2ncc(CN3CCC(C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(O)C3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC4(C3)NC(=O)NC4=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(N)C3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CC(C3)NS(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCn4ncnc4C3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)c2cc(Br)ccc2S(=O)(=O)N(C)C)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)c2ccc(cc2)S(=O)(=O)N(C)C)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N)c2ccc(cc2)S(=O)(=O)N(C)C)cn1
COc1ccc(Nc2nc3ccccc3cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ccccc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2scnc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ncsc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cncc(F)c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cn[nH]c1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cc[nH]n1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cc(F)cc2[nH]ncc12
COc1ncc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2cnn(C)c2)cn1
Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(F)c(F)c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCNCC2)cn1 |t:23|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2cn[nH]c2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccc(C)nc2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2ccnnc2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)-c2cncc(F)c2)cn1
COc1ccc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2cccnc2)cn1
COc1ncc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2cccnc2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCOCC2)cn1 |t:23|
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cncc(F)c1
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(F)c1)-c1cnn(C)c1
COCCOc1ccc(c(Nc2cnc(OC)c(F)c2)n1)-c1nc(C)nc(N)n1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2[nH]cnc2c1
Cc1nc(N)nc(n1)-c1cc(CN2CCNCC2)cnc1Nc1ccc2[nH]cnc2c1
COc1ccc(Nc2ncc(OC(F)F)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cc[nH]c(=O)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(N)c1
CC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cc1F
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](O)C(F)(F)F)cn1.COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](O)C(F)(F)F)cn1 |r|
COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1F
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@H](C)N2CCOCC2)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCOCC2)cc1F |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCN(CC2)S(C)(=O)=O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCOCC2)cc1F
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(CC2)N2CCN(CC2)S(C)(=O)=O)cn1
COc1ncc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cc1F
COc1ncc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)(C)O)cc1F
COc1ccc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)=O)cn1
COc1ccc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
C[C@@H](N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2cc(F)c3cccnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
CC(N1CCOCC1)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCN(CC1)C(=O)N(C)C)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCOCC2)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCOCC2)cc1F |r|
C[C@@H](N1CCN(C[C@@H]1C)S(C)(=O)=O)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)C(=O)N(C)C)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(O)CC2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)NC(C)C)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(N)CC2)cc1F
CCC(N)(CC)c1cnc(Nc2cnc(OC)c(F)c2)c(c1)-c1nc(C)nc(N)n1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1C(C)C |r|
CCS(=O)(=O)c1cnc(Nc2cnc(OC)c(F)c2)c(c1)-c1nc(C)nc(N)n1
Cc1nc(N)cc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
Cc1nc(N)cc(n1)-c1nccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CC(C2)S(C)(=O)=O)cn1
C[C@@H](N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2ccc(Cl)nc2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@@H](N1CCN(CC1)S(C)(=O)=O)c1cnc(Nc2ccc3cccnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)CO)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)CO)cc1F
COc1ncc(Nc2ncc(CN3CCN(CC3C(F)(F)F)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)C(F)(F)F)cc1F
COc1ncc(Nc2ncc(CN3CCOC[C@@H]3C)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1ncc(Nc2ncc(CN3CCN(C[C@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1cc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cnc1Cl |r|
C[C@H]1CN(CCN1Cc1cnc(Nc2ccc(Cl)nc2)c(c1)-c1nc(C)nc(N)n1)S(C)(=O)=O |r|
COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(O)C(F)(F)F)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](O)C(F)(F)F)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](O)C(F)(F)F)cn1 |r|
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N)C(F)(F)F)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc2ccncc2c1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N)cc1F
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1)C1CCOCC1
COc1ncc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cc1NS(C)(=O)=O
COc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
COc1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1
Cc1nc(N)nc(n1)-c1cc(CN2CCOCC2)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C(F)(F)F)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F.COc1ncc(Nc2ncc(CN3CCN(C[C@H]3C(F)(F)F)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
COc1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N3CCOCC3)c2)c(c1)-c1nc(C)nc(N)n1
COCCOc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
COCCOc1cnc(Nc2cnc(OC)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
COc1ncc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1NS(C)(=O)=O
Cc1nc(-c2cccnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c2nc[nH]c2n1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc2[nH]cnc12 |w:1.0|
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc2[nH]cnc12 |w:1.0|
COc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cnc1Cl |r|
COc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cnc1Cl
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCOCC2)cc1F |t:23|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2CCOCC2)cc1F
COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)C(C)(C)O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)C(O)=O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)C(C)(C)O)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1C(F)(F)F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)O)cc1F
COc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cnc1OC
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(OC(=O)c2cccc(Cl)c2)C(C)(C)O)cc1F
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(F)c1)C(C)(C)O
COc1cncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)c1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1C
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(c1)S(C)(=O)=O)C(C)(C)O
Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cncc(c1)S(=O)(=O)c1ccccc1)C(C)(C)O
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C(C)C)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)CC(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C3CC3)cc2-c2nc(C)nc(N)n2)cc1F
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@H]2C)S(C)(=O)=O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cn1 |r|
C[C@@H](N1CCN(C[C@@H]1C)S(C)(=O)=O)c1cnc(Nc2ccc(Cl)nc2)c(c1)-c1nc(C)nc(N)n1 |r|
COc1ncc(Nc2ncc(CN3CCN([C@H](C)C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)C2CC2)c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)N2CCOCC2)c1
CC(C)N(C)S(=O)(=O)Nc1cc(Nc2ncccc2-c2nc(C)nc(N)n2)cnc1Cl
COc1cnc(Nc2cnc(Cl)c(N)c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1
C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1 |r|
C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1 |r|
CN(C)S(=O)(=O)Nc1cc(Nc2ncccc2-c2cc(N)nc(C)n2)cnc1Cl
COCCOc1cnc(Nc2cnc(C)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(C)c(NS(C)(=O)=O)c1
Cc1nc(N)nc(n1)-c1cc(Cl)cnc1Nc1cnc(C)c(NS(C)(=O)=O)c1
CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1cc(N)nc(C)n1
Cc1nc(N)cc(n1)-c1cc(C=C)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1cc(N)nc(C)n1 |r|
C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1cc(N)nc(C)n1 |r|
COc1ncc(Nc2ncc(CN3CCN4C(CCS4(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cc1F
CN(C)S(=O)(=O)Nc1cc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cnc1Cl
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cc1F)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cc1F)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3[nH]c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
O=C(OCc1ccccc1)C1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)[nH]c1=O |(-1.5,.55,;-.01,.95,;.39,2.44,;-.7,3.53,;-.3,5.02,;1.18,5.41,;1.58,6.9,;.49,7.99,;-.99,7.59,;-1.39,6.1,;1.08,-.14,;2.56,.26,;3.65,-.83,;3.26,-2.32,;1.77,-2.71,;.68,-1.62,;4.34,-3.4,;4.02,-4.91,;5.36,-5.68,;5.36,-7.22,;4.02,-7.99,;2.69,-7.22,;1.36,-7.99,;.02,-7.22,;.02,-5.68,;1.36,-4.91,;2.69,-5.68,;-1.31,-4.91,;-1.31,-3.37,;-2.64,-2.6,;-3.98,-3.37,;-5.31,-2.6,;-6.65,-3.37,;-6.65,-4.91,;-5.31,-5.68,;-3.98,-4.91,;-2.64,-5.68,;6.5,-4.65,;5.88,-3.24,;6.65,-1.91,)|
Cn1c2cnc3ccc(nc3c2n(C2CCC(CC2)C(=O)OCc2ccccc2)c1=O)-c1cnc2ccccc2c1 |(7.32,-5.05,;5.83,-4.65,;4.69,-5.68,;4.69,-7.22,;3.35,-7.99,;2.02,-7.22,;.68,-7.99,;-.65,-7.22,;-.65,-5.68,;.68,-4.91,;2.02,-5.68,;3.35,-4.91,;3.67,-3.4,;2.58,-2.32,;2.98,-.83,;1.89,.26,;.41,-.14,;.01,-1.62,;1.1,-2.71,;-.68,.95,;-2.17,.55,;-.29,2.44,;-1.37,3.53,;-.98,5.02,;.51,5.41,;.91,6.9,;-.18,7.99,;-1.67,7.59,;-2.06,6.1,;5.2,-3.24,;5.97,-1.91,;-1.98,-4.91,;-1.98,-3.37,;-3.32,-2.6,;-4.65,-3.37,;-5.98,-2.6,;-7.32,-3.37,;-7.32,-4.91,;-5.98,-5.68,;-4.65,-4.91,;-3.32,-5.68,)|
O=c1[nH]c2cnc3ccc(nc3c2n1C1CCNCC1)-c1cnc2ccccc2c1
CCN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
COC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CCNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CC(C)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CN(C)CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CCOC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CC(C)OC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(Cc4ccccc4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:19.19,wD:22.26,(-6.65,-.2,;-5.31,.57,;-3.98,-.2,;-3.98,-1.74,;-2.64,-2.51,;-1.31,-1.74,;-1.31,-.2,;-2.64,.57,;.02,-2.51,;.02,-4.05,;1.36,-4.82,;2.69,-4.05,;4.02,-4.82,;5.36,-4.05,;5.36,-2.51,;6.5,-1.48,;5.88,-.07,;6.65,1.26,;4.34,-.23,;3.26,.86,;1.77,.46,;.68,1.55,;1.08,3.04,;2.56,3.44,;3.65,2.35,;-.01,4.13,;-1.5,3.73,;-2.59,4.82,;-4.08,4.42,;4.02,-1.74,;2.69,-2.51,;1.36,-1.74,)|
COc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:19.19,wD:22.23,(-6.65,.15,;-5.31,.92,;-3.98,.15,;-3.98,-1.39,;-2.64,-2.16,;-1.31,-1.39,;-1.31,.15,;-2.64,.92,;.02,-2.16,;.02,-3.7,;1.36,-4.47,;2.69,-3.7,;4.02,-4.47,;5.36,-3.7,;5.36,-2.16,;6.5,-1.13,;5.88,.28,;6.65,1.61,;4.34,.12,;3.26,1.2,;1.77,.81,;.68,1.89,;1.08,3.38,;-.01,4.47,;2.56,3.78,;3.65,2.69,;4.02,-1.39,;2.69,-2.16,;1.36,-1.39,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:20.20,wD:23.27,(17.65,-10.2,;18.98,-9.43,;20.31,-10.2,;20.31,-11.74,;21.64,-12.51,;22.98,-11.74,;22.98,-10.19,;21.64,-9.43,;24.32,-12.51,;24.31,-14.05,;25.64,-14.81,;26.97,-14.04,;28.31,-14.81,;29.65,-14.03,;29.63,-12.48,;30.76,-11.45,;32.27,-11.76,;30.13,-10.05,;30.9,-8.71,;28.61,-10.22,;27.8,-8.92,;26.26,-8.97,;25.44,-7.67,;26.17,-6.31,;27.71,-6.25,;28.52,-7.56,;25.35,-5,;26.07,-3.64,;25.25,-2.34,;25.98,-.97,;28.3,-11.72,;26.97,-12.49,;25.63,-11.73,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:20.20,wD:23.24,(32.03,-7.87,;33.36,-7.1,;34.69,-7.87,;34.69,-9.41,;36.03,-10.18,;37.36,-9.41,;37.36,-7.86,;36.02,-7.1,;38.7,-10.18,;38.69,-11.72,;40.02,-12.49,;41.35,-11.71,;42.69,-12.48,;44.03,-11.7,;44.01,-10.15,;45.14,-9.12,;46.65,-9.43,;44.51,-7.72,;45.28,-6.39,;42.99,-7.89,;42.18,-6.59,;40.64,-6.65,;39.83,-5.35,;40.55,-3.98,;39.73,-2.68,;42.09,-3.93,;42.9,-5.23,;42.68,-9.39,;41.35,-10.17,;40.02,-9.41,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)C)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN(C)C)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(N)=O)CC4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC(F)(F)F)CC2)c1=O)-c1cnc2ccccc2c1
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(OC)nc2)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)C(C)(C)O)c1=O)-c1cnc2ccccc2c1
CN(C)CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)C(C)(C)N)c1=O)-c1cnc2ccccc2c1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnc2ccccc2c1 |r,wU:13.14,wD:16.18,(7.32,-1.53,;5.83,-1.13,;4.69,-2.16,;4.69,-3.7,;3.35,-4.47,;2.02,-3.7,;.68,-4.47,;-.65,-3.7,;-.65,-2.16,;.68,-1.39,;2.02,-2.16,;3.35,-1.39,;3.67,.12,;2.58,1.2,;1.1,.81,;.01,1.89,;.41,3.38,;-.68,4.47,;1.89,3.78,;2.98,2.69,;5.2,.28,;5.97,1.61,;-1.98,-1.39,;-1.98,.15,;-3.32,.92,;-4.65,.15,;-5.98,.92,;-7.32,.15,;-7.32,-1.39,;-5.98,-2.16,;-4.65,-1.39,;-3.32,-2.16,)|
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@@H](CC2)OCCO)c1=O)-c1cnc2ccccc2c1 |r,wU:13.14,wD:16.21,(7.32,-1.87,;5.83,-1.48,;4.69,-2.51,;4.69,-4.05,;3.35,-4.82,;2.02,-4.05,;.68,-4.82,;-.65,-4.05,;-.65,-2.51,;.68,-1.74,;2.02,-2.51,;3.35,-1.74,;3.67,-.23,;2.58,.86,;1.1,.46,;.01,1.55,;.41,3.04,;1.89,3.44,;2.98,2.35,;-.68,4.13,;-2.17,3.73,;-3.26,4.82,;-4.75,4.42,;5.2,-.07,;5.97,1.26,;-1.98,-1.74,;-1.98,-.2,;-3.32,.57,;-4.65,-.2,;-5.98,.57,;-7.32,-.2,;-7.32,-1.74,;-5.98,-2.51,;-4.65,-1.74,;-3.32,-2.51,)|
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:20.20,wD:23.27,(-7.32,-.2,;-5.98,.57,;-4.65,-.2,;-4.65,-1.74,;-3.32,-2.51,;-1.98,-1.74,;-1.98,-.2,;-3.32,.57,;-.65,-2.51,;-.65,-4.05,;.68,-4.82,;2.02,-4.05,;3.35,-4.82,;4.69,-4.05,;4.69,-2.51,;5.83,-1.48,;7.32,-1.87,;5.2,-.07,;5.97,1.26,;3.67,-.23,;2.58,.86,;1.1,.46,;.01,1.55,;.41,3.04,;1.89,3.44,;2.98,2.35,;-.68,4.13,;-2.17,3.73,;-3.26,4.82,;-4.75,4.42,;3.35,-1.74,;2.02,-2.51,;.68,-1.74,)|
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:21.21,wD:24.28,(-7.32,-.2,;-5.98,.57,;-5.98,2.11,;-4.65,-.2,;-4.65,-1.74,;-3.32,-2.51,;-1.98,-1.74,;-1.98,-.2,;-3.32,.57,;-.65,-2.51,;-.65,-4.05,;.68,-4.82,;2.02,-4.05,;3.35,-4.82,;4.69,-4.05,;4.69,-2.51,;5.83,-1.48,;7.32,-1.87,;5.2,-.07,;5.97,1.26,;3.67,-.23,;2.58,.86,;1.1,.46,;.01,1.55,;.41,3.04,;1.89,3.44,;2.98,2.35,;-.68,4.13,;-2.17,3.73,;-3.26,4.82,;-4.75,4.42,;3.35,-1.74,;2.02,-2.51,;.68,-1.74,)|
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(F)(F)F)CC4)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(F)(F)F)CC4)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)OCCO)c3c2n1 |r,wU:19.19,wD:22.26,(-6.65,.57,;-5.32,-.2,;-5.32,-1.74,;-3.98,-2.51,;-2.65,-1.74,;-2.65,-.2,;-3.98,.57,;-1.32,-2.51,;-1.32,-4.05,;.02,-4.82,;1.35,-4.05,;2.69,-4.82,;4.02,-4.05,;4.02,-2.51,;5.16,-1.48,;6.65,-1.87,;4.54,-.07,;5.31,1.26,;3.01,-.23,;1.92,.86,;.43,.46,;-.66,1.55,;-.26,3.04,;1.23,3.44,;2.31,2.35,;-1.35,4.13,;-2.84,3.73,;-3.93,4.82,;-5.41,4.42,;2.69,-1.74,;1.35,-2.51,;.02,-1.74,)|
COCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)C(N)=O)c3c2n1 |r,wU:20.20,wD:23.27,(-7.32,-.59,;-5.98,.18,;-4.65,-.59,;-4.65,-2.13,;-3.32,-2.9,;-1.98,-2.13,;-1.98,-.59,;-3.32,.18,;-.65,-2.9,;-.65,-4.44,;.68,-5.21,;2.02,-4.44,;3.35,-5.21,;4.69,-4.44,;4.69,-2.9,;5.83,-1.87,;7.32,-2.27,;5.2,-.47,;5.97,.87,;3.67,-.63,;2.58,.46,;1.1,.06,;.01,1.15,;.41,2.64,;1.89,3.04,;2.98,1.95,;-.68,3.73,;-2.17,3.33,;-.29,5.21,;3.35,-2.13,;2.02,-2.9,;.68,-2.13,)|
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@@H](CC4)C(N)=O)c3c2n1 |r,wU:18.18,wD:21.25,(-5.7,1.21,;-4.93,-.12,;-3.47,-.59,;-3.47,-2.13,;-4.93,-2.61,;-5.84,-1.36,;-2.13,-2.9,;-2.13,-4.44,;-.8,-5.21,;.54,-4.44,;1.87,-5.21,;3.2,-4.44,;3.2,-2.9,;4.35,-1.87,;5.84,-2.27,;3.72,-.47,;4.49,.87,;2.19,-.63,;1.1,.46,;-.39,.06,;-1.48,1.15,;-1.08,2.64,;.41,3.04,;1.5,1.95,;-2.17,3.73,;-3.65,3.33,;-1.77,5.21,;1.87,-2.13,;.54,-2.9,;-.8,-2.13,)|
COCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc(OC)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)O)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(=O)N(C)C)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@@H](CC2)C(N)=O)c1=O)-c1cnn(CCO)c1 |r,wU:13.14,wD:16.21,(6.87,-2.27,;5.38,-1.87,;4.24,-2.9,;4.24,-4.44,;2.9,-5.21,;1.57,-4.44,;.24,-5.21,;-1.1,-4.44,;-1.1,-2.9,;.24,-2.13,;1.57,-2.9,;2.9,-2.13,;3.22,-.63,;2.14,.46,;.65,.06,;-.44,1.15,;-.04,2.64,;1.45,3.04,;2.53,1.95,;-1.13,3.73,;-2.62,3.33,;-.73,5.21,;4.76,-.47,;5.53,.87,;-2.43,-2.13,;-3.89,-2.61,;-4.8,-1.36,;-3.89,-.12,;-4.29,1.37,;-5.78,1.77,;-6.87,.68,;-2.43,-.59,)|
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)c4ncccn4)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CCO)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cn[nH]c1 |r,wU:13.14,wD:16.18,(5.84,-1.53,;4.35,-1.13,;3.2,-2.16,;3.2,-3.7,;1.87,-4.47,;.54,-3.7,;-.8,-4.47,;-2.13,-3.7,;-2.13,-2.16,;-.8,-1.39,;.54,-2.16,;1.87,-1.39,;2.19,.12,;1.1,1.2,;-.39,.81,;-1.48,1.89,;-1.08,3.38,;-2.17,4.47,;.41,3.78,;1.5,2.69,;3.72,.28,;4.49,1.61,;-3.47,-1.39,;-4.93,-1.87,;-5.84,-.62,;-4.93,.62,;-3.47,.15,)|
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:20.20,wD:23.24,(-7.32,.15,;-5.98,.92,;-4.65,.15,;-3.32,.92,;-1.98,.15,;-1.98,-1.39,;-3.32,-2.16,;-4.65,-1.39,;-.65,-2.16,;-.65,-3.7,;.68,-4.47,;2.02,-3.7,;3.35,-4.47,;4.69,-3.7,;4.69,-2.16,;5.83,-1.13,;7.32,-1.53,;5.2,.28,;5.97,1.61,;3.67,.12,;2.58,1.2,;1.1,.81,;.01,1.89,;.41,3.38,;-.68,4.47,;1.89,3.78,;2.98,2.69,;3.35,-1.39,;2.02,-2.16,;.68,-1.39,)|
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:18.18,wD:21.22,(-5.7,1.96,;-4.93,.62,;-3.47,.15,;-3.47,-1.39,;-4.93,-1.87,;-5.84,-.62,;-2.13,-2.16,;-2.13,-3.7,;-.8,-4.47,;.54,-3.7,;1.87,-4.47,;3.2,-3.7,;3.2,-2.16,;4.35,-1.13,;5.84,-1.53,;3.72,.28,;4.49,1.61,;2.19,.12,;1.1,1.2,;-.39,.81,;-1.48,1.89,;-1.08,3.38,;-2.17,4.47,;.41,3.78,;1.5,2.69,;1.87,-1.39,;.54,-2.16,;-.8,-1.39,)|
CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(N)=O)CC4)c3c2n1
CN(C)CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2n1 |r,wU:19.19,wD:22.23,(-6.65,.92,;-5.32,.15,;-5.32,-1.39,;-3.98,-2.16,;-2.65,-1.39,;-2.65,.15,;-3.98,.92,;-1.32,-2.16,;-1.32,-3.7,;.02,-4.47,;1.35,-3.7,;2.69,-4.47,;4.02,-3.7,;4.02,-2.16,;5.16,-1.13,;6.65,-1.53,;4.54,.28,;5.31,1.61,;3.01,.12,;1.92,1.2,;.43,.81,;-.66,1.89,;-.26,3.38,;-1.35,4.47,;1.23,3.78,;2.31,2.69,;2.69,-1.39,;1.35,-2.16,;.02,-1.39,)|
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN)c3c2n1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)NN)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C)CC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN(C)C)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CN)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CCO)CC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2n1
N[C@H]1CC[C@@H](CC1)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)[nH]c1=O |r,wU:4.7,wD:1.0,(-.01,4.47,;1.08,3.38,;.68,1.89,;1.77,.81,;3.26,1.2,;3.65,2.69,;2.56,3.78,;4.34,.12,;4.02,-1.39,;5.36,-2.16,;5.36,-3.7,;4.02,-4.47,;2.69,-3.7,;1.36,-4.47,;.02,-3.7,;.02,-2.16,;1.36,-1.39,;2.69,-2.16,;-1.31,-1.39,;-1.31,.15,;-2.64,.92,;-3.98,.15,;-5.31,.92,;-6.65,.15,;-6.65,-1.39,;-5.31,-2.16,;-3.98,-1.39,;-2.64,-2.16,;6.5,-1.13,;5.88,.28,;6.65,1.61,)|
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(N)=O)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CCO)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cn[nH]c1
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)C)c3c2n1
COCCN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C)CC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cnn(CCO)c1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)O)c3c2n1
Cn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cnc(N)nc1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC(N)=O)CC4)c3c2n1
CC(C)C(=O)CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O
C[C@@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(nc2)N(C)C)n(C)c1=O |r|
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)C(C)(C)O)c3c2n1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
CNC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O
COc1ccc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
Cn1cc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
OCCn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cn[nH]c1
CN(C)c1ccc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
OCCn1cc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3n(CCO)c(=O)n(C4CCOCC4)c3c2n1
OCCn1c2cnc3ccc(nc3c2n(C2CCOCC2)c1=O)-c1cc[nH]n1
Cn1c2cnc3ccc(nc3c2n(C2CCNCC2)c1=O)-c1cnn(CCO)c1
Cn1c2cnc3ccc(nc3c2n(C2CCNCC2)c1=O)-c1cnc(N)nc1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnc(N)nc1 |r,wU:13.14,wD:16.18,(6.65,-1.53,;5.16,-1.13,;4.02,-2.16,;4.02,-3.7,;2.69,-4.47,;1.35,-3.7,;.02,-4.47,;-1.32,-3.7,;-1.32,-2.16,;.02,-1.39,;1.35,-2.16,;2.69,-1.39,;3.01,.12,;1.92,1.2,;.43,.81,;-.66,1.89,;-.26,3.38,;-1.35,4.47,;1.23,3.78,;2.31,2.69,;4.54,.28,;5.31,1.61,;-2.65,-1.39,;-2.65,.15,;-3.98,.92,;-5.32,.15,;-6.65,.92,;-5.32,-1.39,;-3.98,-2.16,)|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H](C)CO)c3c2n1 |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cnc3ccccc3c2)n(C)c1=O |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cnc(N)nc2)n(C)c1=O |r|
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cccc2[nH]ccc12 |r,wU:13.14,wD:16.18,(6.56,-1.53,;5.07,-1.13,;3.92,-2.16,;3.92,-3.7,;2.59,-4.47,;1.26,-3.7,;-.08,-4.47,;-1.41,-3.7,;-1.41,-2.16,;-.08,-1.39,;1.26,-2.16,;2.59,-1.39,;2.91,.12,;1.82,1.2,;.33,.81,;-.75,1.89,;-.36,3.38,;-1.45,4.47,;1.13,3.78,;2.22,2.69,;4.44,.28,;5.21,1.61,;-2.74,-1.39,;-2.74,.15,;-4.08,.92,;-5.41,.15,;-5.41,-1.39,;-6.56,-2.42,;-5.93,-3.83,;-4.4,-3.67,;-4.08,-2.16,)|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2cccc3[nH]ccc23)n(C)c1=O |r|
C[C@H](CO)n1c2c(cnc3ccc(nc23)-c2c[nH]c3nncc3c2)n(C)c1=O |r|
C[C@@H](CO)n1c2c(cnc3ccc(nc23)-c2cnn(C)c2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H](C)CO)c3c2n1 |r|
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(N)nc2)n(C)c1=O
CNC(=O)Nc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
CNC(=O)Nc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(cc2)S(C)(=O)=O)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cccc(c2)-n2cccn2)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccnc3ncccc23)n(C)c1=O
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccnc3[nH]ncc23)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)CO)c1=O)-c1ccnc2[nH]ncc12
C[C@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccnc3[nH]ncc23)n(C)c1=O |r|
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cccc3[nH]ncc23)n(C)c1=O
C[C@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cccc3[nH]ncc23)n(C)c1=O |r|
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)CO)c1=O)-c1cccc2[nH]ncc12
C[C@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2ccc(C)nc2)n(C)c1=O |r|
C[C@@H](O)C(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O |r|
CC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O
COCC(=O)N1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)C(C)(C)O)c1=O)-c1cnc2[nH]ncc2c1
Cn1c2cnc3ccc(nc3c2n(C2CCN(CC2)C(=O)CO)c1=O)-c1cnc2[nH]ncc2c1
CN1CCC(CC1)n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ncc3c2)n(C)c1=O
CCNC(=O)Nc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)OC(C)(C)C)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(CCN4CCNCC4)c3c2n1
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1ccc2[nH]ncc2c1 |r,wU:13.14,wD:16.18,(7.27,-2.02,;5.78,-1.62,;4.64,-2.65,;4.64,-4.19,;3.31,-4.96,;1.97,-4.19,;.64,-4.96,;-.69,-4.19,;-.69,-2.65,;.64,-1.88,;1.97,-2.65,;3.31,-1.88,;3.63,-.37,;2.86,.96,;1.32,.96,;.55,2.29,;1.32,3.63,;.55,4.96,;2.86,3.63,;3.63,2.29,;5.16,-.21,;5.93,1.12,;-2.23,-2.65,;-2.23,-4.19,;-3.57,-4.96,;-4.9,-4.19,;-6.37,-4.67,;-7.27,-3.42,;-6.37,-2.17,;-4.9,-2.65,;-3.57,-1.88,)|
Cn1c2cnc3ccc(nc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnc2[nH]ncc2c1 |r,wU:13.14,wD:16.18,(7.27,-2.02,;5.78,-1.62,;4.64,-2.65,;4.64,-4.19,;3.31,-4.96,;1.97,-4.19,;.64,-4.96,;-.69,-4.19,;-.69,-2.65,;.64,-1.88,;1.97,-2.65,;3.31,-1.88,;3.63,-.37,;2.86,.96,;1.32,.96,;.55,2.29,;1.32,3.63,;.55,4.96,;2.86,3.63,;3.63,2.29,;5.16,-.21,;5.93,1.12,;-2.23,-2.65,;-2.23,-4.19,;-3.57,-4.96,;-4.9,-4.19,;-6.37,-4.67,;-7.27,-3.42,;-6.37,-2.17,;-4.9,-2.65,;-3.57,-1.88,)|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(CCN4CCOCC4)c3c2n1
COCCn1c2c(cnc3ccc(nc23)-c2ccc(OC)nc2)n(C)c1=O
COCCCn1c2c(cnc3ccc(nc23)-c2ccc(OC)nc2)n(C)c1=O
COc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
COc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
COc1ccc(cc1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
COc1cccc(c1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)[C@H](C)O)c3c2n1 |r|
COc1cccc(c1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(=O)CO)c3c2n1
COc1cccc(c1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2n1
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
C[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC1CN(C(=O)O1)c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1
O=C1OC[C@@H](N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1)c1ccccc1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(C)c3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncn(COP([O-])([O-])=O)n3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nnc(N)o3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nnc(N)s3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nnc(C)[nH]3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nnc(NCCO)o3)c2n1 |r|
COc1ccc(CN2C[C@H](C(C)C)N(C2=O)c2ccn3ncc(-c4ccc(cc4)-c4ncc[nH]4)c3n2)cc1 |r|
CC(C)[C@H]1CNC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC(C)[C@H]1CN(CCO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC(C)[C@H]1CN(CCCO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
COCCN1C[C@H](C(C)C)N(C1=O)c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
O=C1N[C@@H]2CCCC[C@@H]2N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
O=C1N[C@H]2CCCC[C@@H]2N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC(C)[C@H]1CN(C[C@H](O)CO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC(C)[C@H]1CN(CC2CCNCC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC(C)[C@H]1CN(CC2CCN(C)CC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3Cl)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3F)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CNC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCCO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CCCC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CC[C@@H](F)C2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CC[C@H](F)C2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CC[C@@H](O)C2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CO[C@@H]1CCN(CCN2C[C@H](C(C)C)N(C2=O)c2ccn3ncc(-c4ccc(cc4)-c4nc[nH]n4)c3n2)C1 |r|
CC(C)[C@H]1CN(CCN2CCOCC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CC3CCC(C2)O3)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r,TLB:7:8:11.12:15|
CC(C)[C@H]1CN(CCN2CCNC(=O)C2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
COCCOCCN1C[C@H](C(C)C)N(C1=O)c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CC2CCNCC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCC2CCCNC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCC2CCCN(C)C2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C[C@@H]2COCCN2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C2CCNCC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CCN1CCC(CC1)N1C[C@H](C(C)C)N(C1=O)c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C[C@H]2CCCN2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CCN1CCC[C@@H]1CN1C[C@H](C(C)C)N(C1=O)c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C[C@H]2CNCCO2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CCN1CCO[C@@H](CN2C[C@H](C(C)C)N(C2=O)c2ccn3ncc(-c4ccc(cc4)-c4nc[nH]n4)c3n2)C1 |r|
CC(C)[C@H]1CN(C[C@H](O)CO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C[C@@H](O)CO)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(C2CNC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CCN1CC(C1)N1C[C@H](C(C)C)N(C1=O)c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CC2CCNCC2)C(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CC(C)[C@H]1CN(CC2CCN(C)CC2)C(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CCN1CCC(CN2CC(C(C)C)N(C2=O)c2ccn3ncc(-c4ccc(-c5nc[nH]n5)c(F)c4)c3n2)CC1
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3C)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(Cl)c3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncn(CC(O)=O)n3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncn(CCO)n3)c2n1 |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3ncnn3CCO)c2n1 |r|
CCN1CC(C1)N1CC(C(C)C)N(C1=O)c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1
O=C1OC[C@H](C2CCCCC2)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)C1CCCCC1 |r|
FC(F)(F)C1CN(C(=O)O1)c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1
O=C1OC[C@@H](N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1)c1ccccc1 |r|
O=C1O[C@@H]2CCC[C@@H]2N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CCNCC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)[C@H]1CN(CCN2CCN(C)CC2)C(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC(C)C[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
O=C1OCC(N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1)c1ccccn1
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1C(COC1=O)c1ccccn1
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccccc1 |r|
CCC[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CC(C)[C@H]1CN(C[C@H]2CCCN2)C(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CC(C)[C@H]1CN(C[C@H]2CCCN2C(C)C)C(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CC[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CCC[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
O=C1OC[C@H](Cc2ccccc2)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
CC[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@@H](Cc2ccccc2)COC1=O |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@@H](CC2CC2)COC1=O |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)C1CC1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)C1CCOCC1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1C(COC1=O)C1CCNCC1
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1cccnc1 |r|
Cc1csc(n1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1csc(n1)[C@@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1cccc(n1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1ccc(cn1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1ccc(cn1)[C@@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1nc(cs1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1nc(n[nH]1)-c1ccc(cc1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(F)cc1 |r|
O=C1O[C@@H]2CCCC[C@@H]2N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H]2CCCC[C@H]2OC1=O |r|
CC(C)[C@H]1COC(=O)N1c1ccn2ncc(-c3cc(F)c(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1ccc(cc1Cl)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1ccc(cc1Cl)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)C1CCCC1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@@H](COC1=O)c1ccc(Cl)cc1 |r|
Fc1ccc([C@@H]2COC(=O)N2c2ccn3ncc(-c4ccc(-c5nc[nH]n5)c(F)c4)c3n2)c(F)c1 |r|
Fc1ccc(cc1F)[C@@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1ccc(cc1F)[C@@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
C[C@@]1(COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1)c1ccccc1 |r|
Fc1ccc(cc1F)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1C(COC1=O)c1ccccc1N1CCNCC1
Fc1ccc(nc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
O=C1OC[C@@H](N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1)c1ccccn1 |r|
O=C1OC[C@H](N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1)c1ccccn1 |r|
Clc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1C(COC1=O)c1ccccn1
Fc1ccc(cc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1ccc(cc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1ccccc1[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(cn1)C(F)(F)F |r|
Fc1cccc(c1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1ccc(nc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(Cl)cn1 |r|
Cc1ccc(nc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Fc1ccc(nc1)[C@@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
COc1ccccc1[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
COc1ccc(cc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
CCOC[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
COCC1(C)COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1
CO[C@@H](C)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1ccnc(c1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1ccnc(c1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
COc1cccc(n1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
COc1cccc(n1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Cc1nc(ccc1F)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1nc(ccc1F)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Cc1cc(ncc1F)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Cc1cc(ncc1F)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3nc[nH]n3)c2n1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccccc1Cl |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1cccc(Cl)c1 |r|
Fc1cc(ccc1-c1nc[nH]n1)-c1cnn2ccc(nc12)N1[C@@H]2[C@@H](Cc3ccccc23)OC1=O |r|
Fc1ccc(cc1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(cc3)-c3cc[nH]n3)c2n1 |r|
CCn1cccc([C@H]2COC(=O)N2c2ccn3ncc(-c4ccc(-c5nc[nH]n5)c(F)c4)c3n2)c1=O |r|
Cc1ccc(F)c(n1)[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4nc[nH]n4)c(F)c3)c2n1 |r|
Nc1nnc(o1)-c1ccc(cc1)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(F)cc1 |r|
O=C1OC[C@@H](N1c1ccn2ncc(-c3ccc(cc3)-c3ncc[nH]3)c2n1)c1ccccn1 |r|
OP(O)(=O)OCn1cnc(n1)-c1ccc(cc1F)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(F)cn1 |r|
Cn1ncnc1-c1ccc(cc1F)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(F)cn1 |r|
Cn1cnc(n1)-c1ccc(cc1F)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(F)cn1 |r|
Nc1nnc(o1)-c1ccc(cc1F)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccc(F)cn1 |r|
OP(O)(=O)OCn1cnc(n1)-c1ccc(cc1F)-c1cnn2ccc(nc12)N1[C@H](COC1=O)c1ccccn1 |r|
Oc1cccc(c1)-c1cc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccnc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccc(F)c(CO)c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccnc2[nH]ccc12)N1CCC(F)(F)CC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccc2[nH]c(=O)[nH]c2c1 |r|
C1CC2CN(CC1O2)c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCOCC1
COc1ccc(cc1C(O)=O)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cc(CO)ccc1Cl)N1CCOCC1 |r|
NCc1cc(ccn1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
CC(O)c1cc(ccn1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cnc2cc[nH]c2c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccc2cc[nH]c2c1 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCC(O)CC1 |r|
COc1cc(CO)cc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc(CO)ccc1F |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccc2cc[nH]c2c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1ccc2cc[nH]c2c1)N1CCOCC1 |r|
COC1CCN(CC1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc2[nH]ccc12
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc2[nH]ccc12
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc2[nH]ncc12
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1ccc2cc[nH]c2c1
Nc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
CC(=O)Nc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1cccc(N)c1 |r|
CS(=O)(=O)Nc1cccc(c1)-c1nc2c(nc(nc2[nH]1)N1CCOCC1)N1CCOCC1
Cc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CNc1ccc(cn1)C#Cc1c(C)nccc1-c1ccc(cc1)S(C)(=O)=O
CN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1cc(ccn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(C(=O)N3CCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(C(=O)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(cc2)C(=O)N2CCN(CC2)C2CC2)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cc1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(cc2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccnc(C)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)NC)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(cc2)C(C)(C)C#N)c1C#Cc1ccc(N)nc1
CCc1cc(ccn1)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2cc(C)nc(C)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(nc2)C2CC2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(nc2)C(F)(F)F)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)CC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1Cl)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(CC)c1C#Cc1ccc(NC)nc1
CCN1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCC(CC3)N3CCOCC3)c(Cl)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CCOCC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)=O)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N(C)CCOC)c(F)c2)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cccc(c1)-c1ccnc(C)c1C#Cc1ccc(C)nc1
CNC(=O)c1cc(ccc1Cl)-c1ccnc(C)c1C#Cc1ccc(C)nc1
Cc1ccc(cn1)C#Cc1c(C)nccc1-c1ccc(Cl)c(c1)C(=O)N1CCOCC1
CN(C)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CNC(=O)c1cc(ccc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1
COCCN(C)C(=O)c1cc(ccc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1cc(ccc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2cn[nH]c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3CCCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CN(C)CCCN(C)C(=O)c1cc(ccc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1
COCCN(C)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(C)CCN(C)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(F)c(c2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CN(C)CCN(C)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
COCCCN(C)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CNC(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(C)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2cnn(C)c2)c1C#Cc1ccc(N)nc1
CN(C1CCN(C)C1)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(CCO)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(CCCO)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CCN1CCC(CN(C)C(=O)c2cc(ccc2F)-c2ccnc(C)c2C#Cc2ccc(N)nc2)C1
CC(O)N1CCC(CC1)N(C)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CCN1CCC(CC1)N(C)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(CC1CCN(C)CC1)C(=O)c1cc(ccc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(C1CCCCC1)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(nc2)C(=O)N2CCOCC2)c1C#Cc1ccc(N)nc1
COCCNC(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN1CCN(CC1)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
COCCN(C)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
CN(C)CCCN(C)C(=O)c1ccc(cn1)-c1ccnc(C)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(nc2)C(=O)N2CCCCC2)c1C#Cc1ccc(N)nc1
CCCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)NCCOC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCCOCC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCC(CC3)OC)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCC(C)(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCC(O)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC(=O)N(C)C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1
CNC(=O)c1cc(ccc1Cl)-c1ccnc(C)c1C#Cc1ccc(N)nc1C
Cc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(cc1)S(C)(=O)=O
CCc1nccc(-c2ccc(Cl)c(c2)C(=O)NC)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(cc2)S(C)(=O)=O)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(C(=O)NC)c(Cl)c2)c1C#Cc1ccc(N)nc1C
Cc1nc(N)ccc1C#Cc1c(C)nccc1-c1cccc(F)c1
CCc1nccc(-c2ccc(C(=O)N3CCN4CCCCC4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN4CCCC4C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CC(C)N(CCOC)C(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C(C)C)C(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCN1CCN(CC1C)C(=O)c1ccc(cc1F)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)C(C)(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)C(C)C3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3C[C@@H]4CC3CN4C)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1nccc(-c2ccc(C(=O)N3C[C@@H]4CC3CN4c3ccc(F)cc3)c(F)c2)c1C#Cc1ccc(N)nc1 |r|
CCc1nccc(-c2ccc(F)c(c2)C(=O)N(C)CCCOC)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(C)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(CC)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C3COC3)c(F)c2)c1C#Cc1ccc(N)nc1
CCc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(C(=O)N2CCOCC2)c(F)c1
CCc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(C(=O)N2CCN(C)CC2)c(F)c1
Cc1nccc(-c2ccc(nc2)C(F)(F)F)c1C#Cc1ccc(N)nc1
Cc1nccc(-c2ccc(nc2)C2CC2)c1C#Cc1ccc(N)nc1
CCc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(C(=O)N2CCCC2)c(F)c1
CCc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(C(=O)N2CCN(CC2)C2CC2)c(F)c1
CN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1C
Cc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(C(=O)N2CCN(CC2)C2CCOCC2)c(F)c1
COCCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1C
Cc1nc(N)ccc1C#Cc1c(C)nccc1-c1ccc(C(=O)N2CCN(CC2)C(C)(C)C)c(F)c1
CCN1CCN(CC1)C(=O)c1ccc(cc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CCOC)CC3)c(F)c2)c1C#Cc1ccc(NC)nc1
CCc1nc(N)ccc1C#Cc1c(CC)nccc1-c1ccc(C(=O)N2CCCC2)c(F)c1
CCc1nc(N)ccc1C#Cc1c(CC)nccc1-c1ccc(C(=O)N2CCOCC2)c(F)c1
CCc1nc(N)ccc1C#Cc1c(CC)nccc1-c1ccc(C(=O)N2CCN(CC2)C2CC2)c(F)c1
CCc1cc(ccn1)-c1ccnc(CC)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2cc(C)nc(C)c2)c1C#Cc1ccc(N)nc1C
COC(=O)CCNC(=O)c1ccc(cc1F)-c1ccnc(C)c1C#Cc1ccc(N)nc1C
CCc1nccc(-c2ccc(C(=O)N3CCN(CC3)C(C)C)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCN(CC4CC4)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccnc(c2)C(C)(C)C)c1C#Cc1ccc(N)nc1
CCCN1CCN(CC1)C(=O)c1ccc(cc1OC)-c1ccnc(CC)c1C#Cc1ccc(N)nc1
CCc1nccc(-c2ccc(C(=O)N3CCNC(=O)C3)c(OC)c2)c1C#Cc1ccc(N)nc1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(O)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(C)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CO)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CO)c1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccccc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccsc1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOCC1)N1CCOC[C@@H]1C |r|
COc1cncc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cn1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ncccc1-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccnc1F |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(nc1)N1CCOCC1 |r|
COc1ncc(cn1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cnn(C)c1 |r|
COc1ncc(c(OC)n1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(N)nc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cncc(Cl)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(Cl)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)nc1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1c(C)noc1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)C(N)=O |r|
CCCNC(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)C(O)=O |r|
CNC(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCNC(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)C(=O)NCCO |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)nc1 |r|
COC(=O)c1cncc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(Cl)c1F |r|
CNC(=O)c1ccc(cc1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CC(C)NC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)S(C)(=O)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)S(C)(=O)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)C(N)=O |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)S(=O)(=O)NCCO |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccncc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(N)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(NS(C)(=O)=O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cc(F)nc(F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C#N |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(O)=O |r|
COC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CO)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)S(N)(=O)=O |r|
COCCNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N1CCN(C)CC1 |r|
COC(=O)c1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)-c1nnn[nH]1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)-c1nnn[nH]1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)-c1nnn[nH]1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(NS(C)(=O)=O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)C#N |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2[nH]ccc2c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)[N+]([O-])=O |r|
COc1ccc(cc1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(Cl)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccccc1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(C)c1 |r|
COc1ccc(cc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccnc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccoc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)C#N |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CO)c1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CO)cc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(O)c1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccccc1C |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(C)c1 |r|
COc1ccc(cc1F)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOC[C@@H]1C |r|
COc1cccc(c1)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOC[C@@H]1C |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccncc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccoc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(O)cc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2[nH]ccc2c1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)[N+]([O-])=O |r|
COc1ccc(cc1)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(O)c(c1)C(O)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2nc[nH]c(=O)c2c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2OCC(=O)Nc2c1 |r|
COc1ccc(cc1C#N)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCOc1ccc(cc1C(N)=O)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCOc1ccc(cc1C#N)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2[nH]ncc2c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2cn[nH]c(=O)c2c1 |r|
CC(C)Oc1ccc(cc1C#N)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(O)c(CO)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2NC(=O)Cc2c1 |r|
CNC(=O)c1ccc(cc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CC(C)Oc1ccc(cc1C(N)=O)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(O)c(c1)C(C)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(nc1)C(N)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(NN)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(C(N)=O)c(F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)C1C=CC(=O)N=C1 |r,c:29,33|
CNc1ccc(cn1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(nc1)N(C)C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2c(NCCNC2=O)c1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC(F)F)c(c1)C(N)=O
CNC(=O)c1cc(ccc1OC(F)F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COC(=O)c1ccc(cc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNC(=O)c1ccc(cc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNC(=O)c1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOCC1)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(C#N)c(F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(NC(C)=O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(-c3cccc(NS(C)(=O)=O)c3)[n+]([O-])c2n1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2CNC(=O)c2c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNS(C)(=O)=O)cc1 |r|
CCNC(=O)c1ccc(cc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2NC(=O)CNC(=O)c2c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2c(c1)nc[nH]c2=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2CC(=O)Nc2c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(NS(C)(=O)=O)cc1 |r|
COc1ccc(cc1N)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cnc2[nH]ccc2c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@H]1C)N1CCOC[C@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2C(=O)NCc2c1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(NS(C)(=O)=O)c1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(c1)C(N)=O)N1CCN(C)CC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(Cl)cc1)N1CCN(C)CC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(c1)C(N)=O)N1CCC(CN)CC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(c1)C(N)=O)N1CCCC(CO)C1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(N)nc1)N1CCC(CC1)c1ccncc1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(c1)C(N)=O)N1CCCCC1CO |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(N)nc1)N1CCCCC1CO |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(c1)C(N)=O)N1CCC(CO)CC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(c1)C(N)=O)N1CCC(N)CC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(N)nc1)N1CCC(CCO)CC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)Nc1cc[nH]n1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N1CCNCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N(C)C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N1CCC[C@@H](O)C1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)NCCF |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)NCC(F)(F)F |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N1CC[C@@H](O)C1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N1CC[C@H](O)C1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)NC1CCOCC1 |r|
CC(C)N(C)C(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COCCN(C)C(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)NCC(F)F |r|
CCN(C)C(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCN(CC)C(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CON(C)C(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N(C)CC=C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N(C)CC#C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)N(C)C(C)(C)C |r|
CC1CCCN1C(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1C(=O)N(C)C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCN(C)C(=O)c1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)C(=O)N(C)C |r|
CCN(CC)C(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CC(C)N(C)C(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CON(C)C(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)C(=O)N(C)CC=C |r|
CCN(C)C(=O)c1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(c1)C(=O)N(C)CC#C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(cc1)C(=O)N(C)C |r|
CNC(=O)c1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNCc1ccc(cc1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CN)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CN2CC[C@@H](O)C2)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CN2CC[C@H](O)C2)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNC2CCOCC2)cc1 |r|
CCOCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNCCO)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNC2CC2)c1 |r|
CC(C)NCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNC2CCOCC2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNCC2CC2)c1 |r|
COCCNCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNc2cc[nH]n2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(Cn2ccnc2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN2CC[C@@H](O)C2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN2CC[C@H](O)C2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CS(C)(=O)=O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNC2CC2)c1 |r|
CC(C)NCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNC2CCOCC2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNCC2CC2)c1 |r|
COCCNCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNCCF)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNCCO)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN2CC[C@@H](O)C2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN2CCNCC2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN(C)C)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN2CCN(C)CC2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN2CCC[C@@H](O)C2)c1 |r|
CC(C)N(C)Cc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COCCN(C)Cc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CN2CC[C@H](O)C2)c1 |r|
COc1ccc(cc1CNC1CC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC(C)C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1CCCC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1CCCCC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNCc1cccs1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1CCOCC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1(CCCCC1)C#C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNCCC(C)(C)C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNCCC(C)C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC(C)CC(C)C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCN(CC)CCCNCc1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1CCCCC1C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNCC1CC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCCCNCc1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNCC(C)C)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNCCO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COCCNCc1cc(ccc1OC)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1CCC(C)CC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r,wU:32.37,wD:39.45,(7.34,-1.15,;6,-1.93,;4.67,-1.15,;4.67,.38,;3.33,1.15,;2,.38,;2,-1.15,;3.33,-1.93,;3.33,-3.47,;2,-4.23,;2,-5.78,;.67,-6.54,;.67,-8.08,;2,-8.85,;2,-10.39,;3.33,-8.08,;3.33,-6.54,;.67,1.15,;-.67,.38,;-2,1.15,;-2,2.69,;-3.33,3.47,;-3.33,5,;-2,5.78,;-.67,5,;-.67,3.47,;.67,2.69,;-2,7.31,;-.67,8.08,;-.67,9.63,;-2,10.39,;-3.33,9.63,;-3.33,8.08,;-4.67,7.31,;-4.67,2.69,;-4.67,1.15,;-6,.38,;-7.34,1.15,;-7.34,2.69,;-6,3.47,;-6,5,)|
COc1ccc(CCNCc2cc(ccc2OC)-c2ccc3c(nc(nc3n2)N2CCOC[C@@H]2C)N2CCOC[C@@H]2C)cc1 |r|
COc1ccc(cc1CNCCc1cnc[nH]1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CNC1CCCCCCC1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNC(C)=O)c1 |r|
COCC(=O)NCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNC(=O)C2CC2)c1 |r|
CC(C)C(=O)NCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNC(=O)C2CCC2)c1 |r|
CC(C)CC(=O)NCc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CNC(=O)C(F)(F)F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN(C)C(C)=O)c1 |r|
COCC(=O)N(C)Cc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN(C)C(=O)C2CC2)c1 |r|
CC(C)C(=O)N(C)Cc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN(C)C(=O)C2CCC2)c1 |r|
CC(C)CC(=O)N(C)Cc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN(C)C(=O)C(F)(F)F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CN(C)S(C)(=O)=O)c1 |r|
CCS(=O)(=O)N(C)Cc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNC(C)=O)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CN(C)C(C)=O)cc1 |r|
COCC(=O)N(C)Cc1ccc(cc1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNC(C)=O)c1 |r|
COCC(=O)NCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNC(=O)C2CC2)c1 |r|
CC(C)C(=O)NCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNC(=O)C2CCC2)c1 |r|
CC(C)CC(=O)NCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(F)c(CNC(=O)C(F)(F)F)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccoc1CO |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNCCO)o1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNCCN(C)C)o1 |r|
CNCc1ccc(o1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CCNCc1ccc(o1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNC2CC2)o1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNC2CCOCC2)o1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNCC2CC2)o1 |r|
COCCNCc1ccc(o1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNc2cc[nH]n2)o1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNCC(N)=O)o1 |r|
CC(C)NCc1ccc(o1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)C(=O)NCCO |r|
COc1ccc(cc1C(=O)NCCO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNC(=O)c1ccc(cn1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(nc1)C(=O)N(C)C |r|
COCc1cc(ccc1F)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccn(C)c(=O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(c1)N(C)S(C)(=O)=O |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ncc(nc2n1)-c1ccccc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ncc(nc2n1)-c1ccc(C)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ncc(nc2n1)-c1ccc(C)cc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ncc(nc2n1)-c1ccccc1 |r|
C[C@H]1COCCN1c1nc(Cl)nc2nc(cnc12)-c1ccc(C)cc1 |r|
COc1cc(ccn1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OCCN(C)C)nc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cc[nH]c(=O)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(c1)C#N |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccnc(c1)C(N)=O |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(nc1)C#N |r|
CNc1cc(ccn1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1C(O)=O)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1C(N)=O)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(NS(=O)(=O)CCO)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(NC(=O)C2CCCO2)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(NC(C)=O)nc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(Oc3ccccc3)nc2n1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC[C@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(N)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCCCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCCC(N)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)c1cccc(O)c1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CCO)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(C1)C(F)(F)F)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(C)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(C1)c1ccccc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(O)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1ccnc1I)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(Nc3ccccc3)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(Nc3ccncn3)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(Nc3cccnc3)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(Nc3ccccn3)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC1)N1CCOC[C@@H]1C |r|
CCOC(=O)C1CCCN(C1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CN)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(C)CC1)N1CCOC[C@@H]1C |r|
CCOC(=O)C1CCN(CC1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)C(N)=O)N1CCOC[C@@H]1C |r|
COc1ccc(cc1)C(=O)C1CCN(CC1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CO)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(CO)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)N1CCCCC1)N1CCOC[C@@H]1C |r|
COC(=O)[C@@H]1C[C@@H](O)CN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CC[C@H](O)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)N1CCOCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(N)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CC(C)CC(C)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)C(F)(F)F)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC2CCCCC2C1)N1CCOC[C@@H]1C |r|
COC(=O)[C@@H]1CCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)N1CCCC1)N1CCOC[C@@H]1C |r|
COC1CCCN(C1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)C(=O)c1ccc(Cl)cc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(Cc2ccccc2)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(O)(CC1)c1ccccc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)(C#N)c1ccccc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC[C@H]1C(N)=O)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)c1ccc(Cl)cc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(C1)c1nc(C)no1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(CN(C)C)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)N(C1CC1)S(=O)(=O)c1ccc(Cl)cc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCC(N)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC(C)CC(C)C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC3CCCC3)nc2n1)N1CCOC[C@@H]1C |r|
COCC(C)Nc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1ccnc1)N1CCOC[C@@H]1C |r|
COC(=O)c1cncn1-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1cnc(C)c1C=O)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1cnc(Br)c1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1cc(Br)nc1C)N1CCOC[C@@H]1C |r|
CCC1CCC(C)N(C1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)c1ccccc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC(C1)c1ccccc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C(C)CCC1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC(CC1)c1ccncc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC[C@H](O)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC[C@@H](O)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOc2ccccc12)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCCC1CO)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CC[C@@H](O)C1)N1CCOC[C@@H]1C |r|
COC[C@@H](C)Nc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
CNc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
CCNc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC(C)C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NCCO)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NCCF)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NCC(N)=O)nc2n1)N1CCOC[C@@H]1C |r|
CNCCNc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(N[C@H](C)CO)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(N[C@@H](C)CO)nc2n1)N1CCOC[C@@H]1C |r|
COCCNc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NCC(F)F)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCNCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NCCN(C)C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC(C)(C)CO)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC(CO)CO)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1ccnc1CO)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCNC(=O)C1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCN(C)CC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCSCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCN(CCO)CC1)N1CCOC[C@@H]1C |r|
COCCN(CCOC)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N(CCO)CCO)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC[C@H]1CO)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCC[C@@H]1CO)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-n1ccnc1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCNC(=O)C1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(N[C@H](C)C(N)=O)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(N[C@@H](C)C(N)=O)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N(C)CCO)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N(CCO)C(C)C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC(C)CN(C)C)nc2n1)N1CCOC[C@@H]1C |r|
COc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
CCOc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(OCCO)nc2n1)N1CCOC[C@@H]1C |r|
COCCOc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(OCCN(C)C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(OC(C)CN(C)C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(OCCS(C)(=O)=O)nc2n1)N1CCOC[C@@H]1C |r|
CNCCOc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(OCCC#N)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCCCO1)N1CCOC[C@@H]1C |r|
C[C@H]1CCCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(Cl)cc1 |r|
CCC1CCCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(Cl)cc1 |r|
C[C@@H]1CCCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(Cl)cc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(Cl)cc1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(Cl)cc1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(Cl)cc1)N1CCC(CC1)C(N)=O |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(N)nc1)N1CCC(CC1)C(=O)N(C)C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1ccco1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(C=O)c1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(CO)c1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(c1)-c1ccccc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(CN)c1)N1CCOC[C@@H]1C |r|
COc1cccc(c1)-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cc(cc(c1)[N+]([O-])=O)C(O)=O)N1CCOC[C@@H]1C |r|
COC(=O)c1cccc(c1)-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(c1)[N+]([O-])=O)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccnc1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(c1)C(N)=O)N1CCOC[C@@H]1C |r|
COCc1cccc(c1)-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(c1)C(F)(F)F)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)-c1cccc(C)c1)N1CCOC[C@@H]1C |r|
COc1ccc(cn1)-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CO)c1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(CO)c1)-c1ccncc1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(CO)c1)-c1cccnc1 |r|
COc1cncc(c1)-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CO)c1 |r|
COc1ncccc1-c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(CO)c1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(CO)c1)-c1cccnc1F |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(CO)c1)-c1cnn(C)c1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1cccc(CO)c1)-c1c(C)nn(C)c1C |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(Cl)cc1)-c1cccnc1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NS(=O)(=O)c3cccc(C)c3)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(NC(=O)c3ccccc3)nc2n1)N1CCOC[C@@H]1C |r|
CC(OC(C)=O)C(=O)Nc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccccc1 |r|
COc1ccc(cc1CO)-c1ccc2c(ncnc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOC[C@@H]1C |r|
CCC1CCCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccccc1 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(C[C@@H]3CCCN3)C(=O)c12)N1CC2CCC(C1)O2 |r,TLB:15:33:36.37:40|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(C[C@@H]3CCCN3C(=O)OCC)C(=O)c12)N1CC2CCC(C1)O2 |r,TLB:15:38:41.42:45|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(C[C@@H]3CCCN3C(C)=O)C(=O)c12)N1CC2CCC(C1)O2 |r,TLB:15:36:39.40:43|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CCC(O)=O)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:31:38:34.35|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CCC(=O)N(C)C)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:33:40:36.37|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CCCO)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:30:33.34:37|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:28:35:31.32|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC)cc3F)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)cc3F)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)N4CCN(C)CC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:40:47:43.44|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(C3CCOCC3)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:32:39:35.36|
Cc1cc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C4CCOCC4)C(=O)c23)N2CC3CCC(C2)O3)no1 |THB:16:34:41:37.38|
Cn1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C4CCOCC4)C(=O)c23)N2CC3CCC(C2)O3)n1 |THB:17:35:42:38.39|
CCNC(=O)Nc1ccc(cn1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CC2CCC(C1)O2 |TLB:14:28:31.32:35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC(F)F)c4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:36:39.40:43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OC[C@H](C)O)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,THB:10:31:38:34.35|
COc1ccnc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2CC3CCC(C2)O3)c1 |TLB:19:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC5CCN(C)CC5)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:41:44.45:48|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)C(=O)N4CCC(CC4)N(C)C)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC(C)(C)O)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:32:39:35.36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cn4)N4CCCC4)cc3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:37:44:40.41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)c(C)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)N[C@H](C)CO)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,THB:10:31:38:34.35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cncc(OC)n4)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCOC[C@@H]4C)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,TLB:10:40:43.44:47|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCOC[C@H]4C)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,TLB:10:40:43.44:47|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCCCC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:39:46:42.43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCCC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:38:41.42:45|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)cn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:33:36.37:40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(C)n4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CC[C@H]1COCCN1c1nc2OC(C)(C)CN(CC)C(=O)c2c(n1)-c1ccc(NC(=O)Nc2ccc(C)nc2)c(F)c1 |r|
CNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(C)C(=O)c12)N1CC2CCC(C1)O2 |TLB:13:26:29.30:33|
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:9:31:34.35:38|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OCCOC)cn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:37:44:40.41|
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)cc3)c2C1=O)N1C2CCC1COC2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)cn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:9:32:35.36:39|
CNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(C)C(=O)c12)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)cn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(C)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:27:34:30.31|
CNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(C)C(=O)c12)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC)cc3F)c2C1=O)N1CC2CCC(C1)O2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)cn4)cc3)c2C1=O)N1C2CCC1COC2
COc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2C3CCC2COC3)nc1
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccnc4)c(F)c3)c2C1=O)N1C2CCC1COC2 |TLB:10:33:39.40.38:35.36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)c(F)c3)c2C1=O)N1C2CCC1COC2 |TLB:10:33:39.40.38:35.36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)c(F)c3)c2C1=O)N1CC2CC11CC1O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)O[C@H]4CCC[C@H]4O)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
COc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2CC3CCC(C2)O3)nc1 |TLB:18:31:34.35:38|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(C)c4)c(F)c3)c2C1=O)N1C2CCC1COC2 |TLB:10:34:40.41.39:36.37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(C)c4)c(F)c3)c2C1=O)N1CC2CC11CC1O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)N[C@@H](C)CO)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,THB:10:31:38:34.35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(C)nc(C)c4)c(F)c3)c2C1=O)N1CC2CC11CC1O2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(C)c4)c(F)c3)c2C1=O)N1C2CCC1COC2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(C)c4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:9:33:40:36.37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)O[C@@H](C)CO)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,THB:10:31:38:34.35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)O[C@H](C)CO)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r,THB:10:31:38:34.35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)cc3)c2C1=O)N1C2CCC1COC2 |TLB:10:32:34.35:37.39.38|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cn4)N(C)C)cc3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:35:42:38.39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCCO)cc3)c2C1=O)N1C2CCC1COC2 |TLB:10:29:35.36.34:31.32|
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:9:33:40:36.37|
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)nc4)c(F)c3)c2C1=O)N1C2CCC1COC2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)cc3)c2C1=O)N1C2CCC1COC2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:9:31:34.35:38|
COc1ccnc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2C3CCC2COC3)c1
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)cc3F)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cn4)N4CCC(O)C4)cc3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:38:45:41.42|
C[C@H]1COCCN1c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2CC3CCC(C2)O3)cn1 |r,THB:24:37:44:40.41|
C[C@H]1COCCN1c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2C3CCC2COC3)cn1 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4F)cc3)c2C1=O)N1C2CCC1COC2 |TLB:10:33:39.40.38:35.36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4F)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC5CCOC5)cc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(c4)N(C)C)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:36:39.40:43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccn4)cc3)c2C1=O)N1C2CCC1COC2 |TLB:10:34:40.41.39:36.37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(c4)N4CCN(CC4)S(C)(=O)=O)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCN(CC4)C(=O)OC)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)c(F)c3)c2C1=O)N1C2CCC1COC2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:9:32:39:35.36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)cc3F)c2C1=O)N1CC2CCC(C1)O2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4F)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:9:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc5[nH]ccc45)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |THB:10:36:43:39.40|
C[C@@H]1COCCN1c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc(nc3OC(C)(C)CN(C)C(=O)c23)N2CC3CCC(C2)O3)cn1 |r,THB:24:37:44:40.41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OC[C@H](C)O)cc3)c2C1=O)N1CC2CCC(C1)O2 |r,THB:10:30:37:33.34|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccn4)cc3F)c2C1=O)N1C2CCC1COC2 |TLB:10:35:41.42.40:37.38|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(C)nc(C)n4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(C)nc(C)n4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncn4)cc3)c2C1=O)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(C)nc(C)n4)cc3)c2C1=O)N1C2CCC1COC2
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CNC(=O)c12)N1CCOCC1
CC1(C)CNC(=O)c2c(O1)nc(nc2-c1ccc(N)nc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OCCN(CC)C(=O)c12)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:28:31.32:35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(OC)c(CO)c3)c2C1=O)N1CCOCC1
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(OC)c(CO)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:26:29.30:33|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(N)cc3)c2C1=O)N1CCOCC1
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OC)cc3)c2C1=O)N1CCOCC1
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NOC)cc3)c2C1=O)N1CCOCC1
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OC)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:27:30.31:34|
CCOC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CC2CCC(C1)O2 |TLB:14:28:31.32:35|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(N)nc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:23:26.27:30|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)CC)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:27:30.31:34|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OCC(C)(C)CN(CC)C(=O)c12)N1C[C@H](C)O[C@H](C)C1 |r|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CC2CCC(C1)O2 |THB:15:29:36:32.33|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NS(=O)(=O)CC)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccnc4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CC2CCC(C1)O2
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1C[C@H](C)O[C@H](C)C1 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnn4C)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(C)on4)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCO)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:29:32.33:36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4nc5ccccc5[nH]4)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCCO)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:30:33.34:37|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CCC(=O)OC(C)(C)C)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:35:42:38.39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(Nc4nnc(C)s4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:29:32.33:36|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccn(C)n4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCF)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnccn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnn(C)c4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC)c4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC4CCCO4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:33:36.37:40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC4CCS(=O)(=O)C4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC4CCN(C)CC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCOC)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:31:34.35:38|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(C3CCN(C)CC3)C(=O)c12)N1CC2CCC(C1)O2 |TLB:14:33:36.37:40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC4CC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:30:33.34:37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC4CCOCC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnc(OC)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC4COC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:31:34.35:38|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(F)c(OC)c4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:36:39.40:43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cncc(OC)n4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nn4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC)n4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnn(C)c4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:33:36.37:40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(OC)n4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCc4ccc(OC)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:36:39.40:43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nn4)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(c4)C(F)(F)F)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:36:39.40:43|
COc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc3OC(C)(C)CN(C4CCOCC4)C(=O)c23)N2CC3CCC(C2)O3)cn1 |THB:18:36:43:39.40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC(F)(F)F)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC4CC4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1CCOC[C@@H]1CC |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(Nc4nnc(C)[nH]4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:30:33.34:37|
CC1(C)CN(C2CCOCC2)C(=O)c2c(O1)nc(nc2-c1ccc(NC(=O)Nc2ccon2)c(F)c1)N1CC2CCC(C1)O2 |THB:17:36:43:39.40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4F)C(F)(F)F)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:37:40.41:44|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)c(F)cc4F)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:36:39.40:43|
C[C@H]1COCCN1c1nc2OC(C)(C)CN(C3CCOCC3)C(=O)c2c(n1)-c1ccc(NC(=O)Nc2ccon2)c(F)c1 |r|
CC1(C)CN(C2CCOCC2)C(=O)c2c(O1)nc(nc2-c1ccc(NC(=O)Nc2ccon2)cc1)N1CC2CCC(C1)O2 |THB:17:35:42:38.39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:33:36.37:40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnccn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)nc4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:12:36:39.40:43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)cn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)cn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)c(C)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccn(C)n4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnc(C)cn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)cn4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4nnc(C)o4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCN(C)CC4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)cc3)c2C1=O)N1CC2CCC(C1)O2 |THB:12:33:40:36.37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)cn4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCN(C)CC4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)c(C)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:35:38.39:42|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)C(=O)N(C)CCN(C)C)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:41:44.45:48|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)C(=O)N4CCC(CC4)N(C)C)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:43:46.47:50|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:12:37:40.41:44|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:12:34:37.38:41|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccon4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cn(C)cn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(Nc4nnc([nH]4)-c4ccc(OC)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:37:40.41:44|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccn4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCCO)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCOCC4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
COc1ccc(NC(=O)Nc2ccc(cc2F)-c2nc(nc3OC(C)(C)CN(C4CCOCC4)C(=O)c23)N2CCOC[C@@H]2C)cn1 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)C(=O)NCC(C)(C)O)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:40:43.44:47|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Oc4cccc(OC)c4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cn(C)cn4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCN(C)CC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)c(C)c3)c2C1=O)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)cc3)c2C1=O)N1CC2CCC(C1)O2 |THB:12:36:43:39.40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnc(OC)cn4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:34:37.38:41|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(C)c4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCOCC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnn(C)c4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccc4F)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(CN5CCCCC5)cc4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:39:42.43:46|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC(F)F)c4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)N4CCN(C)CC4)cc3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:39:42.43:46|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC)c(F)c3)c2C1=O)N1C[C@@H]2C[C@H]1CO2 |r,TLB:10:28:34.33:31|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC)c(F)c3)c2C1=O)N1C2CCC1COC2 |TLB:10:28:34.35.33:30.31|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)c(F)cc4F)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCCO)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CCOC)C(=O)c12)N1CC2CCC(C1)O2 |TLB:14:30:33.34:37|
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CCOC)C(=O)c12)N1CC2CCC(C1)O2 |TLB:15:31:34.35:38|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC(C)F)c4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccc4F)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCC(C)(C)O)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)C(=O)N(C)CCN(C)C)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC(F)F)c4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(CCOC)C(=O)c12)N1CC2CCC(C1)O2 |THB:14:30:37:33.34|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cn4)N4CCN(C)CC4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)C(=O)NCC(C)(C)O)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccc(OC(C)F)c4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:12:39:42.43:46|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccccn4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCCO)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:30:33.34:37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cccnc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:33:36.37:40|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC(C)(C)CO)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:32:35.36:39|
CNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CCOC)C(=O)c12)N1CCOC[C@@H]1C |r|
COCCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCC(C)(C)O)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)N4CCOCC4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CC[C@H]1COCCN1c1nc2OC(C)(C)CN(CC)C(=O)c2c(n1)-c1ccc(NC(=O)NC)c(F)c1 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(C)nc4)c(F)c3)c2C1=O)N1C2CCC1COC2 |TLB:10:34:40.41.39:36.37|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)C(F)(F)F)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:37:40.41:44|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccncc4)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnc(cn4)N4CCOCC4)cc3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnc(cn4)N4CCOCC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:39:42.43:46|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cnc(cn4)N(C)C)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |TLB:10:36:39.40:43|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)N4CCN(CC4)S(C)(=O)=O)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)N4CCN(CC4)C(=O)OC)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cc4)N4CCS(=O)(=O)CC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
C[C@@H](CO)OC(=O)Nc1ccc(cc1)-c1nc(nc2OC(C)(C)CN(C)C(=O)c12)N1CC2CCC(C1)O2 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OC[C@@H](C)O)c(F)c3)c2C1=O)N1CC2CCC(C1)O2 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(OC)nc4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(C)nc(C)c4)c(F)c3)c2C1=O)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4cc(OC)ccn4)cc3F)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCCO)cc3F)c2C1=O)N1C2CCC1COC2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Oc4ccc(cc4)N4CC5CCC(C4)O5)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4C5CCC4COC5)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)OCCO)cc3F)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)C#N)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CC[C@H]1COCCN1c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc(nc3OC(C)(C)CN(CC)C(=O)c23)N2CCOC[C@@H]2C)cn1 |r|
CC[C@H]1COCCN1c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc(nc3OC(C)(C)CN(CC)C(=O)c23)N2C3CCC2COC3)cn1 |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cn4)N4CCOCC4)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(cn4)N4CC5CCC(C4)O5)cc3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4C[C@@H]5C[C@H]4CO5)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r,TLB:24:27:33.32:30|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4C[C@@H]5C[C@H]4CO5)c(F)c3)c2C1=O)N1C2CCC1COC2 |r,TLB:24:27:33.32:30|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NC4CC4)c(F)c3)c2C1=O)N1C2CCC1COC2
CCNC(=O)Nc1ccc(cc1F)-c1nc(nc2OC(C)(C)CN(CC)C(=O)c12)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCOCC4(C)C)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CCOCC4(C)C)c(F)c3)c2C1=O)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CC5CCC(C4)O5)c(F)c3)c2C1=O)N1CCOC[C@@H]1C |r|
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccc(nc4)N4CC5CCC(C4)O5)c(F)c3)c2C1=O)N1C2CCC1COC2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(c4)N4CC5CCC(C4)O5)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)Nc4ccnc(c4)N4CCC(F)(F)CC4)c(F)c3)c2C1=O)N1CC2CCC(C1)O2
Oc1cc(ccc1F)-n1c2c3cc[nH]c3ncc2ccc1=O
CCOC(Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12)OCC
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2c1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(NC(C)=O)nc1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1cnc(N)nc1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1cnc2[nH]ccc2c1
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(N)nc1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(nc1)[N+]#[C-]
CSc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1cccc(c1)C(F)(F)F)-c1ccc(nc1)-n1cccn1
CN1CCN(CC1)c1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
COc1ncc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4cccc(c4)C(F)(F)F)c3c2n1
CN1Cc2cnc3ccc(nc3c2N(C1=O)c1ccc(cc1)C(C)(C)C#N)-c1cnc2ccccc2c1
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(C4CCN(CC4)C(=O)[C@@H](C)O)c3c2n1 |r|
COc1ccc(cn1)-c1ccc2ncc3CN(C)C(=O)N(C4CCNCC4)c3c2n1
C[C@H](Nc1ncnc2[nH]cnc12)c1nc2ccc(F)cc2c(=O)n1-c1ccccc1 |r|
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccccc2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c(OCC)c(n1)C(=O)OCC
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(N)=O)cc1
CCOc1c(nc(nc1C(=O)N1CCOCC1)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccccc2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc(Cl)c(SC)c(n1)N1CCOCC1
CCOc1c(nc(nc1C(=O)N1CCCCC1)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(F)cc2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(F)c(F)c2)cc1
CSc1c(nc(nc1N1CCN(CC1)S(C)(=O)=O)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
CCOc1c(CN2CCOCC2)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccccc2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OC)-c1ccc(NC(=O)Nc2ccccc2)cc1
COc1c(nc(nc1C(=O)N1CCOCC1)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
COc1c(nc(nc1C(=O)N1CCN(CC1)S(C)(=O)=O)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(Cl)c(SC)c(n1)N1CCOCC1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2cccnc2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(OCCN(C)C)cc2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)NC)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2cccnc2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCSCC2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2nccs2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2cccnc2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2cccnc2)cc1
CNC(=O)Nc1ccc(cc1)-c1ncc(OC)c(n1)N1CCOCC1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCSCC2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1
CSc1c(nc(nc1N1CCN(C)CC1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2nccs2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2cccc(NC(C)=O)c2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2cccc(c2)C(N)=O)cc1
CCOc1c(nc(nc1C(=O)N1CCOCC1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCSCC2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCOCC2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cn2)N2CCN(C)CC2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc3oc(=O)[nH]c3c2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=S)Nc2cccnc2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2cccc(c2)C(N)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2nccs2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(O)=O)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1F
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(O)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCOCC2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
CCOc1c(nc(nc1C(=O)N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(cc2)S(C)(=O)=O)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NC(C)=O)cc2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(NC(C)=O)cc2)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc3oc(=O)[nH]c3c2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1F
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NC(C)=O)cc2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)c(F)c1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(C)(=O)=O)cc1
CSc1c(nc(nc1-c1ccncc1)-c1ccc(NC(N)=O)cc1)N1CCOCC1
CSc1c(nc(nc1-c1ccncc1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1)N1CCOCC1
CSc1c(nc(nc1-c1ccncc1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1
CS(=O)c1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(C)(=O)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)c(F)c1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1F
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1F
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1F
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(CC2)S(C)(=O)=O)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(C)(=O)=O)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2cccc(NC(C)=O)c2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCCN(C)C)cc1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1
CSc1c(nc(nc1-c1cccnc1)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NC(C)=O)nc2)cc1
CCOC(=O)c1nc(nc(N2CCOCC2)c1OCC)-c1ccc(NC(=O)Nc2ccc(NC(C)=O)nc2)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccncc2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1
CCOc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(=O)(=O)N2CCOCC2)cc1
CSc1c(nc(nc1-c1ccncc1)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
O=C(Nc1ccc(cc1)C(=O)N1CCOCC1)Nc1ccc(cc1)-c1ncc(OCCN2CCOCC2)c(n1)N1CCOCC1
O=C(Nc1ccc(cc1)N1CCOCC1=O)Nc1ccc(cc1)-c1ncc(OCCN2CCOCC2)c(n1)N1CCOCC1
NC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2ncc(OCCN3CCOCC3)c(n2)N2CCOCC2)cc1
CSc1c(nc(nc1-c1cccnc1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2=O)cc1)N1CCOCC1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)cc1
CSc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccncc2)cc1
CSc1c(nc(nc1-c1cccnc1)-c1ccc(NC(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1)N1CCOCC1
CSc1c(nc(nc1-c1cccnc1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
CSc1c(nc(nc1-c1ccncc1)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccncc2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)S(=O)(=O)N2CCOCC2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccncc2)cc1
COc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccncc2)cc1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c(SC)c(n1)-c1ccncc1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c(SC)c(n1)-c1ccncc1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1ncc(OCCN2CCOCC2)c(n1)N1CCOCC1
CSc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccon2)cc1
COc1cnc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(CC2)S(C)(=O)=O)cc1
CCOc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2ccncc2)cc1
CCOc1c(Cl)nc(nc1N1CCOCC1)-c1ccc(NC(=O)Nc2cccnc2)cc1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1ccccn1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc[nH]n1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCCOCC1 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1ccc(cc1)-c1ncc[nH]1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc(F)cc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc(CO)cc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1ccccn1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccccn1 |r|
C1CN(CCO1)c1nc(N2CCOCC2)c2nc([nH]c2n1)-c1ccccn1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1cc[nH]n1 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc[nH]n1 |r|
CCC[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1C2CCC1CC(O)C2 |r,TLB:32:31:25:27.28,9:25:33.31.30:27.28|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1C2CCC1CC(O)C2 |r,TLB:9:25:33.31.30:27.28,THB:32:31:25:27.28|
CC[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCN(C)CC1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CC2(C1)CCCOC2 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCN(CC1)C1COC1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CC2COCC2C1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCC2COCC2C1 |r|
CC(C)[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCC(CC1)C(F)(F)F |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCC11CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCO[C@H](CO)C1 |r|
C[C@@H]1COCCN1c1nc(nc2[nH]c(nc12)-c1cccc2[nH]ccc12)N1CCO[C@@H](CO)C1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccc(N)nc1 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1ccc(N)nc1 |r|
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cnc(N)nc1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2nc([nH]c2n1)-c1ccc(cc1)-c1ncc[nH]1 |r|
COc1cc(-c2nc3c(nc(nc3[nH]2)N2CCOC[C@@H]2C)N2CCOC[C@H]2C)c2cc[nH]c2c1 |r|
COC(=O)c1cc(-c2nc3c(nc(nc3[nH]2)N2CCOC[C@H]2C)N2CCOC[C@H]2C)c2cc[nH]c2c1 |r|
CC(=O)c1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Nc1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Cn1c(=O)n(-c2cccc(c2)C(F)(F)F)c2c3nc(ccc3ncc2c1=O)-c1ccc(N)nc1
COc1ncc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
Nc1ncc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
FC(F)(F)c1cccc(c1)-n1c2c(cnc3ccc(nc23)-c2cnc3[nH]ccc3c2)c(=O)[nH]c1=O
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.99,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;8.5,-1.56,;9.99,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(c(=O)n(C)c3cnc2cc1F)C1(C)CCOCC1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4COC4)c3c2c1
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4C[C@H](O)C4)c3c2c1 |r,wD:25.25,27.28,(-9.98,.47,;-8.65,1.24,;-8.65,2.78,;-7.32,.47,;-5.98,1.24,;-4.65,.47,;-3.32,1.24,;-1.98,.47,;-.65,1.24,;.68,.47,;.68,-1.07,;-.65,-1.84,;-1.98,-1.07,;2.02,-1.84,;2.02,-3.38,;3.35,-4.15,;4.69,-3.38,;6.02,-4.15,;7.35,-3.38,;7.35,-1.84,;8.5,-.81,;9.98,-1.21,;7.87,.6,;8.64,1.93,;6.34,.43,;5.25,1.52,;3.71,1.52,;3.71,3.06,;2.62,4.15,;5.25,3.06,;6.02,-1.07,;4.69,-1.84,;3.35,-1.07,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;.68,-4.9,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(c3c2c1)C1(C)CCOCC1
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(C4CCOCC4)c(=O)n(C)c3cnc2cc1F
CN(C)CCCOc1ccc(cn1)-c1cc2c3n(C4COC4)c(=O)n(C)c3cnc2cc1F
CN(C)CCCOc1ccc(cn1)-c1cc2c3n([C@@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CN(C)CCCOc1ccc(cn1)-c1cc2c3n([C@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)[nH]c1=O |r,wD:4.6,2.1,(3.69,4.9,;3.29,3.41,;4.38,2.32,;4.38,.78,;5.92,.78,;5.92,2.32,;7.01,-.31,;6.69,-1.82,;8.02,-2.59,;8.02,-4.13,;6.69,-4.9,;5.36,-4.13,;4.02,-4.9,;2.69,-4.13,;2.69,-2.59,;4.02,-1.82,;5.36,-2.59,;1.36,-1.82,;1.36,-.28,;.02,.49,;-1.31,-.28,;-2.64,.49,;-3.98,-.28,;-5.31,.49,;-6.65,-.28,;-7.98,.49,;-9.31,-.28,;-7.98,2.03,;-1.31,-1.82,;.02,-2.59,;9.17,-1.56,;8.54,-.15,;9.31,1.19,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3[nH]c(=O)n(C4CCOCC4)c3c2c1
Cn1c2cnc3ccc(cc3c2n([C@@H]2C[C@H](O)C2)c1=O)-c1ccc(OCCCN2CCC2)nc1 |r,wD:13.14,15.17,(10.26,-1.21,;8.77,-.81,;7.63,-1.84,;7.63,-3.38,;6.3,-4.15,;4.96,-3.38,;3.63,-4.15,;2.29,-3.38,;2.29,-1.84,;3.63,-1.07,;4.96,-1.84,;6.3,-1.07,;6.62,.43,;5.53,1.52,;3.99,1.52,;3.99,3.06,;2.9,4.15,;5.53,3.06,;8.15,.6,;8.92,1.93,;.96,-1.07,;.96,.47,;-.37,1.24,;-1.71,.47,;-3.04,1.24,;-4.37,.47,;-5.71,1.24,;-7.04,.47,;-8.37,1.24,;-8.77,2.73,;-10.26,2.33,;-9.86,.84,;-1.71,-1.07,;-.37,-1.84,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2C[C@H](O)C2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r,wD:13.14,15.17,(10.5,-1.21,;9.02,-.81,;7.87,-1.84,;7.87,-3.38,;6.54,-4.15,;5.2,-3.38,;3.87,-4.15,;2.54,-3.38,;2.54,-1.84,;3.87,-1.07,;5.2,-1.84,;6.54,-1.07,;6.86,.43,;5.77,1.52,;4.23,1.52,;4.23,3.06,;3.14,4.15,;5.77,3.06,;8.39,.6,;9.16,1.93,;1.2,-1.07,;1.2,.47,;-.13,1.24,;-1.46,.47,;-2.8,1.24,;-4.13,.47,;-5.47,1.24,;-6.8,.47,;-8.13,1.24,;-8.13,2.78,;-9.6,3.25,;-10.5,2.01,;-9.6,.76,;-1.46,-1.07,;-.13,-1.84,)|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;-.65,-4.13,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r,wD:4.6,2.1,(3.02,4.9,;2.62,3.41,;3.71,2.32,;3.71,.78,;5.25,.78,;5.25,2.32,;6.34,-.31,;6.02,-1.82,;7.35,-2.59,;7.35,-4.13,;6.02,-4.9,;4.69,-4.13,;3.35,-4.9,;2.02,-4.13,;.68,-4.9,;2.02,-2.59,;3.35,-1.82,;4.69,-2.59,;.68,-1.82,;.68,-.28,;-.65,.49,;-1.98,-.28,;-3.32,.49,;-4.65,-.28,;-5.98,.49,;-7.32,-.28,;-8.65,.49,;-9.98,-.28,;-8.65,2.03,;-1.98,-1.82,;-.65,-2.59,;-.65,-4.13,;8.5,-1.56,;9.98,-1.95,;7.87,-.15,;8.64,1.19,)|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(4.18,4.94,;3.41,3.61,;4.18,2.27,;4.18,.73,;5.72,.73,;5.72,2.27,;6.81,-.35,;6.49,-1.86,;7.82,-2.63,;7.82,-4.17,;6.49,-4.94,;5.15,-4.17,;3.82,-4.94,;2.49,-4.17,;1.15,-4.94,;2.49,-2.63,;3.82,-1.86,;5.15,-2.63,;1.15,-1.86,;1.15,-.32,;-.18,.45,;-1.51,-.32,;-2.85,.45,;-4.18,-.32,;-5.52,.45,;-6.85,-.32,;-8.18,.45,;-8.18,1.99,;-9.65,2.46,;-10.55,1.22,;-9.65,-.03,;-1.51,-1.86,;-.18,-2.63,;8.97,-1.6,;10.55,-2.03,;8.34,-.19,;9.11,1.14,)|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.62,4.9,;3.22,3.41,;4.31,2.32,;4.31,.78,;5.85,.78,;5.85,2.32,;6.93,-.31,;6.61,-1.82,;7.95,-2.59,;7.95,-4.13,;6.61,-4.9,;5.28,-4.13,;3.95,-4.9,;2.61,-4.13,;2.61,-2.59,;3.95,-1.82,;5.28,-2.59,;1.28,-1.82,;1.28,-.28,;-.05,.49,;-1.39,-.28,;-2.72,.49,;-4.06,-.28,;-5.39,.49,;-6.72,-.28,;-8.06,.49,;-8.06,2.03,;-9.52,2.51,;-10.43,1.26,;-9.52,.02,;-1.39,-1.82,;-.05,-2.59,;9.09,-1.56,;10.43,-2.33,;8.47,-.15,;9.24,1.19,)|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.76,4.9,;3.37,3.41,;4.45,2.32,;4.45,.78,;5.99,.78,;5.99,2.32,;7.08,-.31,;6.76,-1.82,;8.1,-2.59,;8.1,-4.13,;6.76,-4.9,;5.43,-4.13,;4.1,-4.9,;2.76,-4.13,;2.76,-2.59,;4.1,-1.82,;5.43,-2.59,;1.43,-1.82,;1.43,-.28,;.09,.49,;-1.24,-.28,;-2.57,.49,;-3.91,-.28,;-5.24,.49,;-6.57,-.28,;-7.91,.49,;-7.91,2.03,;-9.24,2.8,;-10.57,2.03,;-10.57,.49,;-9.24,-.28,;-1.24,-1.82,;.09,-2.59,;9.24,-1.56,;10.57,-2.33,;8.61,-.15,;9.38,1.19,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCC2)nc1 |r|
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)[nH]c1=O |r,wD:4.6,2.1,(4.21,4.9,;3.81,3.41,;4.9,2.32,;4.9,.78,;6.44,.78,;6.44,2.32,;7.53,-.31,;7.21,-1.82,;8.54,-2.59,;8.54,-4.13,;7.21,-4.9,;5.88,-4.13,;4.54,-4.9,;3.21,-4.13,;3.21,-2.59,;4.54,-1.82,;5.88,-2.59,;1.87,-1.82,;1.87,-.28,;.54,.49,;-.79,-.28,;-2.13,.49,;-3.46,-.28,;-4.79,.49,;-6.13,-.28,;-7.46,.49,;-7.46,2.03,;-8.93,2.51,;-9.83,1.26,;-8.93,.02,;-.79,-1.82,;.54,-2.59,;9.69,-1.56,;9.06,-.15,;9.83,1.19,)|
O=c1[nH]c2cnc3ccc(cc3c2n1C1CCOCC1)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
CO[C@H]1C[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCC3)nc2)n(C)c1=O |r,wD:4.6,2.1,(3.37,4.9,;2.97,3.41,;4.06,2.32,;4.06,.78,;5.6,.78,;5.6,2.32,;6.69,-.31,;6.37,-1.82,;7.71,-2.59,;7.71,-4.13,;6.37,-4.9,;5.04,-4.13,;3.7,-4.9,;2.37,-4.13,;2.37,-2.59,;3.7,-1.82,;5.04,-2.59,;1.04,-1.82,;1.04,-.28,;-.3,.49,;-1.63,-.28,;-2.96,.49,;-4.3,-.28,;-5.63,.49,;-6.96,-.28,;-8.3,.49,;-8.7,1.98,;-10.18,1.58,;-9.79,.1,;-1.63,-1.82,;-.3,-2.59,;8.85,-1.56,;10.18,-2.33,;8.22,-.15,;8.99,1.19,)|
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCC2)nc1
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCOCC4)c3c2c1
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCCOC4)c3c2c1 |r|
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4C[C@@H](C4)OC)c3c2c1 |r,wD:24.24,26.29,(-9.91,.47,;-8.57,1.24,;-7.24,.47,;-5.91,1.24,;-4.57,.47,;-3.24,1.24,;-1.91,.47,;-.57,1.24,;.76,.47,;.76,-1.07,;-.57,-1.84,;-1.91,-1.07,;2.1,-1.84,;2.1,-3.38,;3.43,-4.15,;4.76,-3.38,;6.1,-4.15,;7.43,-3.38,;7.43,-1.84,;8.57,-.81,;9.91,-1.58,;7.95,.6,;8.72,1.93,;6.42,.43,;5.33,1.52,;3.79,1.52,;3.79,3.06,;5.33,3.06,;2.7,4.15,;1.21,3.75,;6.1,-1.07,;4.76,-1.84,;3.43,-1.07,)|
CNCCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCOC4)c3c2c1 |r|
Cn1c2cnc3cc(F)c(cc3c2n([C@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1cc2c3n([C@H]4CCCOC4)c(=O)n(C)c3cnc2cc1F |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCOC4)c3c2c1 |r|
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4CCC4)c3c2c1
CN(C)CCCOc1ccc(c(F)n1)-c1ccc2ncc3n(C)c(=O)n(C4COC4)c3c2c1
Cn1c2cnc3cc(F)c(cc3c2n(C2CCOCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCOC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1 |r|
Cn1c2cnc3ccc(cc3c2n(C2COC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCCC2)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1
Cn1c2cnc3ccc(cc3c2n([C@@H]2CCCOC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(NCCCN3CCCCC3)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(NCCCN3CCCCC3)nc2)n(C)c1=O |r|
CO[C@H]1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2F)n(C)c1=O |r|
CO[C@H]1CC[C@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
CO[C@@H]1CC[C@@H](C1)n1c2c(cnc3cc(F)c(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O |r|
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCNCC4)c3c2c1
COC(=O)N1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(OC)nc2)n(C)c1=O
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(CC4)C(C)=O)c3c2c1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cnn(CCCO)c1
Cn1c2cnc3ccc(cc3c2n(C2CNC2)c1=O)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(C2CC2)c1=O)-c1cnc2[nH]ccc2c1
Cn1c2cnc3ccc(cc3c2n(C2CC2)c1=O)-c1cnc(N)nc1
Cn1c2cnc3ccc(cc3c2n(C2CCOCC2)c1=O)-c1cnc(N)nc1
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1ccc2ncc3n(C)c(=O)n(C4CC4)c3c2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccc(-c3ccncc3)c2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2ccc(cc2s1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2ccc(cc2o1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1ccc2cc(ccc2n1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccncc3)n2c1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1ccc2oc(N)nc2c1
Nc1ncnc2ccc(cc12)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1ncc2cc(ccc2n1)-c1ccc2nccc(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccncc3)n2n1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(-c3ccccc3)c2c1
Nc1nc2cccc(-c3ccc4nccc(-c5ccncc5)c4c3)c2o1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(N3CCOCC3)c2c1
Cn1cc(cn1)-c1ccnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nccn2c1
Cn1cc(cn1)-c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)c1ccc(cn1)-c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
CN1CCN(CC1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C#N)c(-c3ccncc3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncnc(OC3CCOCC3)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(OC3CCOCC3)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccc4nc(N)oc4c3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(-c3ccnc(c3)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncn(C3CCOCC3)c(=O)c2c1
Cc1nc2ccc(nn2c1-c1ccncc1)-c1ccc2oc(N)nc2c1
CC(=O)N1CCC(CC1)Nc1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccn2ncc(-c3ccncc3)c2n1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCOCC1
CN1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(=O)[nH]c2c1
CC(C)N1CCC(CC1)n1cnc2ccc(cc2c1=O)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)-c1cccnc1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C#N)c(Cl)c2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(cc2c1)C#N
CCOC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2ccc3oc(N)nc3c2)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(NCCN3CCOCC3)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNC(=O)C1
CN(C1CCN(CC1)C(C)=O)c1ncnc2ccc(cc12)-c1ccc2oc(N)nc2c1
CN(C)CC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(C(=O)NC3CC[C@H](O)CC3)n2c1 |r,wU:23.25,(5.65,-3.53,;4.88,-2.2,;3.35,-2.04,;3.03,-.53,;1.7,.24,;1.7,1.78,;3.03,2.55,;4.37,1.78,;4.37,.24,;5.51,-.79,;.36,2.55,;.36,4.09,;-.97,4.86,;-2.3,4.09,;-3.77,4.56,;-4.67,3.32,;-3.77,2.07,;-4.17,.59,;-5.65,.19,;-3.08,-.5,;-1.99,-1.59,;-2.39,-3.08,;-1.3,-4.17,;.19,-3.77,;1.28,-4.86,;.59,-2.28,;-.5,-1.19,;-2.3,2.55,;-.97,1.78,)|
CN1CC(C1)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)C(=O)N1CCOCC1
CN1CCN(CC1)C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(CC1)N1CCOCC1
CC(=O)Nc1cc2ccc(cc2s1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2nc(N)sc2c1
Nc1nc2cc(ccc2o1)-c1cnc(N)nc1
CC(=O)Nc1cn2cc(ccc2n1)-c1ccc2oc(N)nc2c1
CC(=O)Nc1ncc(s1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1cccc2[nH]nc(N)c12
CC(C)Oc1nc(cnc1N)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2oc(N)nc2c1
Nc1nc2ccc(cc2o1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC[C@H](O)C1 |r|
C[C@@H]1CN(CCN1)C(=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CC(C)[C@@H](N)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
CN1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)C(=O)N1CCN(CC1)C1CC1
CN1CCN(CC1=O)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
N[C@@H](CO)C(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CN1CCN(CC1)C1CN(C1)C(=O)c1cnc2ccc(cn12)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCN(CC1)C1CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CC[C@@H](O)C1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)n1cccn1
Cc1ccn(n1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CC[C@H](O)C1 |r|
CN1CCN(CC1=O)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN(CC)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCNCC1
CC(=O)N1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CS(=O)(=O)N1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CCN1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2oc(N)nc2c1)N1CCOCC1
CC(C)N1CCN(CC1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCN(CCO)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCN(CC2CC2)CC1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCC(CC1)n1ccnc1
Nc1nc2cc(ccc2o1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
C[C@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Cc1cc2oc(N)nc2cc1-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
Cc1nccn1C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(c(F)cc2o1)-c1ccc2ncc(nc2c1)N1CC(C1)N1CCOCC1
CS(=O)(=O)N1CCN(CC1)C1CCN(CC1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
CN(C)[C@@H]1CCN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
CN1CCN(CC1)[C@@H]1CCN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCNC(C1)C(F)(F)F
CC1(C)CN(CCN1)C1CN(C1)c1cnc2ccc(cc2n1)-c1ccc2oc(N)nc2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
CS(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(C(=O)N3CCOCC3)n2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2n1)N1CC(C1)N1CCOCC1
C[C@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1 |r|
C[C@@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2n1)N1C2CCC1COC2
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2n1)N1CC(C1)N1CCN(CC2CC2)CC1
NCC(=O)N1CCN(CC1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
CC(C)(N)C(=O)N1CCN(CC1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2n1)N1CCN(CC1)C(=O)C1(N)CC1
CC(C)N1CCN(CC1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2n1)N1CC(C1)N1CCN(CCO)CC1
C[C@H]1CN(CCN1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1 |r|
C[C@@H]1CN(CCN1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1 |r|
Cc1nccn1C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
CC1(C)CN(CCN1)C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(cc2n1)N1CC(C1)N1CCOCC1
C[C@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1 |r|
C[C@H]1CN(CCN1C)C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1 |r|
C[C@@H]1CN(CCN1)C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1 |r|
C[C@@H]1CN(CCN1C)C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1 |r|
CC1(C)CN(CCN1)C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(cc2n1)N1CC(C1)N1CCN(CC2CC2)CC1
C[C@H]1COCCN1C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1 |r|
Cc1nccn1C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1
CN1CCN(CC1=O)C1CN(C1)c1cnc2ccc(nc2c1)-c1ccc2oc(N)nc2c1
Nc1nc2cc(ccc2o1)-c1ccc2ncc(cc2n1)N1CC(C1)N1CCN(CCO)CC1
CN1CCN(CC1)C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
CC(C)N1CCN(CC1)C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
CCN1CCN(CC1)C1CN(C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
CN1CC2CN(CC2C1)c1cnc2ccc(nc2n1)-c1ccc2oc(N)nc2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCCN(C4)C(=O)CO)c3c2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCCN(C4)C(=O)c4nc[nH]n4)c3c2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCCN(C4)S(C)(=O)=O)c3c2c1
C[C@H](O)C(=O)N1CCCC(C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O |r|
C[C@@H](O)C(=O)N1CCCC(C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O |r|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C4)S(C)(=O)=O)c3c2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C4)C(=O)CO)c3c2c1
CN1CCC(C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O
CCN1CCC(C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O
CC(=O)N1CCC(C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(Cc5ccccc5)C4)c3c2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C4)S(=O)(=O)c4ccc(Cl)cc4)c3c2c1
Cc1ccc(cc1)S(=O)(=O)N1CCC(C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C4)S(N)(=O)=O)c3c2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C4)C(=O)C(F)(F)F)c3c2c1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2c1 |r,wU:24.25,wD:27.29,(-8.04,3.72,;-7.27,2.38,;-5.73,2.38,;-5.26,.92,;-6.5,.01,;-7.75,.92,;-3.92,.15,;-3.92,-1.39,;-2.59,-2.16,;-1.26,-1.39,;-1.26,.15,;-2.59,.92,;.08,-2.16,;.08,-3.7,;1.41,-4.47,;2.74,-3.7,;4.08,-4.47,;5.41,-3.7,;5.41,-2.16,;6.56,-1.13,;8.04,-1.53,;5.93,.28,;6.33,1.76,;4.4,.12,;3.31,1.2,;1.82,.81,;.73,1.89,;1.13,3.38,;.04,4.47,;2.62,3.78,;3.71,2.69,;4.08,-1.39,;2.74,-2.16,;1.41,-1.39,)|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CC[C@H](O)CC4)c3c2c1 |r,wU:24.25,27.29,(-7.7,4.27,;-6.93,2.93,;-5.47,2.46,;-5.47,.92,;-6.93,.44,;-7.84,1.69,;-4.13,.15,;-4.13,-1.39,;-2.8,-2.16,;-1.46,-1.39,;-1.46,.15,;-2.8,.92,;-.13,-2.16,;-.13,-3.7,;1.2,-4.47,;2.54,-3.7,;3.87,-4.47,;5.2,-3.7,;5.2,-2.16,;6.35,-1.13,;7.84,-1.53,;5.72,.28,;6.49,1.61,;4.19,.12,;3.1,1.2,;3.5,2.69,;2.41,3.78,;.92,3.38,;-.17,4.47,;.52,1.89,;1.61,.81,;3.87,-1.39,;2.54,-2.16,;1.2,-1.39,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CC[C@H](O)CC2)c1=O)-c1ccc(nc1)-c1ccccc1 |r,wU:13.14,16.18,(7.98,-1.53,;6.5,-1.13,;5.35,-2.16,;5.35,-3.7,;4.02,-4.47,;2.69,-3.7,;1.35,-4.47,;.02,-3.7,;.02,-2.16,;1.35,-1.39,;2.69,-2.16,;4.02,-1.39,;4.34,.12,;3.25,1.2,;3.65,2.69,;2.56,3.78,;1.07,3.38,;-.02,4.47,;.67,1.89,;1.76,.81,;5.87,.28,;6.27,1.76,;-1.32,-1.39,;-2.65,-2.16,;-3.98,-1.39,;-3.98,.15,;-2.65,.92,;-1.32,.15,;-5.32,.92,;-5.32,2.46,;-6.65,3.23,;-7.98,2.46,;-7.98,.92,;-6.65,.15,)|
COc1ncc(cc1C)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CC[C@H](O)CC4)c3c2c1 |r,wU:21.21,24.25,(-7.32,.15,;-5.98,.92,;-4.65,.15,;-3.32,.92,;-1.98,.15,;-1.98,-1.39,;-3.32,-2.16,;-4.65,-1.39,;-5.98,-2.16,;-.65,-2.16,;-.65,-3.7,;.68,-4.47,;2.02,-3.7,;3.35,-4.47,;4.69,-3.7,;4.69,-2.16,;5.83,-1.13,;7.32,-1.53,;5.2,.28,;5.6,1.76,;3.67,.12,;2.58,1.2,;2.98,2.69,;1.89,3.78,;.41,3.38,;-.68,4.47,;.01,1.89,;1.1,.81,;3.35,-1.39,;2.02,-2.16,;.68,-1.39,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CC[C@H](O)CC2)c1=O)-c1cnn(c1)-c1ccccc1 |r,wU:13.14,16.18,(8.15,-1.53,;6.66,-1.13,;5.51,-2.16,;5.51,-3.7,;4.18,-4.47,;2.85,-3.7,;1.51,-4.47,;.18,-3.7,;.18,-2.16,;1.51,-1.39,;2.85,-2.16,;4.18,-1.39,;4.5,.12,;3.41,1.2,;3.81,2.69,;2.72,3.78,;1.23,3.38,;.14,4.47,;.83,1.89,;1.92,.81,;6.03,.28,;6.43,1.76,;-1.16,-1.39,;-1.16,.15,;-2.62,.62,;-3.53,-.62,;-2.62,-1.87,;-5.07,-.62,;-5.84,-1.95,;-7.38,-1.95,;-8.15,-.62,;-7.38,.71,;-5.84,.71,)|
Cc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CC[C@H](O)CC4)c3c2c1 |r,wU:19.19,22.23,(-6.65,.92,;-5.32,.15,;-5.32,-1.39,;-3.98,-2.16,;-2.65,-1.39,;-2.65,.15,;-3.98,.92,;-1.32,-2.16,;-1.32,-3.7,;.02,-4.47,;1.35,-3.7,;2.69,-4.47,;4.02,-3.7,;4.02,-2.16,;5.16,-1.13,;6.65,-1.53,;4.54,.28,;4.94,1.76,;3.01,.12,;1.92,1.2,;2.31,2.69,;1.23,3.78,;-.26,3.38,;-1.35,4.47,;-.66,1.89,;.43,.81,;2.69,-1.39,;1.35,-2.16,;.02,-1.39,)|
Cn1c2cnc3ccc(cc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1cnn(c1)-c1ccccc1 |r,wU:13.14,wD:16.18,(8.1,-2.15,;6.77,-1.38,;5.52,-2.28,;5.36,-3.82,;3.96,-4.44,;2.71,-3.54,;1.3,-4.16,;.06,-3.26,;.22,-1.73,;1.63,-1.1,;2.87,-2,;4.28,-1.38,;4.75,.09,;3.67,1.17,;2.18,.78,;1.09,1.87,;1.49,3.35,;.4,4.44,;2.98,3.75,;4.06,2.66,;6.29,.09,;7.06,1.42,;-1.11,-.96,;-1.11,.58,;-2.58,1.06,;-3.48,-.19,;-2.58,-1.43,;-5.02,-.19,;-5.79,1.15,;-7.33,1.15,;-8.1,-.19,;-7.33,-1.52,;-5.79,-1.52,)|
COc1ncc(cc1C)-c1ccc2ncc3n(C)c(=O)n([C@H]4CC[C@H](O)CC4)c3c2c1 |r,wU:21.21,wD:24.25,(-6.65,2.46,;-6.65,.92,;-5.32,.15,;-3.98,.92,;-2.65,.15,;-2.65,-1.39,;-3.98,-2.16,;-5.32,-1.39,;-6.65,-2.16,;-1.32,-2.16,;-1.32,-3.7,;.02,-4.47,;1.35,-3.7,;2.69,-4.47,;4.02,-3.7,;4.02,-2.16,;5.16,-1.13,;6.65,-1.53,;4.54,.28,;5.31,1.61,;3.01,.12,;1.92,1.2,;.43,.81,;-.66,1.89,;-.26,3.38,;-1.35,4.47,;1.23,3.78,;2.31,2.69,;2.69,-1.39,;1.35,-2.16,;.02,-1.39,)|
Cn1c2cnc3ccc(cc3c2n([C@H]2CC[C@H](O)CC2)c1=O)-c1ccc(nc1)-c1ccccc1 |r,wU:13.14,wD:16.18,(7.98,-1.53,;6.5,-1.13,;5.35,-2.16,;5.35,-3.7,;4.02,-4.47,;2.69,-3.7,;1.35,-4.47,;.02,-3.7,;.02,-2.16,;1.35,-1.39,;2.69,-2.16,;4.02,-1.39,;4.34,.12,;3.25,1.2,;1.76,.81,;.67,1.89,;1.07,3.38,;-.02,4.47,;2.56,3.78,;3.65,2.69,;5.87,.28,;6.64,1.61,;-1.32,-1.39,;-2.65,-2.16,;-3.98,-1.39,;-3.98,.15,;-2.65,.92,;-1.32,.15,;-5.32,.92,;-5.32,2.46,;-6.65,3.23,;-7.98,2.46,;-7.98,.92,;-6.65,.15,)|
Cn1c2cnc3ccc(cc3c2n([C@@H]2CC[C@H](O)CC2)c1=O)-c1ccc(N)nc1 |r,wU:13.14,16.18,(6.65,-1.53,;5.16,-1.13,;4.02,-2.16,;4.02,-3.7,;2.69,-4.47,;1.35,-3.7,;.02,-4.47,;-1.32,-3.7,;-1.32,-2.16,;.02,-1.39,;1.35,-2.16,;2.69,-1.39,;3.01,.12,;1.92,1.2,;2.31,2.69,;1.23,3.78,;-.26,3.38,;-1.35,4.47,;-.66,1.89,;.43,.81,;4.54,.28,;5.31,1.61,;-2.65,-1.39,;-3.98,-2.16,;-5.32,-1.39,;-5.32,.15,;-6.65,.92,;-3.98,.92,;-2.65,.15,)|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCN(C4)S(C)(=O)=O)c3c2c1 |r|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCN(C4)S(C)(=O)=O)c3c2c1 |r|
CCS(=O)(=O)N1CC[C@@H](C1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O |r|
Cn1c2cnc3ccc(cc3c2n([C@H]2CCN(C2)S(C)(=O)=O)c1=O)-c1ccc(nc1)-c1ccccc1 |r|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CCCN(C4)S(C)(=O)=O)c3c2c1 |r|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCCC(O)C4)c3c2c1
CC(=O)N[C@H]1CC[C@H](CC1)n1c2c(cnc3ccc(cc23)-c2ccc(nc2)-c2cnn(C)c2)n(C)c1=O |r,wU:7.10,4.3,(-2.74,4.82,;-1.65,3.73,;-2.05,2.24,;-.17,4.13,;.92,3.04,;2.41,3.44,;3.5,2.35,;3.1,.86,;1.61,.46,;.52,1.55,;4.19,-.23,;3.87,-1.74,;5.2,-2.51,;5.2,-4.05,;3.87,-4.82,;2.54,-4.05,;1.2,-4.82,;-.13,-4.05,;-.13,-2.51,;1.2,-1.74,;2.54,-2.51,;-1.46,-1.74,;-2.8,-2.51,;-4.13,-1.74,;-4.13,-.2,;-2.8,.57,;-1.46,-.2,;-5.47,.57,;-6.93,.1,;-7.84,1.34,;-6.93,2.59,;-7.7,3.92,;-5.47,2.11,;6.35,-1.48,;7.84,-1.87,;5.72,-.07,;6.49,1.26,)|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CC[C@@H](CC4)NS(C)(=O)=O)c3c2c1 |r,wU:24.25,27.32,(-7.7,3.72,;-6.93,2.39,;-5.47,1.91,;-5.47,.37,;-6.93,-.1,;-7.84,1.14,;-4.13,-.4,;-4.13,-1.94,;-2.8,-2.71,;-1.46,-1.94,;-1.46,-.4,;-2.8,.37,;-.13,-2.71,;-.13,-4.25,;1.2,-5.02,;2.54,-4.25,;3.87,-5.02,;5.2,-4.25,;5.2,-2.71,;6.35,-1.68,;7.84,-2.07,;5.72,-.27,;6.49,1.07,;4.19,-.43,;3.1,.66,;3.5,2.15,;2.41,3.24,;.92,2.84,;.52,1.35,;1.61,.26,;-.17,3.93,;-1.65,3.53,;-3.14,3.13,;-2.05,5.02,;-1.25,2.04,;3.87,-1.94,;2.54,-2.71,;1.2,-1.94,)|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@@H]4CC[C@@H](CC4)C(O)=O)c3c2c1 |r,wU:24.25,27.32,(-7.7,3.92,;-6.93,2.59,;-5.47,2.11,;-5.47,.57,;-6.93,.1,;-7.84,1.34,;-4.13,-.2,;-4.13,-1.74,;-2.8,-2.51,;-1.46,-1.74,;-1.46,-.2,;-2.8,.57,;-.13,-2.51,;-.13,-4.05,;1.2,-4.82,;2.54,-4.05,;3.87,-4.82,;5.2,-4.05,;5.2,-2.51,;6.35,-1.48,;7.84,-1.87,;5.72,-.07,;6.49,1.26,;4.19,-.23,;3.1,.86,;3.5,2.35,;2.41,3.44,;.88,3.08,;.52,1.55,;1.61,.46,;-.2,4.16,;.19,5.65,;-1.69,3.77,;3.87,-1.74,;2.54,-2.51,;1.2,-1.74,)|
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCCN(C4)S(C)(=O)=O)c3c2n1
Cn1cc(cn1)-c1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n([C@H]4CCN(C4)S(C)(=O)=O)c3c2n1 |r|
Cn1c2cnc3ccc(nc3c2n([C@H]2CCN(C2)S(C)(=O)=O)c1=O)-c1ccc(nc1)-c1ccccc1 |r|
CN(CCS(C)(=O)=O)Cc1nc2c(N)cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1c(Cc2c(CNCCS(C)(=O)=O)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cc2c(CNCCO)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cc2c(CNCCO)nc3c(cc(nn23)N2CCOCC2)-c2ncc[nH]2)cccc1C(F)(F)F
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(N)cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1ncc[nH]1
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1ccn[nH]1
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(N)=O
Cc1nc2c(cc(nn2c1Cc1cccc(Cl)c1C)N1CCOCC1)C(N)=O
Cc1nc2c(cc(nn2c1Cc1cccc(C)c1C)N1CCOCC1)C(O)=O
Cc1nc2c(cc(nn2c1Cc1cccc(Cl)c1C)N1CCOCC1)C(O)=O
Cc1c(Cc2c(CO)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cc2c(CO)nc3c(cc(nn23)N2CCOCC2)C(N)=O)cccc1C(F)(F)F
Cc1c(Cc2c(CF)nc3c(cc(nn23)N2CCOCC2)C(N)=O)cccc1C(F)(F)F
Cc1c(Cc2c(CF)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
CC(=O)NCc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1ncc[nH]1
Cc1c(Cc2c(CO)nc3c(cc(nn23)N2CCOCC2)-c2cnc[nH]2)cccc1C(F)(F)F
Cc1c(Cc2c(CO)nc3c(cc(nn23)N2CCOCC2)-c2ncc[nH]2)cccc1C(F)(F)F
Cc1c(Cc2c(CO)nc3c(cc(nn23)N2CCOCC2)-c2ccn[nH]2)cccc1C(F)(F)F
Cc1c(Cc2c(CO)nc3c(cc(nn23)N2CCOCC2)C(O)=O)cccc1C(F)(F)F
Cc1c(Cc2c(CCO)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Cc2c(CCO)nc3c(cc(nn23)N2CCOCC2)-c2c[nH]cn2)cccc1C(F)(F)F
CC1CN(CCO1)c1cc(-c2c[nH]cn2)c2nc(CO)c(Cc3cccc(c3C)C(F)(F)F)n2n1
CC1CN(CCO1)c1cc(N)c2nc(CO)c(Cc3cccc(c3C)C(F)(F)F)n2n1
CC1CN(CCO1)c1cc(C(O)=O)c2nc(C)c(Cc3cccc(c3C)C(F)(F)F)n2n1
Cc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)C1=CCOCC1)C(O)=O |t:25|
CC(O)c1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1c[nH]cn1
CC(O)c1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1ncc[nH]1
CC(O)c1nc2c(N)cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nc2c(cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1ncc[nH]1
Cc1nc2c(cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
Cc1c(Nc2c(CO)nc3c(cc(nn23)N2CCOCC2)C(N)=O)cccc1C(F)(F)F
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCOCC1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(C)c1C)N1CCOCC1
Cc1nc2c(cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(N)=O
Cc1nc2c(cc(nn2c1Nc1cccc(c1CN1CCOCC1)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(cc(nn2c1Nc1cccc2CCNCc12)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCS(=O)(=O)CC1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(F)c1C)N1CCOCC1
Cc1nc2c(cc(nn2c1Nc1cccc(c1CN1CC(O)C1)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCC(C1)S(C)(=O)=O)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CC(C1)S(C)(=O)=O)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCC2(CS(=O)(=O)C2)C1)C(F)(F)F)N1CCOCC1
Cc1nc2c(cc(nn2c1Nc1cccc(F)c1C)N1CCOCC1)-c1c[nH]cn1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CO)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CC(O)C1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CC2(CCS2(=O)=O)C1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCC(CC1)S(C)(=O)=O)C(F)(F)F)N1CCOCC1
CC(CO)NCc1c(Nc2c(C)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
CN1CCN(Cc2c(Nc3c(C)nc4c(cc(nn34)N3CCOCC3)-c3c[nH]cn3)cccc2C(F)(F)F)CC1
CN1CCN(Cc2c(Nc3c(C)nc4c(N)cc(nn34)N3CCOCC3)cccc2C(F)(F)F)CC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1C1CCNCC1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(C)c1C1CCNCC1)N1CCOCC1
CC(=O)OCc1nc2c(N)cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCCC1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(F)c1CN1CCOCC1)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc2CNCCc12)N1CCOCC1
Cc1c(Nc2c(CO)nc3c(N)cc(nn23)N2CCOC(CO)C2)cccc1C(F)(F)F
Cc1c(Cl)cccc1Nc1c(CO)nc2c(cc(nn12)N1CCOCC1)-c1c[nH]cn1
Cc1c(Nc2c(CO)nc3c(cc(nn23)N2CCOC(CO)C2)-c2c[nH]cn2)cccc1C(F)(F)F
Cc1nc2c(N)cc(nn2c1Nc1ccccc1CN1CCOCC1)N1CCOCC1
CC(CO)NCc1c(F)cccc1Nc1c(C)nc2c(N)cc(nn12)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1C1CCN(CCO)CC1)C(F)(F)F)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Nc1cccc(c1CN1CCC(O)C1)C(F)(F)F)N1CCOCC1
CC(N)C(=O)OCc1nc2c(N)cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1c(Nc2c(COC(=O)C(N)Cc3ccccc3)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
CCC(C)C(N)C(=O)OCc1nc2c(N)cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1
CC(C)C(N)C(=O)OCc1nc2c(N)cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1
Cc1c(Nc2c(COC(=O)C3(CC3)NC(=O)OC(C)(C)C)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1c(Nc2c(CN)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1nc2c(cc(nn2c1Nc1ccccc1N1CCOCC1)N1CCOCC1)C(O)=O
Cc1nc2c(cc(nn2c1Nc1ccccc1N1CCOCC1)N1CCOCC1)C(N)=O
Cc1nc2c(N)cc(nn2c1Nc1ccccc1N1CCOCC1)N1CCOCC1
Cc1nc2c(cc(nn2c1Nc1ccccc1N1CCOCC1)N1CCOCC1)-c1ccn[nH]1
Cc1c(Cc2c(nc3c(N)cc(nn23)N2CCOCC2)C(O)CN)cccc1C(F)(F)F
Cc1c(F)cccc1Cc1c(CO)nc2c(N)cc(nn12)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Cc1cccc(F)c1CO)N1CCOCC1
Cc1c(F)cccc1Cc1c(CNCCO)nc2c(N)cc(nn12)N1CCOCC1
CCc1c(F)cccc1Cc1c(CO)nc2c(N)cc(nn12)N1CCOCC1
CCc1c(F)cccc1Cc1c(CNCCO)nc2c(N)cc(nn12)N1CCOCC1
CC(CO)NCc1c(F)cccc1Cc1c(CO)nc2c(N)cc(nn12)N1CCOCC1
CC(CO)NCc1c(F)cccc1Cc1c(C)nc2c(N)cc(nn12)N1CCOCC1
Nc1cc(nn2c(Cc3cccc(c3C3CCNCC3)C(F)(F)F)c(CO)nc12)N1CCOCC1
Nc1cc(nn2c(Cc3cccc(c3C3CCN(CCO)CC3)C(F)(F)F)c(CO)nc12)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Cc1cccc(F)c1C1CCNCC1)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Cc1cccc(F)c1C1CCN(CCO)CC1)N1CCOCC1
Nc1cc(nn2c(Cc3cccc(F)c3C3CCN(CCO)CC3)c(CO)nc12)N1CCOCC1
Cc1nc2c(N)cc(nn2c1Cc1cccc2CCNCc12)N1CCOCC1
Cc1cccc(NS(=O)(=O)c2ccc(C)c(c2)-c2cnc(N)c(c2)-c2cnn(CC(F)(F)F)c2)n1
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)c1)S(=O)(=O)NCCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(CC(F)(F)F)c1)S(=O)(=O)NCCC(C)(C)O
Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(-4.52,5,;-4.52,3.46,;-5.85,2.69,;-5.85,1.15,;-4.52,.38,;-3.19,1.15,;-3.19,2.69,;-1.85,3.47,;-1.85,5.01,;-.52,5.77,;.82,5.01,;2.15,5.78,;.82,3.47,;-.52,2.7,;2.15,2.69,;2.15,1.15,;3.61,.68,;4.52,1.92,;6.06,1.92,;3.61,3.17,;-4.52,-1.16,;-6.06,-1.16,;-2.98,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5.01,;.82,-5.78,;-1.85,-5.78,;-3.19,-5.01,)|
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(CC(F)(F)F)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:28.30,wD:31.34,(-5.65,4.23,;-5.65,2.69,;-6.98,1.92,;-6.98,.38,;-5.65,-.39,;-4.31,.38,;-4.31,1.92,;-2.98,2.7,;-2.98,4.24,;-1.65,5,;-.31,4.24,;1.02,5.01,;-.31,2.7,;-1.65,1.93,;1.02,1.92,;1.02,.38,;2.49,-.09,;3.39,1.15,;4.93,1.15,;5.7,2.49,;4.93,3.82,;6.47,3.82,;7.19,2.09,;2.49,2.4,;-5.65,-1.93,;-7.19,-1.93,;-4.11,-1.93,;-5.65,-3.47,;-4.31,-4.24,;-2.98,-3.47,;-1.65,-4.24,;-1.65,-5.78,;-.31,-6.55,;-2.98,-6.55,;-4.31,-5.78,)|
Cc1cc(ccn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:25.27,wD:28.31,(6.1,2.69,;4.77,1.92,;3.44,2.7,;2.1,1.92,;2.1,.39,;3.44,-.39,;4.77,.39,;.77,2.7,;-.56,1.93,;-1.9,2.7,;-1.9,4.24,;-.56,5,;.77,4.24,;2.1,5.01,;-3.23,1.92,;-3.23,.38,;-4.56,-.39,;-5.9,.38,;-5.9,1.92,;-4.56,2.69,;-4.56,4.23,;-4.56,-1.93,;-6.1,-1.93,;-3.02,-1.93,;-4.56,-3.47,;-3.23,-4.24,;-1.9,-3.47,;-.56,-4.24,;-.56,-5.78,;.77,-6.55,;-1.9,-6.55,;-3.23,-5.78,)|
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(-4.52,5,;-4.52,3.46,;-5.85,2.69,;-5.85,1.15,;-4.52,.38,;-3.19,1.15,;-3.19,2.69,;-1.85,3.47,;-1.85,5.01,;-.52,5.77,;.82,5.01,;2.15,5.78,;.82,3.47,;-.52,2.7,;2.15,2.69,;2.15,1.15,;3.61,.68,;4.52,1.92,;6.06,1.92,;3.61,3.17,;-4.52,-1.16,;-6.06,-1.16,;-2.98,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5,;.82,-5.78,;-1.85,-5.77,;-3.19,-5,)|
CCc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC[C@H]1CCOC1 |r|
Cc1cc(sn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
CC(C)c1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cnc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(7.96,1.93,;6.42,1.93,;5.51,.68,;4.05,1.15,;4.05,2.69,;5.51,3.17,;2.71,3.47,;1.38,2.69,;.05,3.47,;.05,5,;1.38,5.78,;2.71,5,;4.05,5.78,;-1.29,2.69,;-1.29,1.15,;-2.62,.38,;-3.96,1.15,;-3.96,2.69,;-2.62,3.47,;-2.62,5,;-2.62,-1.15,;-4.16,-1.15,;-1.08,-1.15,;-2.62,-2.69,;-3.96,-3.47,;-3.96,-5,;-5.29,-5.78,;-6.62,-5,;-7.96,-5.78,;-6.62,-3.47,;-5.29,-2.69,)|
CCc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(5.15,-.65,;4.38,.68,;2.92,1.16,;2.92,2.7,;4.38,3.17,;5.29,1.93,;1.59,3.47,;.25,2.7,;-1.08,3.47,;-1.08,5.01,;.25,5.78,;1.59,5.01,;2.92,5.78,;-2.42,2.7,;-2.42,1.16,;-3.75,.39,;-5.08,1.16,;-5.08,2.7,;-3.75,3.47,;-3.75,5.01,;-3.75,-1.15,;-5.29,-1.15,;-2.21,-1.15,;-3.75,-2.69,;-2.42,-3.46,;-1.08,-2.69,;.25,-3.46,;.25,-5,;1.59,-5.77,;-1.08,-5.78,;-2.42,-5,)|
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC(O)C1 |(6.66,-.88,;5.89,.45,;6.8,1.7,;5.89,2.95,;4.43,2.47,;4.43,.93,;3.09,3.24,;1.76,2.47,;.43,3.24,;.43,4.78,;1.76,5.55,;3.09,4.78,;4.43,5.55,;-.91,2.47,;-.91,.93,;-2.24,.16,;-3.58,.93,;-3.58,2.47,;-2.24,3.24,;-2.24,4.78,;-2.24,-1.38,;-3.78,-1.38,;-.7,-1.38,;-2.24,-2.92,;-3.58,-3.69,;-5.06,-3.29,;-5.46,-4.78,;-6.8,-5.55,;-3.97,-5.18,)|
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1C[C@H](O)C1 |r,wU:24.26,26.29,(6.66,-.88,;5.89,.45,;6.8,1.7,;5.89,2.95,;4.43,2.47,;4.43,.93,;3.09,3.24,;1.76,2.47,;.43,3.24,;.43,4.78,;1.76,5.55,;3.09,4.78,;4.43,5.55,;-.91,2.47,;-.91,.93,;-2.24,.16,;-3.58,.93,;-3.58,2.47,;-2.24,3.24,;-2.24,4.78,;-2.24,-1.38,;-.7,-1.38,;-3.78,-1.38,;-2.24,-2.92,;-3.58,-3.69,;-5.06,-3.29,;-5.46,-4.78,;-6.8,-5.55,;-3.97,-5.18,)|
Cc1nnc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(5.15,-.34,;4.38,1,;5.29,2.24,;4.38,3.49,;2.92,3.01,;2.92,1.47,;1.59,3.78,;.25,3.01,;-1.08,3.78,;-1.08,5.32,;.25,6.09,;1.59,5.32,;2.92,6.09,;-2.42,3.01,;-2.42,1.47,;-3.75,.7,;-5.08,1.47,;-5.08,3.01,;-3.75,3.78,;-3.75,5.32,;-3.75,-.84,;-2.21,-.84,;-5.29,-.84,;-3.75,-2.38,;-2.42,-3.15,;-2.02,-4.63,;-.53,-4.23,;-.13,-5.72,;1.36,-5.32,;2.69,-6.09,;.96,-3.84,;-.93,-2.75,)|
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC2(C[C@H](O)C2)C1 |r,wU:24.26,28.31,(5.15,-7.55,;4.38,-6.22,;5.29,-4.97,;4.38,-3.73,;2.92,-4.2,;2.92,-5.74,;1.59,-3.43,;.25,-4.2,;-1.08,-3.43,;-1.08,-1.89,;.25,-1.12,;1.59,-1.89,;2.92,-1.12,;-2.42,-4.2,;-2.42,-5.74,;-3.75,-6.51,;-5.08,-5.74,;-5.08,-4.2,;-3.75,-3.43,;-3.75,-1.89,;-3.75,-8.05,;-2.21,-8.05,;-5.29,-8.05,;-3.75,-9.59,;-2.42,-10.36,;-.93,-9.97,;-.53,-11.45,;-.13,-12.94,;1.36,-12.54,;2.69,-13.31,;.96,-11.05,;-2.02,-11.85,)|
Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCCO
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(7.05,-.65,;6.28,.68,;7.19,1.93,;6.28,3.17,;4.82,2.69,;4.82,1.15,;3.48,3.47,;2.15,2.69,;.82,3.47,;.82,5,;2.15,5.78,;3.48,5,;4.82,5.78,;-.52,2.69,;-.52,1.15,;-1.85,.38,;-3.19,1.15,;-3.19,2.69,;-1.85,3.47,;-1.85,5,;-1.85,-1.15,;-.31,-1.15,;-3.39,-1.15,;-1.85,-2.69,;-3.19,-3.47,;-3.19,-5,;-4.52,-5.78,;-5.85,-5,;-7.19,-5.78,;-5.85,-3.47,;-4.52,-2.69,)|
Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(ccn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1
Cc1ccc(cc1-c1cnc(N)c(c1)-c1ccncc1)S(=O)(=O)NCCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](CO)CC1 |r,wU:24.26,wD:27.30,(5.5,-.1,;4.73,1.23,;5.2,2.69,;3.96,3.6,;2.71,2.69,;3.19,1.23,;1.38,3.47,;.04,2.69,;-1.29,3.47,;-1.29,5,;.04,5.78,;1.38,5,;2.71,5.78,;-2.62,2.69,;-2.62,1.15,;-3.96,.38,;-5.29,1.15,;-5.29,2.69,;-3.96,3.47,;-3.96,5,;-3.96,-1.15,;-2.42,-1.15,;-5.5,-1.15,;-3.96,-2.69,;-2.62,-3.47,;-1.29,-2.69,;.04,-3.47,;.04,-5,;1.38,-5.78,;2.71,-5,;-1.29,-5.78,;-2.62,-5,)|
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOCC(C)(C)O
Cc1nn(C)cc1-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(3.91,-5.14,;5.24,-4.37,;6.7,-4.85,;7.61,-3.6,;9.15,-3.6,;6.7,-2.36,;5.24,-2.83,;3.91,-2.06,;2.57,-2.83,;1.24,-2.06,;1.24,-.52,;2.57,.25,;3.91,-.52,;5.24,.25,;-.1,-2.83,;-1.43,-2.06,;-2.76,-2.83,;-2.76,-4.37,;-1.43,-5.14,;-.1,-4.37,;1.24,-5.14,;-4.1,-2.06,;-4.1,-.52,;-4.87,-3.4,;-5.43,-1.29,;-6.2,.04,;-7.69,.44,;-7.29,1.92,;-6.89,3.41,;-8.38,3.81,;-9.15,5.14,;-8.78,2.32,;-5.8,1.53,)|
Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(9.15,-3.6,;7.61,-3.6,;6.7,-4.85,;5.24,-4.37,;5.24,-2.83,;6.7,-2.36,;3.91,-2.06,;2.57,-2.83,;1.24,-2.06,;1.24,-.52,;2.57,.25,;3.91,-.52,;5.24,.25,;-.1,-2.83,;-1.43,-2.06,;-2.76,-2.83,;-2.76,-4.37,;-1.43,-5.14,;-.1,-4.37,;1.24,-5.14,;-4.1,-2.06,;-4.1,-.52,;-4.87,-3.4,;-5.43,-1.29,;-6.2,.04,;-7.69,.44,;-7.29,1.92,;-6.89,3.41,;-8.38,3.81,;-9.15,5.14,;-8.78,2.32,;-5.8,1.53,)|
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CCOC1
Cc1cccc(NS(=O)(=O)c2ccc(C)c(c2)-c2cnc(N)c(c2)-c2cnn(C)c2)n1
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(N)(=O)=O
CC(C)c1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
CC(C)c1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCOCC1
COC1(C)CN(C1)S(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCCCC1
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCOCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC1(O)CCCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@@H]1CCNC(=O)C1 |r|
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(CO)CCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCN
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1(O)CCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N1CC(CO)C1
CCCONS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1
CC(C)ONS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NOC(C)(C)C
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCC(F)(F)F
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCOCC1
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC1CCCO1
Cc1cnn(c1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1c(cnn1C)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1oncc1-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cn(C)nn1)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cc(no1)C(F)(F)F)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(no1)C(F)F)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:26.28,wD:29.32,(-2.34,5,;-2.34,3.46,;-3.68,2.69,;-3.68,1.15,;-2.34,.38,;-1.01,1.15,;-1.01,2.69,;.33,3.47,;.33,5,;1.66,5.77,;2.99,5,;4.33,5.78,;2.99,3.47,;1.66,2.7,;4.33,2.69,;4.33,1.15,;5.79,.68,;6.7,1.92,;5.79,3.17,;6.19,-.81,;5.1,-1.9,;7.68,-1.21,;-2.34,-1.16,;-3.88,-1.16,;-.8,-1.16,;-2.34,-2.7,;-3.68,-3.47,;-3.68,-5.01,;-5.01,-5.78,;-6.34,-5.01,;-7.68,-5.78,;-6.34,-3.47,;-5.01,-2.69,)|
Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(no1)C(F)F)S(=O)(=O)NCC(C)(C)O
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)Nc1cccc(C)n1
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NCCO
Cc1noc(n1)-c1cc(cnc1N)-c1cc(ccc1C)S(N)(=O)=O
Cc1cc(ccn1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](CO)CC1 |r,wU:25.27,wD:28.31,(8.67,3.46,;7.34,2.69,;6,3.47,;4.67,2.69,;4.67,1.16,;6,.38,;7.34,1.16,;3.33,3.47,;2,2.7,;.67,3.47,;.67,5,;2,5.77,;3.33,5,;4.67,5.78,;-.67,2.69,;-.67,1.15,;-2,.38,;-3.33,1.15,;-3.33,2.69,;-2,3.46,;-2,5,;-2,-1.16,;-3.54,-1.16,;-.46,-1.16,;-2,-2.7,;-3.33,-3.47,;-3.33,-5.01,;-4.67,-5.78,;-6,-5.01,;-7.34,-5.78,;-8.67,-5.01,;-6,-3.47,;-4.67,-2.69,)|
Cc1ccc(cc1-c1cnc(N)c(c1)-c1nc(no1)C1CC1)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-n1cncn1)S(=O)(=O)NCC(C)(C)O
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnco1)S(=O)(=O)NCC(C)(C)O
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NO[C@H]1C[C@H](O)C1 |r,wU:27.30,wD:25.27,(7.68,-1.27,;6.91,.07,;5.45,.54,;5.45,2.08,;6.91,2.56,;7.81,1.31,;4.11,2.85,;2.78,2.08,;1.44,2.85,;1.44,4.39,;2.78,5.16,;4.11,4.39,;5.45,5.16,;.11,2.08,;.11,.54,;-1.22,-.23,;-2.56,.54,;-2.56,2.08,;-1.22,2.85,;-1.22,4.39,;-1.22,-1.77,;.32,-1.77,;-2.76,-1.77,;-1.22,-3.31,;-2.56,-4.08,;-4.1,-4.08,;-5.19,-2.99,;-6.27,-4.08,;-7.81,-4.08,;-5.19,-5.16,)|
Cc1ncc(s1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:27.30,wD:24.26,(10.26,-1.16,;8.72,-1.16,;7.82,-2.4,;6.35,-1.92,;6.35,-.39,;7.82,.09,;5.02,.39,;3.69,-.39,;2.35,.39,;2.35,1.92,;3.69,2.69,;5.02,1.92,;6.35,2.69,;1.02,-.39,;-.31,.39,;-1.65,-.39,;-1.65,-1.92,;-.31,-2.69,;1.02,-1.92,;2.35,-2.69,;-2.98,.39,;-2.21,1.72,;-3.75,-.95,;-4.31,1.16,;-5.8,.76,;-6.89,1.85,;-8.38,1.45,;-8.78,-.04,;-10.26,-.44,;-7.69,-1.13,;-6.2,-.73,)|
Cc1ncc(o1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:24.26,wD:27.30,(7.96,1.92,;6.42,1.92,;5.51,.68,;4.05,1.15,;4.05,2.69,;5.51,3.17,;2.71,3.47,;1.38,2.7,;.05,3.47,;.05,5.01,;1.38,5.77,;2.71,5.01,;4.05,5.78,;-1.29,2.69,;-1.29,1.15,;-2.62,.38,;-3.96,1.15,;-3.96,2.69,;-2.62,3.46,;-2.62,5,;-2.62,-1.16,;-1.08,-1.16,;-4.16,-1.16,;-2.62,-2.7,;-3.96,-3.47,;-3.96,-5.01,;-5.29,-5.77,;-6.62,-5.01,;-7.96,-5.78,;-6.62,-3.47,;-5.29,-2.7,)|
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1COC[C@H]1O |r|
Cc1cc(on1)-c1cc(cnc1N)-c1cc(ccc1C)S(=O)(=O)NC1CCC[C@H]1O |r|
Cc1ccc(cc1-c1cnc(N)c(c1)-c1cnn(C)n1)S(=O)(=O)NCCC(C)(C)O
CC(O)CNS(=O)(=O)c1ccc(C)c(c1)-c1cnc(N)c(c1)-c1nc(C)no1
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3oc(NC(C)=O)nc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3nc(NC(C)=O)oc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3nc(N)oc3c2)c2c(N)ncnc12
Nc1nc2cc(ccc2o1)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(C2CCC(CC2)N2CCOCC2)c2ncnc(N)c12 |(4.74,8.63,;3.41,7.86,;3.41,6.32,;1.95,5.84,;1.32,4.44,;-.21,4.28,;-1.12,5.52,;-.49,6.93,;1.04,7.09,;1.95,8.34,;-.61,2.79,;.29,1.54,;-.61,.3,;-.21,-1.19,;-1.3,-2.28,;-.9,-3.77,;.58,-4.17,;1.67,-3.08,;1.27,-1.59,;.98,-5.65,;-.11,-6.74,;.29,-8.23,;1.78,-8.63,;2.87,-7.54,;2.47,-6.05,;-2.08,.77,;-3.41,0,;-4.74,.77,;-4.74,2.31,;-3.41,3.08,;-3.41,4.62,;-2.08,2.31,)|
CC(=O)N1CCC(CC1)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
CC(C)n1cc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
Nc1nc2cc(ccc2o1)-c1cn(C2CCOCC2)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3onc(N)c3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3c(NC(C)=O)noc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2ccc3c(N)noc3c2)c2c(N)ncnc12
CNc1noc2cc(ccc12)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3c(NC4CC4)noc3c2)c2c(N)ncnc12
CNc1noc2ccc(cc12)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3onc(NC4CC4)c3c2)c2c(N)ncnc12
Nc1noc2ccc(cc12)-c1nn(CC(=O)N2CCOCC2)c2ncnc(N)c12
Nc1noc2ccc(cc12)-c1nn(CCN2CCOCC2)c2ncnc(N)c12
COC(=O)Nc1noc2ccc(cc12)-c1nn(C(C)C)c2ncnc(N)c12
COC(=O)Nc1noc2cc(ccc12)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(C)nc12
CC(CO)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(F)ccc3[nH]2)c2c(NC(=O)N(C)C)ncnc12
CC(C)n1nc(-c2cc3cc(F)ccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(ccc3[nH]2)[N+]#[C-])c2c(N)ncnc12
COc1ccc2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3ccccc3n2C)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccccc3[nH]2)c2c(N)ncnc12
COc1ccc2cc([nH]c2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3c(Cl)cccc3[nH]2)c2c(N)ncnc12
COc1cccc2cc([nH]c12)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3cccc(O)c3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCCC1
COc1cc(Cl)c2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
COc1cc(F)c2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3cc(O)cc(Cl)c3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(O)cc(F)c3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(Cl)ccc3[nH]2)c2c(N)ncnc12
COc1ccc2[nH]c(cc2n1)-c1nn(C(C)C)c2ncnc(N)c12
COc1cnc2[nH]c(cc2c1)-c1nn(C(C)C)c2ncnc(N)c12
CC(C)n1nc(-c2cc3cnccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccc(O)cc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3c(Cl)c(O)ccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(ccc3[nH]2)C(N)=O)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccc(cc3[nH]2)C#N)c2c(N)ncnc12
CC(C)n1nc(-c2cc3ccc(cc3[nH]2)C(N)=O)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCCCC1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCC1
CCOC(=O)Cn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
COc1cc2cc([nH]c2cc1Cl)-c1nn(C(C)C)c2ncnc(N)c12
CC(=O)N1CCC(CC1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCN(CC1)C(=O)C1CC1
CC(C)n1nc(-c2cc3cc(O)c(Cl)cc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(CCN3CCOCC3)nc(-c3cc4cc(O)ccc4[nH]3)c12
Nc1ncnc2n(CC(=O)N3CCOCC3)nc(-c3cc4cc(O)ccc4[nH]3)c12
CNC(=O)Cn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cccc(O)c4[nH]3)c12)C1CCCC1
CC(C)n1nc(-c2cc3c(O)cccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(Cc3cccnc3)nc(-c3cc4cc(O)ccc4[nH]3)c12
CC(C)n1nc(-c2cc3c(Cl)ccc(O)c3[nH]2)c2c(N)ncnc12
COCCn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cccc(O)c4[nH]3)c12)C1CCN(CC1)C(=O)C1CC1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCOCC1
CNC(=O)CCn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Cc1nccn1CCn1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)nccc12
Nc1ncnc2n(nc(-c3cc4c(Cl)cccc4[nH]3)c12)C1CCOCC1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CC(C1)N1CCOCC1 |(-2.36,3.11,;-2.36,1.57,;-3.69,.8,;-3.69,-.74,;-2.36,-1.51,;-1.02,-.74,;.44,-1.22,;1.35,.03,;.44,1.27,;.84,2.76,;-.06,4,;.84,5.25,;.52,6.76,;1.67,7.79,;1.27,9.27,;3.13,7.31,;3.45,5.8,;2.31,4.77,;2.31,3.23,;-1.02,.8,;.84,-2.71,;.07,-4.04,;1.4,-4.81,;2.17,-3.48,;1.8,-6.3,;.71,-7.39,;1.11,-8.88,;2.6,-9.27,;3.69,-8.19,;3.29,-6.7,)|
CC(C)n1nc(-c2cc3cccc(Cl)c3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cccc(Cl)c4[nH]3)c12)C1CCOCC1
CN1CCN(CC1)C1CC(C1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12 |(3.02,-10.82,;2.62,-9.33,;1.06,-8.91,;.71,-7.39,;1.8,-6.3,;3.29,-6.7,;3.76,-8.19,;1.4,-4.81,;.07,-4.04,;.84,-2.71,;2.17,-3.48,;.44,-1.22,;1.35,.03,;.44,1.27,;.84,2.76,;-.06,4,;.84,5.25,;.52,6.76,;1.67,7.79,;1.27,9.27,;3.13,7.31,;3.45,5.8,;2.31,4.77,;2.31,3.23,;-1.02,.8,;-2.36,1.57,;-2.36,3.11,;-3.69,.8,;-3.69,-.74,;-2.36,-1.51,;-1.02,-.74,)|
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CC(=O)C1
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CC(O)C1 |(-2.24,1.62,;-2.24,.08,;-3.57,-.69,;-3.57,-2.23,;-2.24,-3,;-.9,-2.23,;.56,-2.71,;1.47,-1.46,;.56,-.22,;.96,1.27,;.06,2.52,;.96,3.76,;.64,5.27,;1.79,6.3,;1.39,7.79,;3.25,5.82,;3.57,4.32,;2.43,3.29,;2.43,1.75,;-.9,-.69,;.96,-4.2,;.19,-5.53,;1.52,-6.3,;1.92,-7.79,;2.29,-4.97,)|
CC(C)N1CCC(CC1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
CC(C)N1CCC(CC1)n1nc(-c2cc3cc(O)cc(Cl)c3[nH]2)c2c(N)ncnc12
Nc1ncnc2n(nc(-c3cc4cc(O)ccc4[nH]3)c12)C1CCC(CC1)N1CCOCC1 |w:23.30,(-2.24,3.7,;-2.24,2.16,;-3.57,1.39,;-3.57,-.15,;-2.24,-.92,;-.9,-.15,;.56,-.63,;1.47,.62,;.56,1.86,;.96,3.35,;.06,4.6,;.96,5.84,;.64,7.35,;1.79,8.38,;1.39,9.87,;3.25,7.9,;3.57,6.4,;2.43,5.37,;2.43,3.83,;-.9,1.39,;.56,-2.17,;-.77,-2.94,;-.77,-4.48,;.56,-5.25,;1.9,-4.48,;1.9,-2.94,;.56,-6.79,;-.77,-7.56,;-.77,-9.1,;.56,-9.87,;1.9,-9.1,;1.9,-7.56,)|
CN1CCN(CC1)C1CCC(CC1)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12 |w:7.7,(.56,-10.64,;.56,-9.1,;-.77,-8.33,;-.77,-6.79,;.56,-6.02,;1.9,-6.79,;1.9,-8.33,;.56,-4.48,;-.77,-3.71,;-.77,-2.17,;.56,-1.4,;1.9,-2.17,;1.9,-3.71,;.56,.14,;1.47,1.39,;.56,2.63,;.96,4.12,;.06,5.37,;.96,6.61,;.64,8.12,;1.79,9.15,;1.39,10.64,;3.25,8.67,;3.57,7.17,;2.43,6.14,;2.43,4.6,;-.9,2.16,;-2.24,2.93,;-2.24,4.47,;-3.57,2.16,;-3.57,.62,;-2.24,-.15,;-.9,.62,)|
COc1ccc2cc([nH]c2c1)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cc4ccc(O)cc4[nH]3)c12)C1CCOCC1
COc1ccc(Cl)c2cc([nH]c12)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cc4cccc(O)c4[nH]3)c12)C1CCOCC1
COc1cccc2cc([nH]c12)-c1nn(C2CCOCC2)c2ncnc(N)c12
CC(C)N1CCC(CC1)n1nc(-c2cc3cccc(O)c3[nH]2)c2c(N)ncnc12
CC(=O)N1CCC(CC1)n1nc(-c2cc3ccc(O)cc3[nH]2)c2c(N)ncnc12
COc1cccc2cc([nH]c12)-c1nn(C2CCN(CC2)C(=O)C2CC2)c2ncnc(N)c12
COc1cc(Cl)c2[nH]c(cc2c1)-c1nn(C2CCOCC2)c2ncnc(N)c12
Nc1ncnc2n(nc(-c3cc4cc(O)cc(Cl)c4[nH]3)c12)C1CCOCC1
CC(=O)N1CCC(CC1)n1nc(-c2cc3c(Cl)ccc(O)c3[nH]2)c2c(N)ncnc12
CC(=O)N1CCC(CC1)n1nc(-c2cc3cc(O)cc(Cl)c3[nH]2)c2c(N)ncnc12
CC(C)N1CCC(CC1)n1nc(-c2cc3c(Cl)ccc(O)c3[nH]2)c2c(N)ncnc12
C[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1nccs1 |r|
CC[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1ccc(OC)cc1 |r|
COc1ccc(cc1)[C@@H]1OC(=O)N([C@H]1CO)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F |r|
CC[C@H]1[C@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1ccccc1 |r|
C[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1ccccc1 |r|
CC[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1cccc(OC)c1 |r|
CC[C@H]1[C@@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1nccs1 |r|
CCC1C(OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1cccnc1
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2[C@@H](CO)[C@@H](OC2=O)c2ccccc2)c(n1)C(F)(F)F |r|
C[C@H]1[C@H](OC(=O)N1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F)c1nccs1 |r|
COCCOc1ccc(cc1)[C@@H]1OC(=O)N([C@H]1CO)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2[C@@H](CO)[C@@H](OC2=O)c2ccc(OCCO)cc2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2[C@@H](CO)[C@@H](OC2=O)c2ccc(OCCCO)cc2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCCCC2=O)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCN(C2=O)c2ccccc2)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCC(=O)CC2)c(n1)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOC(C2)c2ccccc2)c(n1)C(F)(F)F
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1C2CCC1COC2
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1C2CCC1COC2 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOCC1)N1C2CCC1COC2
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1C2CCC1COC2 |r|
COCCN(C)c1nc(N2C3CCC2COC3)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CC2CCC(C1)O2)N1C2CCC1COC2
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1C[C@H](C)O[C@H](C)C1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1CC2CCC(C1)O2
COCCN(C)c1nc(nc2nc(ccc12)-c1ccc(OC)c(CO)c1)N1C2CCC1COC2
COc1ccc(cc1CO)-c1cc2nc(nc(N3CCOCC3)c2cn1)N1CCOCC1
COc1ccc(cc1CO)-c1cc2nc(nc(N3CCOCC3)c2cn1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3CCOCC3)c2cn1)N1C[C@H](C)O[C@H](C)C1 |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3C[C@H](C)O[C@H](C)C3)c2cn1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3C[C@H](C)O[C@H](C)C3)c2cn1)N1C[C@H](C)O[C@H](C)C1 |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3CCOC[C@@H]3C)c2cn1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3CCOC[C@@H]3C)c2cn1)N1CCOCC1 |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3CC4CCC(C3)O4)c2cn1)N1CC2CCC(C1)O2
COc1ccc(cc1CO)-c1cc2nc(nc(N3CC4CCC(C3)O4)c2cn1)N1CCOCC1
COc1ccc(cc1CO)-c1cc2nc(nc(N3CC4CCC(C3)O4)c2cn1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1cc2nc(nc(N3C4CCC3COC4)c2cn1)N1C2CCC1COC2
COc1ccc(cc1CO)-c1cc2nc(nc(N3C4CCC3COC4)c2cn1)N1CCOCC1
COc1ccc(cc1CO)-c1cc2nc(nc(N3C4CCC3COC4)c2cn1)N1CCOC[C@@H]1C |r|
C1CN(CCO1)c1nc(N2CCOCC2)c2cnc(cc2n1)-c1ccccc1
C[C@H]1COCCN1c1nc(N2CCOCC2)c2cnc(cc2n1)-c1ccccc1 |r|
C1CC2CN(CC1O2)c1nc(N2CCOCC2)c2cnc(cc2n1)-c1ccccc1
C[C@H]1COCCN1c1nc(nc2cc(ncc12)-c1ccccc1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2cnc(cc2n1)-c1ccccc1 |r|
C[C@H]1COCCN1c1nc(nc2cc(ncc12)-c1ccccc1)N1CC2CCC(C1)O2 |r|
C1CN(CCO1)c1nc(N2CCOCC2)c2cnc(nc2n1)-c1ccccc1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2cnc(nc2n1)-c1ccccc1 |r|
C1CC2CN(CC1O2)c1nc(N2CC3CCC(C2)O3)c2cnc(nc2n1)-c1ccccc1
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1C2CCC1COC2
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1CCOC[C@@H]1C |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CC2CCC(C1)O2)N1CCOC[C@@H]1C |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOCC1)N1C2CCC1COC2
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1C2CCC1COC2 |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1C2CCC1COC2 |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CC2CCC(C1)O2 |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1C2CCC1COC2)N1CC2CCC(C1)O2
Cc1ncc(s1)-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCCO
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)O
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC1(C)COC1
Cc1ncc(s1)-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(6.06,1.92,;4.52,1.92,;3.61,.68,;2.15,1.15,;2.15,2.69,;3.61,3.17,;.82,3.46,;.82,5,;-.52,5.78,;-1.85,5,;-1.85,3.46,;-.52,2.69,;-3.19,2.69,;-3.19,1.15,;-4.52,.38,;-5.85,1.15,;-5.85,2.69,;-4.52,3.46,;-4.52,5,;-4.52,-1.16,;-2.98,-1.16,;-6.06,-1.16,;-4.52,-2.7,;-3.19,-3.47,;-1.85,-2.7,;-.52,-3.47,;-.52,-5.01,;.82,-5.78,;-1.85,-5.78,;-3.19,-5.01,)|
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NC1CC2(CC(O)C2)C1 |(4.78,4.98,;4.38,3.49,;5.29,2.24,;4.38,1,;4.78,-.49,;2.92,1.47,;2.92,3.01,;1.59,3.78,;1.59,5.32,;.25,6.09,;-1.08,5.32,;-1.08,3.78,;.25,3.01,;-2.42,3.01,;-2.42,1.47,;-3.75,.7,;-5.08,1.47,;-5.08,3.01,;-3.75,3.78,;-3.75,5.32,;-3.75,-.84,;-2.21,-.84,;-5.29,-.84,;-3.75,-2.38,;-2.42,-3.15,;-2.02,-4.63,;-.53,-4.23,;-.13,-5.72,;1.36,-5.32,;2.69,-6.09,;.96,-3.84,;-.93,-2.75,)|
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NC[C@@H]1C[C@H](O)C1 |r,wU:25.27,27.30,(3.96,6.23,;3.96,4.69,;5.2,3.78,;4.73,2.32,;5.5,.99,;3.19,2.32,;2.71,3.78,;1.38,4.55,;1.38,6.09,;.04,6.86,;-1.29,6.09,;-1.29,4.55,;.04,3.78,;-2.62,3.78,;-2.62,2.24,;-3.96,1.47,;-5.29,2.24,;-5.29,3.78,;-3.96,4.55,;-3.96,6.09,;-3.96,-.07,;-2.42,-.07,;-5.5,-.07,;-3.96,-1.61,;-3.96,-3.15,;-2.87,-4.24,;-2.87,-5.78,;-1.33,-5.78,;-.24,-6.86,;-1.33,-4.24,)|
Cc1nn(C)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCC(C)(C)CO
Cc1ccc(cc1-c1cncc(n1)-c1cnn(CCN2CCOCC2)c1)S(=O)(=O)NCCC(C)(C)O
Cc1nn(CCN2CCOCC2)cc1-c1cncc(n1)-c1cc(ccc1C)S(=O)(=O)NCCC(C)(C)O
Cc1ccc(cc1-c1cncc(n1)-c1cccnc1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:23.25,wD:26.29,(-2,5,;-2,3.47,;-3.33,2.69,;-3.33,1.15,;-2,.38,;-.67,1.15,;-.67,2.69,;.67,3.47,;.67,5,;2,5.78,;3.33,5,;3.33,3.47,;2,2.69,;4.67,2.69,;4.67,1.15,;6,.38,;7.34,1.15,;7.34,2.69,;6,3.47,;-2,-1.15,;-3.54,-1.15,;-.46,-1.15,;-2,-2.69,;-3.33,-3.47,;-3.33,-5,;-4.67,-5.78,;-6,-5,;-7.34,-5.78,;-6,-3.47,;-4.67,-2.69,)|
Cc1ccc(cc1-c1cncc(n1)-c1csc(CN2CCOCC2)c1)S(=O)(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:29.32,wD:32.36,(-4.16,5,;-4.16,3.47,;-5.5,2.69,;-5.5,1.15,;-4.16,.38,;-2.83,1.15,;-2.83,2.69,;-1.49,3.47,;-1.49,5,;-.16,5.78,;1.17,5,;1.17,3.47,;-.16,2.69,;2.51,2.69,;2.51,1.15,;3.97,.68,;4.88,1.93,;6.42,1.93,;7.19,.59,;6.42,-.74,;7.19,-2.08,;8.73,-2.08,;9.5,-.74,;8.73,.59,;3.97,3.17,;-4.16,-1.15,;-5.7,-1.15,;-2.62,-1.15,;-4.16,-2.69,;-5.5,-3.47,;-5.5,-5,;-6.83,-5.78,;-8.16,-5,;-9.5,-5.78,;-8.16,-3.47,;-6.83,-2.69,)|
Cc1cc(-c2cncc(n2)-c2cc(ccc2C)S(=O)(=O)NC[C@@H]2C[C@H](O)C2)n(C)n1 |r,wU:22.23,24.26,(6.1,4.85,;4.77,4.08,;3.52,4.98,;2.27,4.08,;.94,4.85,;.94,6.39,;-.39,7.16,;-1.73,6.39,;-1.73,4.85,;-.39,4.08,;-3.06,4.08,;-3.06,2.54,;-4.39,1.77,;-5.73,2.54,;-5.73,4.08,;-4.39,4.85,;-4.39,6.39,;-4.39,.23,;-5.93,.23,;-2.85,.23,;-4.39,-1.31,;-5.73,-2.08,;-5.33,-3.57,;-6.1,-4.9,;-4.77,-5.67,;-4.37,-7.16,;-4,-4.34,;2.75,2.61,;1.98,1.28,;4.29,2.61,)|
CN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CCN1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CC1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CCC1CCN(CCn2nc(-c3ccc(C)cc3)c3c(N)ncnc23)CC1
CN(C)CC1CCN(CCn2nc(-c3cnc4[nH]ccc4c3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3cnc4[nH]ccc4c3)c3c(N)ncnc23)CC1
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CN(C)C)CC2)c2ncnc(N)c12
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N2CCCC2)c2ncnc(N)c12
COc1cc(ccc1NC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N2CCCCC2)c2ncnc(N)c12
COc1cc(ccc1NC(=O)CC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1NCc1ccccc1)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1NC(=O)NC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
CN(C)C1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)cc3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(CC(=O)OC(C)(C)C)cc3)c3c(N)ncnc23)CC1
CN(C)C1CCN(CCn2nc(-c3ccc(CC(O)=O)cc3)c3c(N)ncnc23)CC1
COc1cc(ccc1CC(=O)OC(C)(C)C)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COc1cc(ccc1Cc1ncc(C)o1)-c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
COC1CCN(CCn2nc(-c3ccc(NC(=O)OC(C)(C)C)c(OC)c3)c3c(N)ncnc23)CC1
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccccc1
CC(C)(C)NS(=O)(=O)c1ccc(cc1)-c1ccc2ncc3ccc(=O)n(-c4ccc5CCN(C(=O)C=C)c5c4)c3c2c1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(NS(C)(=O)=O)cc1
CN1CCN(CC1)c1ccc(cc1)-c1ccc2ncc3ccc(=O)n(-c4ccc5CCN(C(=O)C=C)c5c4)c3c2c1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc2OCCOc2c1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnn(C)c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc5CCN(C(=O)C=C)c5c4)c3c2c1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(N)nc1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4cccc(NC(=O)C=C)c4)c3c2c1
C=CC(=O)Nc1cccc(c1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccsc1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccoc1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cccnc1
C=CC(=O)N1CCc2ccc(cc12)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc5CCN(C(=O)C=C)c5c4)c3c2c1
C=CC(=O)N1CCc2ccc(cc12)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Cc1ccc(cc1NC(=O)C=C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;4.44,4.02,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(F)cncc4F)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;4.47,.62,;5.55,-.47,;4.86,2.11,;3.77,3.2,;2.29,2.8,;1.89,1.31,;.4,.91,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)nc4C)c3c2cc1-c1cn[nH]c1 |(-5.66,.57,;-4.33,1.34,;-3,.57,;-3,-.97,;-1.66,-1.74,;-1.66,-3.28,;-.33,-4.05,;1,-3.28,;2.47,-3.76,;2.87,-5.25,;3.37,-2.51,;4.91,-2.51,;2.47,-1.27,;2.87,.22,;4.33,.7,;4.33,2.24,;5.66,3.01,;2.87,2.71,;1.96,1.47,;.42,1.47,;1,-1.74,;-.33,-.97,;-.33,.57,;-1.66,1.34,;-1.66,2.88,;-.42,3.78,;-.89,5.25,;-2.43,5.25,;-2.91,3.78,)|
COc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cn(C)nc2C)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-3.54,3.12,;-3.07,4.58,;-3.84,5.91,;-1.53,4.58,;-1.05,3.12,;.44,2.72,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)nc4C)c3c2cc1-c1cnn(C)c1 |(-5.66,-.1,;-4.33,.67,;-3,-.1,;-3,-1.64,;-1.66,-2.41,;-1.66,-3.95,;-.33,-4.72,;1,-3.95,;2.47,-4.43,;2.87,-5.91,;3.37,-3.18,;4.91,-3.18,;2.47,-1.93,;2.87,-.45,;4.33,.03,;4.33,1.57,;5.66,2.34,;2.87,2.05,;1.96,.8,;.42,.8,;1,-2.41,;-.33,-1.64,;-.33,-.1,;-1.66,.67,;-1.66,2.21,;-.42,3.12,;-.89,4.58,;-2.43,4.58,;-3.2,5.91,;-2.91,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cc4F)c3c2cc1-c1cn[nH]c1 |(-5.29,.57,;-3.96,1.34,;-2.62,.57,;-2.62,-.97,;-1.29,-1.74,;-1.29,-3.28,;.05,-4.05,;1.38,-3.28,;2.84,-3.76,;3.24,-5.25,;3.75,-2.51,;5.29,-2.51,;2.84,-1.27,;3.24,.22,;4.73,.62,;5.13,2.11,;4.04,3.2,;4.44,4.68,;2.55,2.8,;2.15,1.31,;.67,.91,;1.38,-1.74,;.05,-.97,;.05,.57,;-1.29,1.34,;-1.29,2.88,;-.04,3.78,;-.52,5.25,;-2.06,5.25,;-2.53,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cn[nH]c1 |(-5.29,.57,;-3.96,1.34,;-2.62,.57,;-2.62,-.97,;-1.29,-1.74,;-1.29,-3.28,;.05,-4.05,;1.38,-3.28,;2.84,-3.76,;3.24,-5.25,;3.75,-2.51,;5.29,-2.51,;2.84,-1.27,;3.24,.22,;4.73,.62,;5.13,2.11,;4.04,3.2,;2.55,2.8,;2.15,1.31,;.67,.91,;1.38,-1.74,;.05,-.97,;.05,.57,;-1.29,1.34,;-1.29,2.88,;-.04,3.78,;-.52,5.25,;-2.06,5.25,;-2.53,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(C)cncc4F)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;4.47,.62,;5.55,-.47,;4.86,2.11,;3.77,3.2,;2.29,2.8,;1.89,1.31,;.4,.91,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4F)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;1.89,1.31,;2.29,2.8,;3.77,3.2,;4.86,2.11,;4.47,.62,;5.55,-.47,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)nc4C)c3c2cc1-c1cn(C)nc1C |(-5.66,-.1,;-4.33,.67,;-3,-.1,;-3,-1.64,;-1.66,-2.41,;-1.66,-3.95,;-.33,-4.72,;1,-3.95,;2.47,-4.43,;2.87,-5.91,;3.37,-3.18,;4.91,-3.18,;2.47,-1.93,;2.87,-.45,;1.96,.8,;2.87,2.05,;2.47,3.53,;4.33,1.57,;4.33,.03,;5.66,-.74,;1,-2.41,;-.33,-1.64,;-.33,-.1,;-1.66,.67,;-1.66,2.21,;-2.91,3.12,;-2.43,4.58,;-3.2,5.91,;-.89,4.58,;-.42,3.12,;1.07,2.72,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cc4F)c3c2cc1-c1cn(C)nc1C |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;4.44,4.02,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-2.53,3.12,;-2.06,4.58,;-2.83,5.91,;-.52,4.58,;-.04,3.12,;1.29,2.35,)|
CCc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
CCn1cc(cn1)-c1cc2c3n(-c4c(F)cncc4OC)c(=O)n(C)c3cnc2cc1OC |(-3.07,6.58,;-3.84,5.25,;-3.07,3.91,;-3.54,2.45,;-2.3,1.54,;-1.05,2.45,;-1.53,3.91,;-2.3,0,;-.96,-.77,;-.96,-2.31,;.37,-3.08,;1.84,-2.6,;2.23,-1.11,;1.14,-.02,;-.34,-.42,;1.54,1.46,;3.03,1.86,;4.12,.77,;3.72,-.71,;4.81,-1.8,;6.3,-1.41,;2.74,-3.85,;4.28,-3.85,;1.84,-5.09,;2.23,-6.58,;.37,-4.62,;-.96,-5.39,;-2.3,-4.62,;-2.3,-3.08,;-3.63,-2.31,;-3.63,-.77,;-4.96,0,;-6.3,-.77,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cn(C)nc1C |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-2.8,3.12,;-2.32,4.58,;-3.09,5.91,;-.78,4.58,;-.31,3.12,;1.18,2.72,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(C)c4)c3c2cc1-c1cn[nH]c1
COc1cc2ncc3n(C)c(=O)n(-c4c(C)cncc4F)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C)c3c2cc1-c1cn[nH]c1 |(-5.55,.57,;-4.22,1.34,;-2.89,.57,;-2.89,-.97,;-1.55,-1.74,;-1.55,-3.28,;-.22,-4.05,;1.11,-3.28,;2.58,-3.76,;2.98,-5.25,;3.48,-2.51,;5.02,-2.51,;2.58,-1.27,;2.98,.22,;1.89,1.31,;2.29,2.8,;3.77,3.2,;4.86,2.11,;4.47,.62,;5.55,-.47,;1.11,-1.74,;-.22,-.97,;-.22,.57,;-1.55,1.34,;-1.55,2.88,;-.31,3.78,;-.78,5.25,;-2.32,5.25,;-2.8,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(C)cc4F)c3c2cc1-c1cn[nH]c1 |(-5.29,.57,;-3.96,1.34,;-2.62,.57,;-2.62,-.97,;-1.29,-1.74,;-1.29,-3.28,;.05,-4.05,;1.38,-3.28,;2.84,-3.76,;3.24,-5.25,;3.75,-2.51,;5.29,-2.51,;2.84,-1.27,;3.24,.22,;4.73,.62,;5.13,2.11,;4.04,3.2,;4.44,4.68,;2.55,2.8,;2.15,1.31,;.67,.91,;1.38,-1.74,;.05,-.97,;.05,.57,;-1.29,1.34,;-1.29,2.88,;-.04,3.78,;-.52,5.25,;-2.06,5.25,;-2.53,3.78,)|
CCn1cc(cn1)-c1cc2c3n(-c4cn(C)nc4C)c(=O)n(C)c3cnc2cc1OC |(-2.43,6.58,;-3.2,5.25,;-2.43,3.91,;-2.91,2.45,;-1.66,1.54,;-.42,2.45,;-.89,3.91,;-1.66,0,;-.33,-.77,;-.33,-2.31,;1,-3.08,;2.47,-2.6,;2.87,-1.11,;4.33,-.64,;4.33,.9,;5.66,1.67,;2.87,1.38,;1.96,.13,;.42,.13,;3.37,-3.85,;4.91,-3.85,;2.47,-5.09,;2.87,-6.58,;1,-4.62,;-.33,-5.39,;-1.66,-4.62,;-1.66,-3.08,;-3,-2.31,;-3,-.77,;-4.33,0,;-5.66,-.77,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(F)cncc4F)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(C)c4)c3c2cc1-c1cnn(C)c1
CCn1cc(cn1)-c1cc2c3n(-c4ncccc4F)c(=O)n(C)c3cnc2cc1OC |(-4.37,5.91,;-2.83,5.91,;-2.06,4.58,;-2.53,3.12,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-1.29,.67,;.05,-.1,;.05,-1.64,;1.38,-2.41,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;3.75,-3.18,;5.29,-3.18,;2.84,-4.43,;3.24,-5.91,;1.38,-3.95,;.05,-4.72,;-1.29,-3.95,;-1.29,-2.41,;-2.62,-1.64,;-2.62,-.1,;-3.96,.67,;-5.29,-.1,)|
CCc1cncc(F)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(CC)c2)n(C)c1=O |(6.3,-1.41,;4.81,-1.8,;3.72,-.71,;4.12,.77,;3.03,1.86,;1.54,1.46,;1.14,-.02,;-.34,-.42,;2.23,-1.11,;1.84,-2.6,;.37,-3.08,;.37,-4.62,;-.96,-5.39,;-2.3,-4.62,;-2.3,-3.08,;-3.63,-2.31,;-3.63,-.77,;-4.96,0,;-6.3,-.77,;-2.3,0,;-.96,-.77,;-.96,-2.31,;-2.3,1.54,;-1.05,2.45,;-1.53,3.91,;-3.07,3.91,;-3.84,5.25,;-3.07,6.58,;-3.54,2.45,;1.84,-5.09,;2.23,-6.58,;2.74,-3.85,;4.28,-3.85,)|
CCn1cc(cn1)-c1cc2c3n(-c4c(F)cncc4F)c(=O)n(C)c3cnc2cc1OC |(-2.32,6.58,;-3.09,5.25,;-2.32,3.91,;-2.8,2.45,;-1.55,1.54,;-.31,2.45,;-.78,3.91,;-1.55,0,;-.22,-.77,;-.22,-2.31,;1.11,-3.08,;2.58,-2.6,;2.98,-1.11,;4.47,-.71,;5.55,-1.8,;4.86,.77,;3.77,1.86,;2.29,1.46,;1.89,-.02,;.4,-.42,;3.48,-3.85,;5.02,-3.85,;2.58,-5.09,;2.98,-6.58,;1.11,-4.62,;-.22,-5.39,;-1.55,-4.62,;-1.55,-3.08,;-2.89,-2.31,;-2.89,-.77,;-4.22,0,;-5.55,-.77,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(C)cc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;4.44,4.02,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cnccc1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cc(C)[nH]n1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;.25,5.91,;-2.06,4.58,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4csc(C)n4)c3c2cc1-c1cn[nH]c1
COc1cc2ncc3n(C)c(=O)n(-c4ncncc4F)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cnccc1-n1c2c(cnc3cc(OC)c(cc23)-c2cn[nH]c2)n(C)c1=O |(6.3,-.07,;4.81,-.47,;3.72,.62,;4.12,2.11,;3.03,3.2,;1.54,2.8,;1.14,1.31,;2.23,.22,;1.84,-1.27,;.37,-1.74,;.37,-3.28,;-.96,-4.05,;-2.3,-3.28,;-2.3,-1.74,;-3.63,-.97,;-3.63,.57,;-4.96,1.34,;-6.3,.57,;-2.3,1.34,;-.96,.57,;-.96,-.97,;-2.3,2.88,;-1.05,3.78,;-1.53,5.25,;-3.07,5.25,;-3.54,3.78,;1.84,-3.76,;2.23,-5.25,;2.74,-2.51,;4.28,-2.51,)|
CCn1cc(cn1)-c1cc2c3n(-c4ccncc4F)c(=O)n(C)c3cnc2cc1OC |(-2.32,6.58,;-3.09,5.25,;-2.32,3.91,;-2.8,2.45,;-1.55,1.54,;-.31,2.45,;-.78,3.91,;-1.55,0,;-.22,-.77,;-.22,-2.31,;1.11,-3.08,;2.58,-2.6,;2.98,-1.11,;1.89,-.02,;2.29,1.46,;3.77,1.86,;4.86,.77,;4.47,-.71,;5.55,-1.8,;3.48,-3.85,;5.02,-3.85,;2.58,-5.09,;2.98,-6.58,;1.11,-4.62,;-.22,-5.39,;-1.55,-4.62,;-1.55,-3.08,;-2.89,-2.31,;-2.89,-.77,;-4.22,0,;-5.55,-.77,)|
CCn1cc(cn1)-c1cc2c3n(-c4ccncc4C)c(=O)n(C)c3cnc2cc1OC |(-4.63,5.91,;-3.09,5.91,;-2.32,4.58,;-2.8,3.12,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-1.55,.67,;-.22,-.1,;-.22,-1.64,;1.11,-2.41,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;3.48,-3.18,;5.02,-3.18,;2.58,-4.43,;2.98,-5.91,;1.11,-3.95,;-.22,-4.72,;-1.55,-3.95,;-1.55,-2.41,;-2.89,-1.64,;-2.89,-.1,;-4.22,.67,;-5.55,-.1,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4F)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncc(F)cn4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4cnn(c4)C4CCOCC4)c3c2cc1-c1cn[nH]c1
CCn1cc(cn1)-c1cc2c3n(-c4c(C)cncc4F)c(=O)n(C)c3cnc2cc1OC |(-4.63,5.91,;-3.09,5.91,;-2.32,4.58,;-2.8,3.12,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-1.55,.67,;-.22,-.1,;-.22,-1.64,;1.11,-2.41,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;3.48,-3.18,;5.02,-3.18,;2.58,-4.43,;2.98,-5.91,;1.11,-3.95,;-.22,-4.72,;-1.55,-3.95,;-1.55,-2.41,;-2.89,-1.64,;-2.89,-.1,;-4.22,.67,;-5.55,-.1,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(C)cncc4F)c3c2cc1-c1cn(C)nc1C |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;4.47,-.05,;5.55,-1.14,;4.86,1.44,;3.77,2.53,;2.29,2.13,;1.89,.64,;.4,.24,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-2.8,3.12,;-2.32,4.58,;-3.09,5.91,;-.78,4.58,;-.31,3.12,;1.18,2.72,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccnn4C)c3c2cc1-c1cn[nH]c1 |(-5.66,.57,;-4.33,1.34,;-3,.57,;-3,-.97,;-1.66,-1.74,;-1.66,-3.28,;-.33,-4.05,;1,-3.28,;2.47,-3.76,;2.87,-5.25,;3.37,-2.51,;4.91,-2.51,;2.47,-1.27,;2.87,.22,;1.96,1.47,;2.87,2.71,;4.33,2.24,;4.33,.7,;5.66,-.07,;1,-1.74,;-.33,-.97,;-.33,.57,;-1.66,1.34,;-1.66,2.88,;-.42,3.78,;-.89,5.25,;-2.43,5.25,;-2.91,3.78,)|
COc1cc2ncc3n(C)c(=O)n(-c4c[nH]nc4C)c3c2cc1-c1cnn(C)c1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.71,.03,;4.71,1.57,;3.24,2.05,;2.34,.8,;.8,.8,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;-2.06,4.58,;-2.83,5.91,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4c(F)cncc4C#N)c3c2cc1-c1cnn(C)c1 |(-6.1,-.1,;-4.76,.67,;-3.43,-.1,;-3.43,-1.64,;-2.1,-2.41,;-2.1,-3.95,;-.76,-4.72,;.57,-3.95,;2.03,-4.43,;2.43,-5.91,;2.94,-3.18,;4.48,-3.18,;2.03,-1.93,;2.43,-.45,;1.34,.64,;-.14,.24,;1.74,2.13,;3.23,2.53,;4.32,1.44,;3.92,-.05,;5.01,-1.14,;6.1,-2.23,;.57,-2.41,;-.76,-1.64,;-.76,-.1,;-2.1,.67,;-2.1,2.21,;-.85,3.12,;-1.33,4.58,;-2.87,4.58,;-3.64,5.91,;-3.34,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ccnc(c4)C#N)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C#N)c3c2cc1-c1cnn(C)c1 |(-6.1,-.1,;-4.76,.67,;-3.43,-.1,;-3.43,-1.64,;-2.1,-2.41,;-2.1,-3.95,;-.76,-4.72,;.57,-3.95,;2.03,-4.43,;2.43,-5.91,;2.94,-3.18,;4.48,-3.18,;2.03,-1.93,;2.43,-.45,;1.34,.64,;1.74,2.13,;3.23,2.53,;4.32,1.44,;3.92,-.05,;5.01,-1.14,;6.1,-2.23,;.57,-2.41,;-.76,-1.64,;-.76,-.1,;-2.1,.67,;-2.1,2.21,;-.85,3.12,;-1.33,4.58,;-2.87,4.58,;-3.64,5.91,;-3.34,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4nccs4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccnn4C)c3c2cc1-c1cnn(C)c1 |(-5.66,-.1,;-4.33,.67,;-3,-.1,;-3,-1.64,;-1.66,-2.41,;-1.66,-3.95,;-.33,-4.72,;1,-3.95,;2.47,-4.43,;2.87,-5.91,;3.37,-3.18,;4.91,-3.18,;2.47,-1.93,;2.87,-.45,;1.96,.8,;2.87,2.05,;4.33,1.57,;4.33,.03,;5.66,-.74,;1,-2.41,;-.33,-1.64,;-.33,-.1,;-1.66,.67,;-1.66,2.21,;-.42,3.12,;-.89,4.58,;-2.43,4.58,;-3.2,5.91,;-2.91,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4ncccc4F)c3c2cc1-c1cn(C)nn1 |(-5.29,-.1,;-3.96,.67,;-2.62,-.1,;-2.62,-1.64,;-1.29,-2.41,;-1.29,-3.95,;.05,-4.72,;1.38,-3.95,;2.84,-4.43,;3.24,-5.91,;3.75,-3.18,;5.29,-3.18,;2.84,-1.93,;3.24,-.45,;4.73,-.05,;5.13,1.44,;4.04,2.53,;2.55,2.13,;2.15,.64,;.67,.24,;1.38,-2.41,;.05,-1.64,;.05,-.1,;-1.29,.67,;-1.29,2.21,;-.04,3.12,;-.52,4.58,;.25,5.91,;-2.06,4.58,;-2.53,3.12,)|
COc1cc2ncc3n(C)c(=O)n(-c4cn[nH]c4)c3c2cc1-c1cnn(C)c1
CCc1cncc(C)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(C)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(c4)C4CCOCC4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4cncnc4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4cn(C)cn4)c3c2cc1-c1cnn(C)c1
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4Cl)c3c2cc1-c1cnn(C)c1 |(-5.55,-.1,;-4.22,.67,;-2.89,-.1,;-2.89,-1.64,;-1.55,-2.41,;-1.55,-3.95,;-.22,-4.72,;1.11,-3.95,;2.58,-4.43,;2.98,-5.91,;3.48,-3.18,;5.02,-3.18,;2.58,-1.93,;2.98,-.45,;1.89,.64,;2.29,2.13,;3.77,2.53,;4.86,1.44,;4.47,-.05,;5.55,-1.14,;1.11,-2.41,;-.22,-1.64,;-.22,-.1,;-1.55,.67,;-1.55,2.21,;-.31,3.12,;-.78,4.58,;-2.32,4.58,;-3.09,5.91,;-2.8,3.12,)|
CCc1cncc(C)c1-n1c2c(cnc3cc(OC)c(cc23)-c2cnn(CC)c2)n(C)c1=O |(6.3,-.74,;4.81,-1.14,;3.72,-.05,;4.12,1.44,;3.03,2.53,;1.54,2.13,;1.14,.64,;-.34,.24,;2.23,-.45,;1.84,-1.93,;.37,-2.41,;.37,-3.95,;-.96,-4.72,;-2.3,-3.95,;-2.3,-2.41,;-3.63,-1.64,;-3.63,-.1,;-4.96,.67,;-6.3,-.1,;-2.3,.67,;-.96,-.1,;-.96,-1.64,;-2.3,2.21,;-1.05,3.12,;-1.53,4.58,;-3.07,4.58,;-3.84,5.91,;-5.38,5.91,;-3.54,3.12,;1.84,-4.43,;2.23,-5.91,;2.74,-3.18,;4.28,-3.18,)|
CCn1cc(cn1)-c1cc2c3n(-c4ccncc4)c(=O)n(C)c3cnc2cc1OC
CC(C)NCCOC1=NCC(C2=CC3C4=C(C=NC3CC2F)N(C)C(=O)C42CCC2)C=C1NS(=O)(=O)C(C)C
CC(C)NCCOc1ncc(-c2cc3c4c(cnc3cc2F)N(C)C(=O)C42CCC2)cc1NS(C)(=O)=O
CCS(=O)(=O)NC1=CC(C2=CC3C4=C(C=NC3CC2F)N(C)C(=O)C42CCC2)CN=C1OCCNC(C)C
CN1C(=O)C2(CCC2)c2c1cnc1ccc(-c3cnc(N4CC(N(C)C)C4)c(NS(C)(=O)=O)c3)cc21
Nc1ncnc2n(CC3SSCC3OC(=O)c3ccccc3)nc(C#Cc3ccccc3)c12
Nc1ncnc2n(CC3SSCC3O)nc(C#Cc3ccccc3)c12
Nc1nc2cc(ccc2o1)-c1nn(CC2SSCC2OC(=O)c2ccccc2)c2ncnc(N)c12
COc1cc2ncc3n(C)c(=O)n(-c4ccncc4C)c3c2cc1-c1c[nH]nc1C |(-5.55,.49,;-4.22,1.26,;-2.89,.49,;-2.89,-1.05,;-1.55,-1.82,;-1.55,-3.36,;-.22,-4.13,;1.11,-3.36,;2.58,-3.84,;3.35,-5.17,;3.48,-2.59,;5.02,-2.59,;2.58,-1.34,;2.98,.14,;1.89,1.23,;2.29,2.72,;3.77,3.12,;4.86,2.03,;4.47,.54,;5.55,-.55,;1.11,-1.82,;-.22,-1.05,;-.22,.49,;-1.55,1.26,;-1.55,2.8,;-2.8,3.71,;-2.32,5.17,;-.78,5.17,;-.31,3.71,;1.03,2.94,)|
COc1cc2ncc3n(C)c(=O)n(-c4cnn(C)c4)c3c2cc1-c1cn(C)nc1C
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(cc1)C#N)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(F)c(Cl)c1)N1CCOCC1
Cc1cnccc1-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc(c1)C#N)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1
Nc1ncc(-c2cc(cc(c2)S(=O)(=O)c2ccc(cc2)C#N)N2CCOCC2)c(n1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccc(cc1)C#N)N1CCOCC1)C(F)(F)F
OCCNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
O=S(=O)(c1ccccc1)c1cc(cc(c1)-c1cnc(NC2CC2)nc1)N1CCOCC1
Cc1ccc(cc1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CC(=O)Nc1ccc(cc1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1cccc(c1)C#N)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(CO)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
CC(=O)Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1ccccc1)N1CCOCC1
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1)C(F)(F)F
OCCNc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CC1CCOC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)CC1CCOCC1)N1CCOCC1
Oc1cccc(c1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(F)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1c[nH]c2ccccc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccccc1F)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)[C@H]1CCOC1)N1CCOCC1 |r|
CC(C)(C)OC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc2[nH]ccc2c1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(NS(N)(=O)=O)cc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1ccc(cc1)N1CCOCC1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)Cc1c[nH]cn1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOCC1)N1CCOCC1
CC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1cc(c(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCOC1)N1CCOCC1)C(F)(F)F
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C(F)(F)c1ccccc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1CCC(F)(F)CC1)N1CCOCC1
CC(=O)N1CCC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
CCNC(=O)N1CC(C1)S(=O)(=O)c1cc(cc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1cc(F)c(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1cc(Cl)c(cn1)-c1cc(cc(c1)S(=O)(=O)[C@@H]1CCOC1)N1CCOCC1 |r|
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc2ccoc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)c1cccc2CCOc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)S(=O)(=O)c1ccccc1
Nc1ncc(cn1)-c1cc(cc(c1)S(=O)(=O)C1COc2ccccc12)N1CCOCC1
Nc1ncc(cn1)-c1cc(Oc2ccccc2)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)c1ccccc1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(F)(F)c1ccccc1
CC(c1ccccc1)c1cc(nc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C1(CC1)c1ccccc1
Nc1ncc(cn1)-c1cc(OC2CN(C2)C(=O)C2CC2)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(OC2CCOC2)cc(n1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)C1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(F)(F)C1CCOCC1
Nc1ncc(cn1)-c1cc(Oc2ccccc2Cl)cc(n1)N1CCOCC1
COc1ccccc1Oc1cc(nc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(Oc2ccccc2OC(F)(F)F)cc(n1)N1CCOCC1
Cc1ccccc1Oc1cc(nc(c1)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1cc(cc(n1)N1CCOCC1)C(=O)c1ccccc1Cl
CC(C)C[C@]1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1 |r|
CC(C)C[C@@]1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1 |r|
CC(C)CC1CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CSCC1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CCC1(CC)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CC1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CCCC1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CCC1(CC)C(C)N(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CC1(C)C(=O)N(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CC(=O)N1CC2(C1)C(=O)N(c1c2ncnc1N)c1ccc2oc(N)nc2c1 |$;;;;;;;;;;;;;;;;;;;;;;;N;;;$|
CC(C)(C)CC(=O)N1CC2(C1)C(=O)N(c1c2ncnc1N)c1ccc2oc(N)nc2c1
CC(C)(C)OC(=O)N1CC2(C1)CN(c1c2ncnc1N)c1ccc2oc(N)nc2c1
CSC[C@]1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1 |r|
CC(C)CC1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1 |w:4.3|
CSC[C@@]1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1 |r|
Nc1nc2cc(ccc2o1)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)[C@@H]1CCCN1 |r|
CC(=O)Nc1nc2ccc(cc2s1)-c1ccc2oc(N)nc2c1
C[C@H](Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1Cc2ccccc2C1 |r|
CC(Nc1ccccc1C(O)=O)c1cc(C)cc2c1oc(cc2=O)N1CCC(C)(C)CC1
O=C1NC(=S)S\C1=C/c1cnn(c1)-c1ccccc1
Fc1ccccc1-n1cc(\C=C2/SC(=S)NC2=O)cn1
Fc1cccc(c1)-n1cc(\C=C2/SC(=S)NC2=O)cn1
Fc1ccc(cc1)-n1cc(\C=C2/SC(=S)NC2=O)cn1
Clc1ccccc1-n1cc(\C=C2/SC(=S)NC2=O)cn1
Clc1cccc(c1)-n1cc(\C=C2/SC(=S)NC2=O)cn1
Clc1ccc(cc1)-n1cc(\C=C2/SC(=S)NC2=O)cn1
CC(C)c1ccc(cc1)-n1cc(\C=C2/SC(=S)NC2=O)cn1
COc1ccccc1-n1cc(\C=C2/SC(=S)NC2=O)cn1
O=C1NC(=S)S\C1=C/c1cnn(c1)-c1ccccn1
O=C1NC(=S)S\C1=C/c1cnn(c1)-c1cccnc1
Cc1c(\C=C2/SC(=S)NC2=O)cnn1-c1ccccc1
O=C1NC(=O)\C(S1)=C\c1cnn(c1)-c1ccccc1
O=C1NC(=O)\C(S1)=C\c1cnn(c1)-c1cccnc1
O=C1NC(=S)S\C1=C/c1ccn(n1)-c1ccccn1
O=C1NC(=S)S\C1=C/c1ccn(n1)-c1cccnc1
O=C1NC(=O)\C(S1)=C\c1ccn(n1)-c1ccccn1
O=C1NC(=O)\C(S1)=C\c1ccn(n1)-c1ccncc1
CC(C)C[C@H](C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12 |r|
CC(C)C[C@H](C)n1nc(-c2cc3nc(N)oc3cc2F)c2c(N)nc(N)nc12 |r|
CC1(Cn2nc(-c3ccc4oc(N)nc4c3F)c3c(N)nc(N)nc23)CCC1
CC1(Cn2nc(-c3cc4nc(N)oc4cc3F)c3c(N)nc(N)nc23)CCC1
CC(C)C[C@H](C)n1nc(-c2ccc3oc(N)nc3c2F)c2c(N)nc(N)nc12 |r|
CCC(C)(C)Cn1nc(-c2ccc3oc(NC(C)=O)nc3c2)c2c(N)nc(N)nc12
CC(C)(C)Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12
CCC(C)(C)Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12
CC1(Cn2nc(-c3ccc4oc(N)nc4c3)c3c(N)nc(N)nc23)CSC1
CCC(C)(C)Cn1nc(-c2ccc3oc(N)nc3c2F)c2c(N)nc(N)nc12
CCNc1nc2cc(ccc2o1)-c1nn(CC(C)(C)C)c2nc(N)nc(N)c12
CC(C)(Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12)C=C
CC(C)(Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12)[C@@H]1CCCO1 |r|
CC(C)(Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12)C#C
CC(C)(CO)Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12
CSC(C)(C)Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12
CC(C)(C)Cn1nc(-c2ccc3oc(N)nc3c2Cl)c2c(N)nc(N)nc12
COc1cc2oc(N)nc2cc1-c1nn(CC(C)(C)C)c2nc(N)nc(N)c12
CC(C)(C)Cn1nc(-c2cc3cc(O)cnc3[nH]2)c2c(N)nc(N)nc12
CCC(C)(C)Cn1nc(-c2cc3nc(N)oc3cc2OC)c2c(N)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12
CCC(CC)(Cn1nc(-c2ccc3oc(N)nc3c2)c2c(N)nc(N)nc12)S(C)(=O)=O
CC(C)Cn1nc(-c2ccc3oc(N)nc3c2)c2c(Cl)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2cnc(N)nc12
CC(C)[C@H](C)n1nc(-c2cc3nc(N)oc3cc2Cl)c2c(N)nc(N)nc12 |r|
CNc1nc(N)c2c(nn(C(C)C)c2n1)-c1ccc2oc(N)nc2c1
Cc1nc(N)nc2n(CC(C)(C)C)nc(-c3ccc4oc(N)nc4c3)c12
CC(C)n1nc(-c2ccc3oc(NC4CC4)nc3c2)c2c(N)nc(N)nc12
CCC(C)(C)Cn1nc(-c2cc(C)c3oc(N)nc3c2)c2c(N)nc(N)nc12
CC1(Cn2nc(-c3ccc4oc(N)nc4c3)c3c(N)nc(N)nc23)CCC1
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(Cl)nc(N)nc12
C[C@@H]1COCCN1c1cc(-c2c(C)nn(c2C)-c2cncc(F)c2)n2ncc(-c3ccn[nH]3)c2n1 |wD:1.0,(6.26,6.69,;7.59,5.92,;8.92,6.69,;10.26,5.92,;10.26,4.38,;8.92,3.61,;7.59,4.38,;6.26,3.61,;6.26,2.07,;4.92,1.3,;4.92,-.24,;6.17,-1.14,;7.63,-.67,;5.69,-2.61,;4.15,-2.61,;3.68,-1.14,;2.21,-.67,;3.25,-3.85,;3.88,-5.26,;2.97,-6.51,;1.44,-6.34,;.81,-4.94,;-.72,-4.78,;1.72,-3.69,;3.59,2.07,;2.13,1.6,;1.22,2.84,;2.13,4.09,;1.65,5.55,;.18,6.03,;.18,7.57,;1.65,8.04,;2.55,6.8,;3.59,3.61,;4.92,4.38,)|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(COCCN3CCC(C)(C)CC3)nc2)n(C)c1=O
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCC(=O)N2CCC3(CC3)C2)n(C)c1=O |r|
COC1CCN(CCO[C@H](C)c2ccc(cn2)-c2ccc3nnc4n(C)c(=O)n(C(C)C)c4c3c2)CC1 |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCCC2)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCC(C2)OC2CC2)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CC[C@@H](C)C2)n(C)c1=O |r|
C[C@@H](OCCN1CCC2(CC2)C1)c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1 |r|
C[C@@H](OCCN1CCC2(CC2)CC1)c1ccc(cn1)-c1ccc2nnc3n(C)c(=O)n(C4CCOCC4)c3c2c1 |r|
CO[C@@H]1CCN(CCO[C@H](C)c2ccc(cn2)-c2ccc3nnc4n(C)c(=O)n(C5CCOCC5)c4c3c2)C1 |r|
CO[C@H]1C[C@@H](C1)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](C)OCCN2CCCC2)n(C)c1=O |r,wU:2.1,wD:4.6,23.27,(3.84,4.98,;3.36,3.51,;4.39,2.37,;5.93,2.29,;5.85,.75,;4.31,.83,;6.88,-.39,;6.56,-1.9,;7.9,-2.67,;7.9,-4.21,;6.56,-4.98,;5.23,-4.21,;3.89,-4.98,;2.56,-4.21,;2.56,-2.67,;3.89,-1.9,;5.23,-2.67,;1.23,-1.9,;1.23,-.36,;-.11,.41,;-1.44,-.36,;-1.44,-1.9,;-.11,-2.67,;-2.77,.41,;-2.77,1.95,;-4.11,-.36,;-5.44,.41,;-6.78,-.36,;-8.11,.41,;-8.27,1.94,;-9.78,2.26,;-10.55,.93,;-9.52,-.22,;9.04,-1.64,;10.55,-1.96,;8.41,-.23,;9.18,1.1,)|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@H](OCCN2CCCC2)C(F)(F)F)n(C)c1=O |r|
CC(C)n1c2c(nnc3ccc(cc23)-c2ccc(nc2)[C@@H](OCCN2CCCC2)C(F)(F)F)n(C)c1=O |r|
CCC(C)(C)C(=O)N[C@@H](C1CCCC1)C(=O)OCCCc1cccnc1 |r|
O=C(NCCCc1ccccc1)[C@@H](NC(=O)c1cccc2ccccc12)C1CCCC1 |r|
O=C(NCCCc1ccccc1)[C@@H](NC(=O)c1cccc2ccccc12)C1CCCCC1 |r|
O=C(NCCCc1ccccc1)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C1CCCCC1 |r,TLB:25:16:23:19.20.21,14:16:19:23.22.21,14:16:23:19.20.21,THB:25:20:23:24.17.16,24:22:19:25.17.16,24:16:19:23.22.21|
Clc1ccc(C[C@H](NC(=O)c2cccc3ccccc23)C(=O)NCCCc2ccccc2)cc1 |r|
Clc1ccc(C[C@H](NC(=O)c2ccc3ccccc3c2)C(=O)NCCCc2ccccc2)cc1 |r|
Clc1ccc(C[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)C(=O)NCCCc2ccccc2)cc1 |r,wU:6.6,TLB:8:10:12:14.15.16,THB:17:18:12:14.15.16,17:15:12:18.19.10,10:18:14:12.11.16,10:11:14:18.17.19,(1.49,5.56,;.72,4.22,;1.49,2.89,;.72,1.55,;-.82,1.55,;-1.59,.22,;-1.59,-1.32,;-2.92,-2.09,;-4.25,-1.32,;-4.25,.22,;-5.59,-2.09,;-6.92,-1.32,;-8.25,-2.09,;-8.25,-3.63,;-9.08,-5.53,;-7.69,-4.89,;-7.67,-2.49,;-6.48,-5.56,;-5.59,-3.63,;-6.92,-4.4,;-.25,-2.09,;-.25,-3.63,;1.08,-1.32,;2.41,-2.09,;3.75,-1.32,;5.08,-2.09,;6.42,-1.32,;7.75,-2.09,;9.08,-1.32,;9.08,.22,;7.75,.99,;6.42,.22,;-1.59,2.89,;-.82,4.22,)|
Clc1ccc(C[C@H](NC(=O)c2cnc3ccccc3c2)C(=O)NCCCc2ccccc2)cc1 |r|
Fc1ccc2cc(ccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCCc1ccccc1 |r|
Clc1ccc(C[C@H](NC(=O)c2ccc3cn[nH]c3c2)C(=O)NCCCc2ccccc2)cc1 |r|
COc1ccc2cc(ccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCCc1ccccc1 |r|
Cn1c(cc2ccccc12)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCCc1ccccc1 |r|
Fc1ccc(C[C@H](NC(=O)c2ccc3ccccc3c2)C(=O)NCCCc2ccccc2)cc1 |r|
Clc1ccc(C[C@@H](NC(=O)c2ccc3ccccc3c2)C(=O)NCCCc2ccccc2)cc1 |r|
Clc1ccc(CC(NC(=O)c2ccc3ccccc3c2)C(=O)NCCCc2ccncc2)cc1
Fc1ccc2cc(ccc2c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCCc1cccnc1 |r|
Clc1ccc(C[C@H](NC(=O)c2ccc3c(n[nH]c3c2)-c2ccccc2)C(=O)NCCCc2ccccc2)cc1 |r|
Fc1ccc(cc1)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCCc1ccccc1 |r|
Clc1ccc(C[C@H](NC(=O)c2ccc(Oc3ccccc3)cc2)C(=O)NCCCc2ccccc2)cc1 |r|
Clc1ccc(C[C@H](NC(=O)c2nc3ccccc3[nH]2)C(=O)NCCCc2ccccc2)cc1 |r|
Fc1ccc2cc(ccc2c1)C(=O)N[C@H](C(=O)NCCCc1ccccc1)c1ccccc1 |r|
Cn1c(\C=C\c2ccc(Cl)cc2)nc2ccccc12
CCn1c(\C=C\c2ccc(Cl)cc2)nc2ccccc12
CN(C)c1ccc(\C=C\c2nc3ccccc3n2C)cc1
Fc1ccccc1Cn1c(\C=C\c2ccccc2)nc2ccccc12
C(c1ccccc1)n1c(\C=C\c2ccccc2)nc2ccccc12
CCCn1c(\C=C\c2ccccc2)nc2ccccc12
Clc1ccccc1Cn1c(\C=C\c2ccccc2)nc2ccccc12
Cc1ccc(Cn2c(\C=C\c3ccc(F)cc3)nc3ccccc23)cc1
Clc1ccc(\C=C\c2nc3ccccc3n2Cc2ccccc2)cc1
CCCCn1c(\C=C\c2ccccc2)nc2ccccc12
CC(C)Cn1c(\C=C\c2ccccc2)nc2ccccc12
CCCCn1c(\C=C\c2ccc(F)cc2)nc2ccccc12
CC(C)CCn1c(\C=C\c2ccc(Cl)cc2)nc2ccccc12
CC(C)CCn1c(\C=C\c2ccc(F)cc2)nc2ccccc12
C=CCn1c(\C=C\c2ccccc2)nc2ccccc12
Cn1c(\N=N\c2ccc(O)cc2)nc2ccccc12
CN(C)c1ccc(cc1)\N=N\c1nc2ccccc2n1C
Cn1c(\N=N\c2cccc3ccccc23)nc2ccccc12
COc1ccc2ccccc2c1\N=N\c1nc2ccccc2n1C
COc1ccc(\N=N\c2nc3ccccc3n2C)c2ccccc12
Cn1c(\N=N\c2c(Nc3ccccc3)ccc3ccccc23)nc2ccccc12
Cn1c(\N=N\c2c(O)ccc3ccccc23)nc2ccccc12
Cn1c2cnc3cc(F)c(-c4ccc(OCCCN5CCCCC5)nc4)c4OC5CCCCC5n(c2c34)c1=O
CC[C@@H]1COc2c(c(F)cc3ncc4n(C)c(=O)n1c4c23)-c1ccc(OCCCN2CCCCC2)nc1 |r|
CC(C)n1c2c(n(C)c1=O)N=NC1CC(F)C(C3C=NC(OCCCN4CCCCC4)=CC3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN(C)C)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(N5CCC(N(C)C)CC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(N5CCC(CN(C)C)C5)nc4)cc3c21
CC(C)n1c2c(n(C)c1=O)N=NC1C=C(F)C(c3ccc(COCCN(C)C)nc3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CCCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CCCC5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CC[C@@H](F)C5)nc4)cc3c21
CC(C)n1c2c(nnc3cc(F)c(cc23)-c2ccc(COCCN3CCC(F)CC3)nc2)n(C)c1=O
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(COCCN5CC6CC6C5)nc4)cc3c21
CC(C)n1c2c(n(C)c1=O)N=NC1C=C(F)C(c3ccc(C(=O)NCCN(C)C)nc3)=CC21
CC(C)n1c2c(n(C)c1=O)N=NC1CC(F)C(C3C=NC(OCCCN4CCC(F)CC4)=CC3)=CC21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC[C@H](F)C5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC[C@@H](F)C5)nc4)cc3c21
CC(C)n1c(=O)n(C)c2nnc3cc(F)c(-c4ccc(OCCCN5CC6CC6C5)nc4)cc3c21
Nc1nc2cc(-c3nn(CCCCC(=O)NCCCCCCCC/C=C/C(=O)N4CCC[C@@H](n5nc(-c6ccc(Oc7ccccc7)cc6)c6c(N)ncnc65)C4)c4ncnc(N)c34)ccc2o1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2ccc(-c3cccc(C(=O)NCCOCCOCCOCCOC/C=C/C(=O)N4CCC[C@@H](n5nc(-c6ccc(Oc7ccccc7)cc6)c6c(N)ncnc65)C4)c3)nc2n1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2ccc(-c3cccc(C(=O)NCCOCCOCCOCCOCCOCCOCCOCCOC/C=C/C(=O)N4CCC[C@@H](n5nc(-c6ccc(Oc7ccccc7)cc6)c6c(N)ncnc65)C4)c3)nc2n1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2ccc(-c3cccc(C(=O)NCCCCCCCC/C=C/C(=O)N4CCC[C@@H](n5nc(-c6ccc(Oc7ccccc7)cc6)c6c(N)ncnc65)C4)c3)nc2n1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2ccc(-c3cccc(C(=O)NCCCCCCCCOc4ccc(C(=O)C[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)c3)nc2n1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2ccc(-c3cccc(C(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)c3)nc2n1
C[C@@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2ccc(-c3cccc(C(=O)NCCOCCOCCOCCOCCOc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)c3)nc2n1
COc1ccc(Oc2cc(C)c(-c3csc(NC(=O)c4ccnc(F)c4)n3)c(C)c2)cc1
Cn1cc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2c1
Cn1c2cnc3ccccc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O
Cc1ccc(cc1)-n1c2c(cnc3ccc(cc23)-c2ccncc2)n(C)c1=O
COc1ccc(cc1)-n1c2c(cnc3ccc(cc23)-c2ccncc2)n(C)c1=O
Cc1cc(=O)oc2cc(O)c(O)cc12
c1cnn(c1)-c1ccccc1
c1ccn(c1)-c1ccccc1
c1ccc(nc1)-c1nnn[nH]1
c1nnc([nH]1)-c1ccccc1
c1c[nH]c(n1)-c1ccccc1
O=S(=O)(Nc1ccccc1)c1ccccc1
c1cc(on1)-c1ccccc1
CCOC(=O)C1CCC(=O)C=C1C |c:10|
c1cc(n[nH]1)-c1ccccc1
c1nc(c[nH]1)-c1ccccc1
Cc1cc(=O)oc2ccc(O)cc12
c1cn(cn1)-c1ccccc1
c1ccc2[nH]c(nc2c1)-c1cccnc1
c1ccc(nc1)-c1nc2ccccc2[nH]1
O=S(=O)(NC1CCCCC1)c1ccccc1
CCN(CC)c1ccc2c(c1)OC(=O)C=C2C
CCCCSC(=O)C1CC(=O)NC(=O)C1
c1ccc(cc1)-c1nnn[nH]1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOCC1 |r|
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CSc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2Cl)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
C[C@@H]1COCCN1c1cc(nc(n1)-c1cccc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CS(=O)(=O)C1(CC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CC(C)(c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1)S(C)(=O)=O
CS(=O)(=O)C1(CCNCC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
Cc1cc(\C=N\NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3sccc3n2)cc(C)c1O
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1C(C)C
CCc1cc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cnc1OC
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cn1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)CO)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)CO)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)O)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)O)cc1F |r|
COc1ncc(Nc2ncc(CO)cc2-c2nc(C)nc(N)n2)cc1F
Oc1c(Br)cc(\C=N\Nc2nc3CCSCc3c(n2)N2CCOCC2)cc1Br
COc1cc(\C=N\Nc2nc3CCSCc3c(n2)N2CCOCC2)cc(OC)c1O
Oc1ccc(\C=N\Nc2nc3CCSCc3c(n2)N2CCOCC2)cc1Br
Oc1c(Br)cc(\C=N\Nc2nc3CCS(=O)(=O)Cc3c(n2)N2CCOCC2)cc1Br
COc1cc(CN=Nc2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc(OC)c1O |w:7.7|
COc1cc(\C=N\Nc2nc3CCS(=O)(=O)Cc3c(n2)N2CCOCC2)cc(OC)c1O
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C2(CC2)C#N)c1=O)-c1cnc2ccccc2c1
O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)C(C)(C)C |r|
C[C@@H]1Cn2ncc(c2CN1c1ccnc2[nH]ccc12)-c1ccc(cc1)S(C)(=O)=O |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|
C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|
C[C@H](n1cnc2c(nc(cc12)-c1cncc2[nH]ccc12)N1CCOC[C@H]1C)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1cncc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1nncc2[nH]ccc12 |r|
CC(C)(C#N)c1ccc(cc1)N1C(=O)OCc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
CCN(CC)CCCNc1nc(nc2ccsc12)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
O=c1cc(oc2c(cccc12)-c1cccc2c3ccccc3sc12)N1CCOCC1
O=c1cc(oc2c3ccccc3ccc12)N1CCOCC1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1cnc2nc(N)nc(C)c2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1OC)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1cccs1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cnc2nc(N)nc(C)c2c1
COc1ncc(cc1NS(=O)(=O)c1cccnc1)-c1cnc2nc(N)nc(C)c2c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:19.20,wD:22.27,(7.3,4.56,;5.97,5.33,;4.64,4.56,;3.3,5.33,;1.97,4.56,;1.97,3.02,;3.3,2.25,;4.64,3.02,;.64,2.25,;-.7,3.02,;-2.03,2.25,;-3.37,3.02,;-3.37,4.56,;-4.7,2.25,;-4.7,.71,;-6.03,-.06,;-3.37,-.06,;-2.03,.71,;-.7,-.06,;-.7,-1.6,;.64,-2.37,;.64,-3.91,;-.7,-4.68,;-2.03,-3.91,;-2.03,-2.37,;-.7,-6.22,;.64,-6.99,;.64,-8.53,;1.97,-9.3,;.64,.71,;1.97,-.06,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2nc(N)nc(C)c2c1
C[C@@H](O)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)-c2cnc(N)nc2)N2CCOCC2)CC1 |r|
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccc3n(ccc3c2n1)S(C)(=O)=O
CNC(=O)Nc1ccc(cc1)-c1nc(nc2n(ncc12)C1CCOCC1)N1CCOCC1
CC1CN(CCO1)c1cc(=O)c2ccc3ccccc3c2o1
O=c1cc(nc2c3ccccc3ccn12)N1CCOCC1
C[C@H]1COCCN1c1cc(nc(n1)-c1ccc(NC(=S)NCCO)cc1)C1(CC1)S(=O)(=O)C1CC1 |r|
O=S(=O)(Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1)c1ccccc1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2[nH]ccc2c1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc(NC(=O)Nc2ccc(F)cc2)cc1)N1CCOCC1
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)NCCN(C)C)cc1 |r|
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc(NC(=O)NCCO)cc1 |r|
[O-][N+](=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4sccc4n3)c(=O)c2c1
OC(=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4sccc4n3)c(=O)c2c1
N#Cc1cccc(Cn2cc(\C=N\Nc3nc(nc(n3)N3CCOCC3)N3CCOCC3)c3ccccc23)c1
Fc1cccc(Cn2cc(\C=N\Nc3nc(N4CCOCC4)c4sccc4n3)c3ccccc23)c1
[O-][N+](=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4ccsc4n3)c(=O)c2c1
OC(=O)c1ccc2occ(\C=N\Nc3nc(N4CCOCC4)c4ccsc4n3)c(=O)c2c1
COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C([C@@H]2CCC(=O)[C@@]2(C)C[C@H]1OC(C)=O)C3=O |r,t:16|
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@@H]1n1cnnn1 |c:14,33,t:29,31|
CO[C@@H]1C[C@H](CC(C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@H]3O[C@](O)([C@H](C)C[C@@H]3OC)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O |c:14,33,t:29,31|
CO[C@@H]1C[C@H](C[C@@H](C)C2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1OC(=O)N(C)OC |c:14,33,t:29,31|
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@@H]1n1ncnn1 |c:14,33,t:29,31|
CCn1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc2c(ncnc2s1)-c1ccncc1
Cc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ncnc2s1)-c1ccncc1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2c(ncnc2s1)-c1ccncc1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2c(ncnc2s1)-c1ccncc1
Clc1ccc(s1)S(=O)(=O)Nc1cc(cnc1Cl)-c1cc2c(ncnc2s1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2ncnc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncnc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(ccnc2cn1)-c1ccncc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2nccc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nncc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cnc2nc(N)nc(-c3ccncc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nc(N)nc(-c3ccncc3)c2c1
CO[C@H]1CC[C@H](CC1)N1CC(=O)Nc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wD:2.1,5.8,(-2.38,8.32,;-1.32,7.7,;-1.32,6.16,;-2.65,5.39,;-2.66,3.85,;-1.33,3.08,;.01,3.84,;.01,5.38,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-3.75,-1.39,;-1.33,-1.54,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;1.33,1.54,;,.77,;4,1.54,;3.99,3.08,;5.33,3.85,;6.66,3.08,;6.66,1.54,;5.33,.77,;7.99,3.86,;9.06,3.24,;9.06,4.47,;7.99,5.09,)|
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:22.23,wD:19.19,(-9.08,-3.23,;-8.02,-3.85,;-9.08,-4.47,;-8.02,-5.08,;-6.68,-3.08,;-5.35,-3.85,;-4.01,-3.08,;-4.01,-1.54,;-5.35,-.77,;-6.68,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;1.33,-3.08,;-0,-3.85,;-.01,-5.39,;1.33,-6.16,;1.32,-7.39,;2.66,-5.39,;2.66,-3.85,;,-.77,;-1.33,-1.54,)|
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N([C@@H]3CC[C@H](O)CC3)c2n1 |r,wD:19.19,22.23,(-9.08,-3.23,;-8.02,-3.85,;-9.08,-4.47,;-8.02,-5.08,;-6.68,-3.08,;-5.35,-3.85,;-4.01,-3.08,;-4.01,-1.54,;-5.35,-.77,;-6.68,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;1.33,-3.08,;2.66,-3.85,;2.66,-5.39,;1.33,-6.16,;1.32,-7.39,;-.01,-5.39,;-0,-3.85,;,-.77,;-1.33,-1.54,)|
CO[C@H]1CC[C@H](CN2C(=O)CNc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wU:5.5,wD:2.1,(6.68,-7.38,;6.68,-6.15,;5.34,-5.38,;5.34,-3.84,;4,-3.07,;2.67,-3.85,;1.33,-3.08,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,;2.68,-5.39,;4.01,-6.15,)|
CO[C@H]1CC[C@H](CN2CC(=O)Nc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wU:2.1,wD:5.5,(6.68,7.38,;6.68,6.15,;5.34,5.38,;5.34,3.84,;4,3.07,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-8.02,3.85,;-9.08,3.23,;-9.08,4.47,;-8.02,5.08,;2.68,5.39,;4.01,6.15,)|
CO[C@@H]1CC[C@H](CN2C(=O)CNc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wU:5.5,2.1,(6.68,-7.38,;6.68,-6.15,;5.34,-5.38,;5.34,-3.84,;4,-3.07,;2.67,-3.85,;1.33,-3.08,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,;2.68,-5.39,;4.01,-6.15,)|
CO[C@@H]1CC[C@H](CN2CC(=O)Nc3ncc(nc23)-c2ccc(nc2)C(C)(C)O)CC1 |r,wD:5.5,2.1,(6.68,7.38,;6.68,6.15,;5.34,5.38,;5.34,3.84,;4,3.07,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-8.02,3.85,;-9.08,3.23,;-9.08,4.47,;-8.02,5.08,;2.68,5.39,;4.01,6.15,)|
CC(C)(O)c1ccc(cn1)-c1cnc2[nH]c(=O)n(CCC3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(CC3CCCCC3)c2n1
COCCN1CC(=O)Nc2ncc(nc12)-c1ccc(nc1)C(C)(C)O
COCCN1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(C3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N(C3CCOCC3)c2n1
Cc1nc(ccc1-c1cnc2NC(=O)CN(CCC3CCOCC3)c2n1)-c1nc[nH]n1
Cc1nc(ccc1-c1cnc2NCC(=O)N(CCC3CCOCC3)c2n1)-c1nc[nH]n1
O=C1CN(CCC2CCOCC2)c2nc(cnc2N1)-c1ccc2[nH]ccc2c1
O=C1CNc2ncc(nc2N1CCC1CCOCC1)-c1ccc2[nH]ccc2c1
O=C1CNc2ncc(nc2N1CCC1CCOCC1)-c1ccc(cc1)-c1nc[nH]n1
Cc1cc(ccc1-c1cnc2NC(=O)CN(CCC3CCOCC3)c2n1)-c1nc[nH]n1
Cc1cc(ccc1-c1cnc2NCC(=O)N(CCC3CCOCC3)c2n1)-c1nc[nH]n1
O=C1CN(CCC2CCOCC2)c2nc(cnc2N1)-c1ccc(nc1)-c1nc[nH]n1
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N(CC3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(CC3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NC(=O)CN(CCC3CCOCC3)c2n1
CC(C)(O)c1ccc(cn1)-c1cnc2NCC(=O)N(CCC3CCOCC3)c2n1
O=C1CN(CCC2CCOCC2)c2nc(cnc2N1)-c1ccc(cc1)-c1nnc[nH]1
CC(C)(O)c1ccc(cc1)-c1cnc2NC(=O)CN(CCC3CCOCC3)c2n1
CC(C)(O)c1ccc(cc1)-c1cnc2NCC(=O)N(CCC3CCOCC3)c2n1
CO[C@H]1CC[C@@H](CC1)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wU:2.1,wD:5.8,(2.39,-8.32,;1.33,-7.7,;1.33,-6.16,;-.01,-5.39,;-0,-3.85,;1.33,-3.08,;2.66,-3.85,;2.66,-5.39,;1.33,-1.54,;2.66,-.77,;3.73,-1.38,;2.66,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;-4.01,-1.54,;-4.01,-3.08,;-5.35,-3.85,;-6.68,-3.08,;-6.68,-1.54,;-5.35,-.77,;-8.02,-3.85,;-9.08,-3.23,;-9.08,-4.47,;-8.02,-5.08,)|
CO[C@H]1CC[C@@H](CC1)N1CC(=O)Nc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |r,wU:5.8,wD:2.1,(2.39,8.32,;1.33,7.7,;1.33,6.16,;-.01,5.39,;-0,3.85,;1.33,3.08,;2.66,3.85,;2.66,5.39,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-8.02,3.85,;-9.08,3.23,;-9.08,4.47,;-8.02,5.08,)|
Cc1nc(ccc1-c1cnc2NCC(=O)N(CCN3CCOCC3)c2n1)-c1nc[nH]n1
Cc1nc(ccc1-c1cnc2NCC(=O)N(CC3CCOCC3)c2n1)-c1nc[nH]n1
CO[C@@H]1CC[C@H](CN2C(=O)CNc3ncc(nc23)-c2ccc(nc2C)-c2nc[nH]n2)CC1 |r,wD:5.5,2.1,(6.68,7.38,;6.68,6.15,;5.34,5.38,;5.34,3.84,;4,3.07,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.66,.77,;3.73,1.38,;2.66,-.77,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-5.35,.77,;-6.68,1.54,;-6.68,3.08,;-5.35,3.85,;-4.01,3.08,;-2.95,3.7,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,;2.68,5.39,;4.01,6.15,)|
CO[C@H]1CC[C@H](CN2C(=O)CNc3ncc(nc23)-c2ccc(nc2C)-c2nc[nH]n2)CC1 |r,wU:2.1,wD:5.5,(6.68,7.38,;6.68,6.15,;5.34,5.38,;5.34,3.84,;4,3.07,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.66,.77,;3.73,1.38,;2.66,-.77,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-5.35,.77,;-6.68,1.54,;-6.68,3.08,;-5.35,3.85,;-4.01,3.08,;-2.95,3.7,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,;2.68,5.39,;4.01,6.15,)|
CO[C@H]1CC[C@H](CC1)N1CC(=O)Nc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1 |r,wU:5.8,2.1,(2.39,8.32,;1.33,7.7,;1.33,6.16,;2.66,5.39,;2.66,3.85,;1.33,3.08,;-0,3.85,;-.01,5.39,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-5.35,.77,;-6.68,1.54,;-6.68,3.08,;-5.35,3.85,;-4.01,3.08,;-2.95,3.7,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,)|
CO[C@H]1CC[C@@H](CC1)N1CC(=O)Nc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1 |r,wU:5.8,wD:2.1,(2.39,8.32,;1.33,7.7,;1.33,6.16,;-.01,5.39,;-0,3.85,;1.33,3.08,;2.66,3.85,;2.66,5.39,;1.33,1.54,;2.66,.77,;2.66,-.77,;3.73,-1.38,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-5.35,.77,;-6.68,1.54,;-6.68,3.08,;-5.35,3.85,;-4.01,3.08,;-2.95,3.7,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,)|
CO[C@H]1CC[C@@H](CC1)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1 |r,wU:5.8,wD:2.1,(2.39,8.32,;1.33,7.7,;1.33,6.16,;-.01,5.39,;-0,3.85,;1.33,3.08,;2.66,3.85,;2.66,5.39,;1.33,1.54,;2.66,.77,;3.73,1.38,;2.66,-.77,;1.33,-1.54,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;-4.01,1.54,;-5.35,.77,;-6.68,1.54,;-6.68,3.08,;-5.35,3.85,;-4.01,3.08,;-2.95,3.7,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,)|
Cc1nc(ccc1-c1cnc2NCC(=O)N([C@@H]3CC[C@H](O)CC3)c2n1)-c1nc[nH]n1 |r,wU:16.16,19.20,(-2.95,3.7,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-4.01,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;3.73,1.38,;1.33,1.54,;1.33,3.08,;2.66,3.85,;2.66,5.39,;1.33,6.16,;1.32,7.39,;-.01,5.39,;-0,3.85,;,.77,;-1.33,1.54,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,)|
Cc1nc(ccc1-c1cnc2NCC(=O)N([C@H]3CC[C@H](O)CC3)c2n1)-c1nc[nH]n1 |r,wU:16.16,wD:19.20,(-2.95,3.7,;-4.01,3.08,;-5.35,3.85,;-6.68,3.08,;-6.68,1.54,;-5.35,.77,;-4.01,1.54,;-2.68,.77,;-2.68,-.77,;-1.33,-1.54,;,-.77,;1.33,-1.54,;2.66,-.77,;2.66,.77,;3.73,1.38,;1.33,1.54,;1.33,3.08,;-0,3.85,;-.01,5.39,;1.33,6.16,;1.32,7.39,;2.66,5.39,;2.66,3.85,;,.77,;-1.33,1.54,;-8.02,3.85,;-8.16,5.37,;-9.66,5.69,;-10.43,4.36,;-9.4,3.21,)|
Cc1nc(ccc1-c1cnc2NCC(=O)N(C3CCOCC3)c2n1)-c1nc[nH]n1
CC(C)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
COCCN1CC(=O)Nc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
COCCN1C(=O)CNc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
CCN1CC(=O)Nc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
CCN1C(=O)CNc2ncc(nc12)-c1ccc(nc1C)-c1nc[nH]n1
CN(C)CC(=O)N1CCC(CC1)n1cc(cn1)-c1cnc(N)c(n1)-n1nnc2ccccc12
CN(C)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-n2nnc3ccccc23)n(C)n1
CC(=O)Nc1ccc(cc1)S(=O)(=O)N(c1ccccc1)c1ccnc2ccc(cc12)-c1ccc(O)cc1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nc(NC(=O)NC3CC3)nn2c1
CCN(CC)CCNC(=O)Nc1nc2ccc(cn2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1
Oc1cc(ccc1C(=O)c1ccccc1)N1CCOCC1
COc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1
CCOc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1
COc1ncc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cc1F
Cc1nc(N)nc(n1)-c1c(Nc2ccc3ncccc3c2)nc2ccccn12
Cc1nc(N)nc(n1)-c1c(Nc2ccc3ccncc3c2)nc2ccccn12
Cc1nc(N)nc(n1)-c1c(Nc2ccc3cccnc3c2)nc2ccccn12
Cc1nc(N)nc(n1)-c1c(Nc2cccc3[nH]ncc23)nc2ccccn12
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCNCC2)cc1F
COc1ccc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCNCC2)cn1
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCN(CC2)C(C)C)cc1F
COCCN1CCN(CC1)c1ccc2nc(Nc3cnc(OC)c(F)c3)c(-c3nc(C)nc(N)n3)n2c1
COc1ccc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCN(CC2)C(=O)N(C)C)cn1
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)N2CCN(CC2)C(=O)N(C)C)cc1F
COc1ccc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)C(C)(C)O)cn1
COc1ncc(Nc2nc3ccc(cn3c2-c2nc(C)nc(N)n2)C(C)(C)O)cc1F
C[C@@H]1COCCN1c1cc(=O)n2CC[C@H](N(Cc3cncc(Cl)c3)c2n1)C(F)(F)F |r|
Cc1ccc(cn1)-c1ccc2OCCN(c3nc4CC(C)(C)NC(=O)c4s3)c2c1
CCN1CCN(CC\C=C\c2ccc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c(cnc3c2)C#N)CC1
Oc1cc(CNC=C2C(=O)NC(=O)c3ccc(I)cc23)ccc1-c1ccoc1 |w:6.5|
CCOC(=O)N1CCN(CC#Cc2ccnc3ccc(cc23)-c2cnc(OC)c(NS(=O)(=O)c3ccc(F)cc3F)c2)CC1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(C#CCN3CCN(CC3)S(C)(=O)=O)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccnnc3)c2c1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccc(Nc3cccnc3C#N)cc2n1
Fc1ccc(NC(=O)Nc2ccc(cn2)-c2nc3CCSCc3c(n2)N2CCOCC2)cc1Cl
Fc1ccc(NC(=O)Nc2ccc(cn2)-c2nc3CCS(=O)(=O)Cc3c(n2)N2CCOCC2)cc1Cl
FC(F)(F)c1cc(NC(=O)N2CCN(CC2)c2nc3CCSCc3c(n2)N2CCOCC2)ccc1Cl
FC(F)(F)c1cc(NC(=O)N2CCN(CC2)c2nc3CCS(=O)(=O)Cc3c(n2)N2CCOCC2)ccc1Cl
CC1(C)OCCn2c1nc1c(nc(nc21)-c1cnc(N)nc1)N1CCOCC1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2nc3n(CCOC3(C)C)c2n1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2nc(n(CCO)c2n1)C(C)(C)O
Cc1c(sc2c1nc(nc2N3CCOCC3)c4cnc(nc4)N)CN5CCN(CC5)C(=O)[C@H](C)O
COC1(COC1)c1sc2c(nc(nc2c1C)-c1cnc(N)nc1)N1CCOCC1
COC(C)(C)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
OC(=O)c1ccc2occ(\C=N\Nc3nc4CCSCc4c(n3)N3CCOCC3)c(=O)c2c1
CCOC(Cn1nc(-c2cnc3[nH]ccc3c2)c2c(N)ncnc12)OCC
Cc1ccc(cc1)-c1nn(c2ncnc(N)c12)C(C)(C)C
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
Cc1c(Cc2c(CO)nc3c(N)cc(nn23)N2CCOCC2)cccc1C(F)(F)F
Cc1nc2c(cc(nn2c1Nc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
CC(=O)NCc1nc2c(cc(nn2c1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)-c1cnc[nH]1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN(C)CCO)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(Cn4cncn4)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(-c3ccc(CN(C)C)cc3)c2c1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CC(F)(F)F)c2n1
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C2CCC1COC2
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@H]2C)c2cnn(C3CCN(CC3)C(=O)OCC)c2n1 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C2CCC1COC2
CNC(=O)Nc1ccc(cc1)-c1nc(N2C3CCC2COC3)c2cnn(CC(F)(F)F)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OCC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2C3CCC2COC3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOC(C)C1
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOC[C@H]1C |r|
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CC(F)(F)F)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2C3CCC2COC3)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2cnn(C3CCN(CC3)C(=O)OCC)c2n1 |r|
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOC[C@@H]1C |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CC(F)(F)F)c2n1
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOC[C@H]1C |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC(C)C2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@@H]3C[C@H]2CO3)c2cnn(CC(F)(F)F)c2n1 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1C[C@@H]2C[C@H]1CO2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC(C)C2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C[C@H]2C[C@@H]1CO2 |r|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1C[C@H]2C[C@@H]1CO2 |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@H]3C[C@@H]2CO3)c2cnn(CC(F)(F)F)c2n1 |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@H](C)O[C@H](C)C2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1 |r|
CCOC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOC[C@@H]1C |r|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CC(F)(F)F)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CC2CCC(C1)O2
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C[C@@H]2C[C@H]1CO2 |r|
COc1cc(CN=Nc2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc(OC)c1OC |w:7.7|
COc1cc(cc(OC)c1O)-c1cn(cn1)-c1nccc(n1)N1CCOCC1
COc1cc(CN=Nc2nc(nc(n2)N2CCOCC2)N2CCCCC2)cc(OC)c1O |w:7.7|
COc1cc(CN=Nc2nc(nc(n2)N2CCCCC2)N2CCCCC2)cc(OC)c1O |w:7.7|
COc1cc(CN=Nc2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc(OC)c1O |w:7.7|
COc1cc(cc(OC)c1O)-c1cn(cn1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1cccc(n1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1nc(cs1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1csc(n1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1ccc(o1)-c1ccnc(n1)N1CCOCC1
COc1cc(cc(OC)c1O)-c1ccc(o1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Oc1ccc(cc1)-c1ccc(o1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Oc1cccc(c1)-c1ccc(o1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
OCc1ccc(cc1)-c1ccc(o1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
OCc1cccc(c1)-c1ccc(o1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
C1CN(CCO1)c1cc(nc(n1)N1CCOCC1)-c1ccc(o1)-c1ccncc1
C1CN(CCO1)c1cc(nc(n1)N1CCOCC1)-c1ccc(o1)-c1ccc2[nH]ccc2c1
COc1cc(cc(OC)c1O)-c1cn(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NN(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NN2CCCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:35:42:38.39|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CN(C)CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2 |TLB:9:30:37:33.34|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1)N1CC2CCC(C1)O2 |TLB:6:34:41:37.38|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(NC)nc2)cc1)N1CC2CCC(C1)O2 |TLB:6:29:36:32.33|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(nc2)N(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:30:37:33.34|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCOCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CC2CCC(C1)O2 |TLB:6:27:34:30.31|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CC2CCC(C1)O2 |TLB:6:34:41:37.38|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCCC2)cc1)N1CC2CCC(C1)O2 |TLB:6:32:39:35.36|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CC4CCC(C3)O4)c3cnn(CC(F)(F)F)c3n2)cc1 |TLB:23:24:31:27.28|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCNCC2)cc1)N1CC2CCC(C1)O2 |TLB:9:36:43:39.40|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(NCCN(C)C)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N(C)CCN(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:34:41:37.38|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CN)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:29:36:32.33|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CN3CCN(C)CC3)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:35:42:38.39|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(OCCN(C)C)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:33:40:36.37|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:29:36:32.33|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCO)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:30:37:33.34|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(OCCN3CCOCC3)nc2)cc1)N1CC2CCC(C1)O2 |TLB:6:36:43:39.40|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CN(C)C)cc2)cc1)N1CC2CCC(C1)O2 |TLB:6:31:38:34.35|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CC)c2n1 |TLB:14:15:22:18.19|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CCN(C)C)c2n1 |TLB:14:15:22:18.19|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCN(C)C)cc1)N1CC2CCC(C1)O2 |TLB:6:26:33:29.30|
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CC2CCC(C1)O2 |TLB:6:27:34:30.31|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3cccnc3)cc2)CC1 |TLB:15:16:23:19.20|
CN1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3ccncc3)cc2)CC1 |TLB:12:13:20:16.17|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3ccncc3)cc2)CC1 |TLB:15:16:23:19.20|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:13:14:21:17.18|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:14:15:22:18.19|
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:15:16:23:19.20|
OCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:15:16:23:19.20|
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:15:16:23:19.20|
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:18:19:26:22.23|
O=C(Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1)Nc1cccnc1 |TLB:11:12:19:15.16|
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:18:19:26:22.23|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sc(CN3CCN(C)CC3)cc2n1 |TLB:13:14:21:17.18|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sc(CN3CCN(CC3)S(C)(=O)=O)cc2n1 |TLB:13:14:21:17.18|
CN1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)NC3CC3)cc2)CC1 |TLB:12:13:20:16.17|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)NC3CC3)cc2)CC1 |TLB:15:16:23:19.20|
CN1CCN(Cc2cc3nc(nc(N4CC5CCC(C4)O5)c3s2)-c2ccc(NC(=O)Nc3cccnc3)cc2)CC1 |TLB:12:13:20:16.17|
Oc1cccc(c1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Nc1ncc(cn1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Oc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Nc1ccc(cn1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:9:10:17:13.14|
C1CC2CN(CC1O2)c1nc(nc2ccsc12)-c1ccc2[nH]ccc2c1 |TLB:8:4:7:0.1|
CC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:12:13:20:16.17|
COC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2sccc2n1 |TLB:13:14:21:17.18|
Oc1cccc(c1)-c1nc(N2CCOCC2)c2sccc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2sccc2n1
CC(=O)N1CCC(CC1)n1cnc2c(nc(nc12)-c1cccc(CO)c1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccn4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccc4F)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(F)cc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(cc4)-c4ccncc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(CC3)c3ccc(F)cc3F)c2n1
CN(C)CCCOc1ccc(CN2CCC(CC2)n2cnc3c(nc(nc23)-c2cccc(CO)c2)N2CCOCC2)cc1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCNCC3)c2n1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(Cl)cc4)CC3)c2n1
Cc1ccc(CN2CCC(CC2)n2cnc3c(nc(nc23)-c2cncc(O)c2)N2CCOCC2)cc1
Oc1cncc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(F)nc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCNCC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4cccnc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccc(nc4)N4CCOCC4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4cncc(Cl)c4)CC3)c2n1
COc1ccc(CN2CCC(CC2)n2cnc3c(nc(nc23)-c2cccc(O)c2)N2CCOCC2)cn1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(Cc4ccccc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCNCC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2cnn(CC(F)(F)F)c2n1 |t:15|
FCCNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2cnn(CC(F)(F)F)c2n1 |t:17|
FC(F)(F)Cn1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)C1=CCOCC1 |t:34|
Oc1cccc(c1)-c1nc(C2=CCOCC2)c2cnn(-c3ccccc3)c2n1 |t:11|
Oc1cccc(c1)-c1nc(C2CCOCC2)c2cnn(-c3ccccc3)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:16|
FCCNC(=O)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:17|
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:21|
O=C(Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1)Nc1cccnc1 |t:13|
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(C2=CCOCC2)c2sccc2n1 |t:21|
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ccn(C3CCNCC3)c2n1
Oc1ccc(cc1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
OCc1ccc(cc1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1ccc2cc[nH]c2c1
C1Oc2ccc(cc2O1)-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1ccsc1
Oc1ccccc1-c1nc(N2CCOCC2)c2[nH]cnc2n1
C1CN(CCO1)c1nc(nc2nc[nH]c12)-c1cccs1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CC3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CC3CCN(Cc4ccccc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCN(CC3)C(=O)OC(C)(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C)c2n1
CCn1ncc2c(nc(nc12)-c1ccc(NC(=O)NC)cc1)N1CC2CCC(C1)O2
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CCO)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(CCN(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC(=O)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@H]3CC[C@H](O)CC3)c2n1 |r,wU:26.28,wD:29.32,(3.02,-14.8,;4.36,-15.56,;5.68,-14.79,;5.68,-13.25,;7.02,-15.55,;8.35,-14.78,;8.35,-13.24,;9.67,-12.47,;11.01,-13.24,;11.01,-14.77,;9.69,-15.55,;12.33,-12.47,;12.33,-10.92,;13.67,-10.15,;13.67,-8.59,;12.33,-7.83,;12.33,-6.27,;12.92,-4.89,;14.43,-4.89,;15.02,-6.27,;15.02,-7.83,;13.67,-5.5,;15.02,-10.92,;16.48,-10.43,;17.4,-11.68,;16.49,-12.93,;16.97,-14.39,;18.51,-14.4,;19.27,-15.74,;18.48,-17.07,;19.24,-18.41,;16.94,-17.05,;16.19,-15.72,;15.02,-12.46,;13.67,-13.24,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@@H]3CC[C@H](O)CC3)c2n1 |r,wU:26.28,29.32,(3.05,-14.78,;4.38,-15.55,;5.71,-14.77,;5.7,-13.24,;7.04,-15.54,;8.37,-14.77,;8.37,-13.23,;9.7,-12.46,;11.03,-13.23,;11.04,-14.76,;9.71,-15.53,;12.36,-12.45,;12.36,-10.9,;13.7,-10.13,;13.7,-8.58,;12.36,-7.81,;12.36,-6.26,;12.94,-4.86,;14.45,-4.86,;15.04,-6.26,;15.04,-7.81,;13.7,-5.5,;15.04,-10.9,;16.51,-10.42,;17.42,-11.67,;16.52,-12.92,;17,-14.38,;16.19,-15.69,;16.92,-17.04,;18.46,-17.08,;19.19,-18.44,;19.26,-15.77,;18.53,-14.41,;15.04,-12.45,;13.7,-13.22,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@H]3CC[C@@H](CC3)OC)c2n1 |r,wU:26.28,wD:29.35,(2.25,-14.82,;3.57,-15.58,;4.9,-14.81,;4.9,-13.27,;6.23,-15.57,;7.56,-14.8,;7.56,-13.26,;8.89,-12.49,;10.22,-13.26,;10.23,-14.79,;8.91,-15.57,;11.55,-12.49,;11.55,-10.93,;12.89,-10.17,;12.89,-8.61,;11.55,-7.84,;11.55,-6.29,;12.13,-4.9,;13.65,-4.9,;14.23,-6.29,;14.23,-7.84,;12.89,-5.52,;14.23,-10.93,;15.7,-10.45,;16.61,-11.7,;15.71,-12.95,;16.19,-14.41,;17.72,-14.39,;18.5,-15.73,;17.74,-17.07,;16.2,-17.07,;15.43,-15.75,;18.52,-18.4,;20.06,-18.39,;14.24,-12.48,;12.89,-13.26,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn([C@@H]3CC[C@@H](CC3)OC)c2n1 |r,wU:26.28,29.35,(3.04,-14.26,;4.37,-15.02,;5.7,-14.25,;5.7,-12.71,;7.04,-15.01,;8.37,-14.24,;8.36,-12.7,;9.69,-11.93,;11.03,-12.7,;11.03,-14.23,;9.71,-15.01,;12.35,-11.93,;12.35,-10.38,;13.69,-9.61,;13.69,-8.05,;12.35,-7.28,;12.35,-5.73,;12.94,-4.34,;14.45,-4.34,;15.04,-5.73,;15.04,-7.28,;13.69,-4.96,;15.04,-10.38,;16.5,-9.89,;17.42,-11.14,;16.51,-12.39,;16.99,-13.85,;16.19,-15.17,;16.93,-16.51,;18.47,-16.55,;19.27,-15.23,;18.53,-13.88,;19.21,-17.9,;18.41,-19.22,;15.04,-11.92,;13.69,-12.7,)|
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC(CC3)(OC)OC)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCCO4)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1
O=C(Nc1ccc(cc1)-c1nc(N2CC3CCC(C2)O3)c2cnn(C3CCC4(CC3)OCCO4)c2n1)Nc1cccnc1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)C)cc1)N1CCOCC1
CCCCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3nnn(CC)c3n2)cc1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCc2ccccn2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN2CCN(C)CC2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCCN(C)C)cc1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2nnn(C3CCN(Cc4ccccc4)CC3)c2n1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2nnn(C3CC3)c2n1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
Cn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2nnn(C3CC3)c2n1)Nc1cccnc1
Cn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccs2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccs2)cc1)N1CCOCC1
O=C(Nc1cccs1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2nnn(C3CC3)c2n1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccnc(C)c2)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N(C)C)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CCn1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)OC)cc1)N1CCOCC1
CC(C)n1nnc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCOCC2)cc1)N1CCOCC1
CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3nnn(CC)c3n2)cc1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
CC(C)(O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cccc2[nH]ncc12
CC(C)(O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2sc(CN3CCN(CC3)S(C)(=O)=O)cc2n1
Cc1nc(N)ncc1-c1nc(N2CCOCC2)c2sc(cc2n1)C(C)(C)O
Nc1ncnc2n(nc(-c3cnc4[nH]ccc4c3)c12)C1CCCC1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2cc(nn12)-c1ccncc1
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1C2CCC1COC2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCOCC1
CCN(CC)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(C)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1C2CCC1COC2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CC2CCC1CO2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCOCC1
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4ccc(nc4)N4CCOCC4)cc3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4ccccc4)cc3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
CN(C)CCNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(N5CC6CCC(C5)O6)c34)C(=O)c2c1
CCNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(N5CC6CCC(C5)O6)c34)C(=O)c2c1
CNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(N5CC6CCC(C5)O6)c34)C(=O)c2c1
CNC(=O)Nc1cccc2O\C(=C/c3cn(C)c4nccc(-c5ccccc5)c34)C(=O)c12
CNC(=O)Nc1ccc2O\C(=C/c3cn(C)c4nccc(-c5ccccc5)c34)C(=O)c2c1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccccc1
CN(C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12)c1cccnc1
CN(Cc1ccccc1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(Cc1ccccn1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(Cc1ccncc1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(Cc1cccnc1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)NCc1cccnc1
CN(C)C1CCN(C1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
COC1CCN(C1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCCCC1
Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCCC1
CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c12
CN(C)C(=O)c1ccccc1-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(N)=O
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CN)CC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(N)CC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCOCC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1C2CCC1COC2
CN1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(c2c1nccc2N3CCN(CC3)C)/C=C\4/C(=O)c5c(cc(cc5O4)O)O
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2ccccc12
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2c(cccc12)-c1ccccc1
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2cccnc12
Cn1cc(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2c(ccnc12)-c1ccccc1
Cn1cc(\C=C2/Oc3cc(O)ccc3C2=O)c2c(ccnc12)-c1ccccc1
CN(C)C(=O)c1ccc(cc1)-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
CN(C)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CCOCC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCOCC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CC2CCC(C1)O2
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CC2CCC(C1)O2
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
CN1CCN(CC1)C(=O)C1CCN(CC1)c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CCN(CCO)CC1
Cn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)N1CCN(CCO)CC1
CCn1cc(\C=C2/Oc3cccc(O)c3C2=O)c2c(ccnc12)-c1ccc(cc1)C(=O)N1CCN(CCO)CC1
CN(C)C(=O)c1cccc(c1)-c1ccnc2n(C)cc(\C=C3/Oc4cccc(O)c4C3=O)c12
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
O=C(Nc1ccc(cc1)N1CCNCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(cc3)-c3nc(nc(n3)N3C4CCC3COC4)N3C4CCC3COC4)cc2)CC1
CN(C)Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CNCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CN(C)CCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CN1CCN(CCOc2ccc(NC(=O)Nc3ccc(cc3)-c3nc(nc(n3)N3C4CCC3COC4)N3C4CCC3COC4)cc2)CC1
O=C(Nc1ccc(OCCN2CCCC2)cc1)Nc1ccc(cc1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
OCCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2C3CCC2COC3)cc1
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)N2[C@@H](CO)CC[C@H]2CO)cc1 |r|
CC(C)Nc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1C2CCC1COC2
CC(C)N(C)c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1C2CCC1COC2
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCSCC2)N2C3CCC2COC3)cc1
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1C2CCC1COC2 |r|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)C2=CCOCC2)N2C3CCC2COC3)cc1 |t:30|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
O=C(Nc1ccc(cc1)N1CCNCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1C2CCC1COC2)C1CCOCC1
CCN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CC(C)N1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)C1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
CN(C)CCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCNCC2)cc1)N1C2CCC1COC2 |r|
CCN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)N2C3CCC2COC3)cc1 |r|
CC(C)N1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)N2C3CCC2COC3)cc1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCC(CC2)N(C)C)cc1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1C2CCC1COC2 |r|
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)N2C3CCC2COC3)cc1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(OCCN(C)C)cc2)cc1)N1C2CCC1COC2 |r|
CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@H]2C)C2CCOCC2)cc1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCC(CC2)N(C)C)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(CN(C)C)cc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(OCCN(C)C)cc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)C)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCNCC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCC(CC2)N(C)C)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1C[C@@H]2C[C@H]1CO2 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2cccnc2)cc1)C1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(nc2)N2CCN(C)CC2)cc1)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CCOC[C@H]1C |r|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CC3CCC(C2)O3)N2CC3CCC(C2)O3)cc1 |TLB:25:27:34:30.31,23:35:42:38.39|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C[C@H]3C[C@@H]2CO3)N2C[C@H]3C[C@@H]2CO3)cc1 |r,THB:25:27:30:33.32|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C[C@@H]3C[C@H]2CO3)N2C[C@@H]3C[C@H]2CO3)cc1 |r,TLB:23:34:37:39.40,25:27:30:32.33|
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CC3CCC(C2)O3)N2C3CCC2COC3)cc1 |TLB:25:27:34:30.31|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2 |TLB:16:18:25:21.22,14:26:33:29.30|
FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CCOCC1 |TLB:16:18:25:21.22|
CNC(=O)Nc1ccc(cc1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2 |TLB:15:17:24:20.21,13:25:32:28.29|
CCNC(=O)Nc1ccc(cc1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2 |TLB:16:18:25:21.22,14:26:33:29.30|
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2 |TLB:17:19:26:22.23,15:27:34:30.31|
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2 |TLB:18:30:37:33.34,20:22:29:25.26|
COc1ccc2n(C)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2[nH]c(c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1)-c1cccnc1
COc1ccc2[nH]c(c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1)-c1ccccc1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccc4ccccc4c3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccc(Cl)cc3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccc(F)cc3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccccn3)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c([nH]c4ccccc34)-c3ccccc3)C(=O)c2c(O)c1
COc1ccc2[nH]c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Cc1[nH]c2ccc(Br)cc2c1\C=C1/Oc2cc(O)cc(O)c2C1=O
Cc1[nH]c2ccccc2c1\C=C1/Oc2cc(O)cc(O)c2C1=O
Oc1cc2O\C(=C/c3c[nH]c4ccc(Oc5ccccc5)cc34)C(=O)c2c(O)c1
COc1ccc2[nH]cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Oc1cc2O\C(=C/c3c[nH]c4ccc(Br)cc34)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c[nH]c4ccc(Cl)cc34)C(=O)c2c(O)c1
Oc1cc2O\C(=C/c3c[nH]c4ccccc34)C(=O)c2c(O)c1
COc1ccc2n(CCCN3CCN(CCO)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCN(C)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCOCC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN(C)C)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCN(CCO)CC3)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN3CCOCC3)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCCN(C)C)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCN(CCCO)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCN(C)CC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCOCC3)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN(C)C)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
COc1ccc2n(CCN3CCN(CCCO)CC3)cc(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
Cn1c(c(\C=C2/Oc3cc(O)cc(O)c3C2=O)c2ccccc12)-c1ccccc1
COc1ccc2n(C)c(C)c(\C=C3/Oc4cc(O)cc(O)c4C3=O)c2c1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ncnc2sc(cc12)-c1ccncc1
CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCNCC2)cc1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
Cc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
Nc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]ccc2n1
CN(C)Cc1c[nH]c2c(nc(nc12)-c1cccc(CO)c1)N1CCOCC1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(CN3CCCC3)c2n1
Cn1ccc2nc(nc(N3CCOCC3)c12)-c1cccc(CO)c1
Cn1cc(CN2CCCC2)c2nc(nc(N3CCOCC3)c12)-c1cccc(CO)c1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(C3CCNCC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(C3CCN(Cc4ccccc4)CC3)c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2[nH]cc(C3CCN(Cc4ccc(F)cc4)CC3)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2cc[nH]c2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cc[nH]c2n1
CN(C)CCn1ccc2c(nc(nc12)-c1cccc(CO)c1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1cccc(O)c1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccccn2)cc1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CN(C)CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(F)cc2)cc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN(C)C)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN(C)C)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cc[nH]c2n1
FC(F)(F)Cn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
COC(Cn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1)OC
O=CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN3CCCC3)c2n1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN3CCCCC3)c2n1
CN(C)CCNCCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CN1CCN(CCn2ccc3c(nc(nc23)-c2ccc(NC(=O)Nc3ccncc3)cc2)N2CCOCC2)CC1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ccn(CCN3CCNCC3)c2n1
OCCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
CN(C)CCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CN(C)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ccn(CC(F)(F)F)c3n2)cc1
CCn1ccc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CN(Cc1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1)S(C)(=O)=O
CN(Cc1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1)C(C)=O
CC(C)(N)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
CS(=O)(=O)c1cccc(c1)-c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
Cc1c(sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1)-c1cccc(c1)S(C)(=O)=O
Cc1c(CN2CCN(CC2)S(C)(=O)=O)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
CN(Cc1sc2c(nc(nc2c1C)-c1cnc(N)nc1)N1CCOCC1)C(C)=O
CN1CCN(CC1)C(=O)c1cccc(c1)-c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
CN1CCN(CC1)C(=O)c1cccc(c1)-c1sc2c(nc(nc2c1C)-c1cnc(N)nc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCO)cc2)cc1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC(C)C)c2n1
CC(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
OCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccccc2)cc1)N1CCOCC1
CC(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1)N1CCOCC1
CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
O=C(Nc1ncc[nH]1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC(C)(C)C)c2n1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCN3CCCC3)cc2)cc1)N1CCOCC1
COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CCN3CCN(C)CC3)cc2)cc1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1)Nc1cccnc1
CN(C)CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CN(C)C(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CN(C)NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Nc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
Nc1cccc(n1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CN1CCC(CC1)NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Nc1ccc(nc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
CNC(=O)Cc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
FCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
O=C(NC1CC1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CC(C)NC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CONC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
COCCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
CONC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
C1CN(CCO1)c1nc(nc2n(ncc12)-c1ccccc1)-c1ccc2[nH]ccc2c1
CN(C(C)=O)c1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1
Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
COc1cc(Nc2c(cnc3cc(\C=C\CCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
CC(CN1CCCCC1)OC(=O)[C@@H]1CCCN1C(=O)C(=O)C(C)(C)C
CC(C)CC(=O)C(=O)N1CCC[C@H]1C(=O)OC(C)CN1CCCCC1
CC(CN1CCCCC1)OC(=O)[C@@H]1CCCN1C(=O)C(=O)c1ccccc1
CC(C)CC(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1cccnc1
CC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)OCCS(=O)(=O)c1ccccc1
CC(C)CC(=O)C(=O)N1CCC[C@H]1C(=O)OCCS(=O)(=O)c1ccccc1
O=C(OCCS(=O)(=O)c1ccccc1)[C@@H]1CCCN1C(=O)C(=O)c1ccccc1
CC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1cccnc1
O=C(OCCCc1cccnc1)[C@@H]1CCCN1C(=O)C(=O)c1ccccc1
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-3.98,-22,;-3.98,-23.54,;-2.64,-24.31,;-2.64,-25.86,;-1.31,-26.62,;.03,-25.85,;1.49,-26.32,;2.4,-25.07,;1.49,-23.82,;2.09,-22.4,;1.32,-21.07,;1.95,-19.66,;.8,-18.64,;.8,-17.11,;-.53,-16.34,;-1.86,-17.12,;-3.2,-16.35,;-3.2,-14.81,;-1.87,-14.03,;-4.54,-14.04,;-4.55,-12.51,;-5.88,-11.76,;-5.9,-10.23,;-4.57,-9.45,;-3.24,-10.21,;-3.23,-11.74,;-1.85,-18.65,;-.53,-19.4,;-.21,-20.91,;-1.24,-22.06,;.02,-24.3,;-1.31,-23.54,;3.94,-25.07,;4.84,-26.32,;4.36,-27.78,;6.3,-25.85,;6.3,-24.3,;7.55,-23.39,;4.84,-23.82,;4.36,-22.36,)|
CNC(=O)Nc1ccc2O\C(=C\c3c([nH]c4c(F)cc(OC)cc34)-c3c(C)nn(C)c3C)C(=O)c2c1 |(15.41,-12.32,;16.73,-11.54,;18.07,-12.3,;19.4,-11.53,;18.07,-13.84,;19.41,-14.61,;20.75,-13.83,;22.07,-14.6,;22.07,-16.14,;23.22,-17.16,;22.59,-18.56,;23.36,-19.9,;22.76,-21.32,;23.67,-22.57,;22.77,-23.82,;21.3,-23.34,;19.96,-24.12,;19.97,-25.65,;18.63,-23.35,;18.63,-21.81,;17.29,-21.03,;17.29,-19.49,;19.96,-21.03,;21.3,-21.8,;25.21,-22.57,;26.11,-23.81,;25.63,-25.28,;27.57,-23.34,;27.57,-21.8,;28.82,-20.89,;26.11,-21.32,;25.63,-19.85,;21.06,-18.41,;20.03,-19.56,;20.75,-16.9,;19.42,-16.14,)|
COc1cc(F)c2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5cccnc5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-3.89,-40.1,;-3.89,-41.64,;-2.56,-42.41,;-2.56,-43.96,;-1.22,-44.72,;-1.22,-46.26,;.11,-43.95,;1.58,-44.42,;2.48,-43.17,;1.58,-41.92,;2.17,-40.5,;1.41,-39.17,;2.03,-37.76,;.88,-36.74,;.88,-35.21,;-.44,-34.43,;-1.78,-35.21,;-3.11,-34.45,;-3.12,-32.9,;-1.79,-32.13,;-4.46,-32.14,;-4.47,-30.61,;-5.8,-29.86,;-5.81,-28.33,;-4.49,-27.55,;-3.15,-28.31,;-3.14,-29.84,;-1.77,-36.75,;-.44,-37.5,;-.12,-39.01,;-1.16,-40.16,;.11,-42.4,;-1.23,-41.64,;4.02,-43.17,;4.92,-44.42,;4.45,-45.88,;6.39,-43.95,;6.39,-42.4,;7.64,-41.5,;4.92,-41.92,;4.45,-40.46,)|
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCOCC5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-2.53,-10.46,;-2.53,-12,;-1.2,-12.77,;-1.2,-14.32,;.14,-15.09,;1.47,-14.31,;2.94,-14.78,;3.85,-13.53,;2.94,-12.28,;3.54,-10.86,;2.77,-9.53,;3.4,-8.12,;2.25,-7.1,;2.25,-5.57,;.92,-4.79,;-.41,-5.57,;-1.75,-4.8,;-1.76,-3.26,;-.43,-2.49,;-3.1,-2.5,;-3.11,-.97,;-1.78,-.2,;-1.79,1.34,;-3.12,2.1,;-4.45,1.31,;-4.44,-.22,;-3.14,3.63,;-1.81,4.41,;-4.47,4.39,;-4.48,5.92,;-5.81,6.68,;-7.13,5.91,;-7.13,4.37,;-5.79,3.61,;-.41,-7.11,;.92,-7.86,;1.24,-9.37,;.21,-10.52,;1.47,-12.77,;.14,-12,;5.39,-13.53,;6.29,-14.78,;5.81,-16.25,;7.75,-14.31,;7.75,-12.77,;9,-11.86,;6.29,-12.29,;5.81,-10.82,)|
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCN(C)CC5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-2.98,-34.6,;-2.98,-36.14,;-1.64,-36.92,;-1.65,-38.46,;-.31,-39.23,;1.02,-38.45,;2.49,-38.93,;3.4,-37.68,;2.49,-36.43,;3.09,-35.01,;2.32,-33.67,;2.95,-32.27,;1.8,-31.25,;1.8,-29.71,;.47,-28.94,;-.86,-29.72,;-2.2,-28.95,;-2.21,-27.41,;-.87,-26.64,;-3.55,-26.65,;-3.56,-25.12,;-2.23,-24.34,;-2.24,-22.81,;-3.57,-22.05,;-4.9,-22.84,;-4.88,-24.36,;-3.58,-20.52,;-2.26,-19.74,;-4.92,-19.76,;-4.92,-18.23,;-6.25,-17.48,;-7.57,-18.25,;-8.9,-17.49,;-7.56,-19.78,;-6.23,-20.55,;-.85,-31.25,;.47,-32.01,;.79,-33.52,;-.24,-34.67,;1.02,-36.91,;-.31,-36.14,;4.94,-37.68,;5.84,-38.93,;5.36,-40.39,;7.3,-38.45,;7.3,-36.91,;8.55,-36,;5.84,-36.43,;5.36,-34.96,)|
COc1ccc2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N(C)CCN(C)C)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(17.28,-35.65,;17.28,-37.19,;18.62,-37.96,;18.61,-39.51,;19.95,-40.28,;21.28,-39.5,;22.75,-39.97,;23.66,-38.72,;22.75,-37.47,;23.35,-36.05,;22.58,-34.72,;23.21,-33.32,;22.06,-32.29,;22.06,-30.76,;20.73,-29.99,;19.4,-30.77,;18.06,-30,;18.05,-28.46,;19.39,-27.68,;16.71,-27.69,;16.7,-26.16,;18.03,-25.39,;18.02,-23.86,;16.69,-23.1,;15.36,-23.88,;15.38,-25.41,;16.67,-21.56,;18,-20.79,;15.34,-20.81,;15.33,-19.27,;14.02,-21.59,;12.68,-20.83,;11.36,-21.61,;10.03,-20.85,;11.38,-23.14,;19.4,-32.3,;20.73,-33.06,;21.05,-34.56,;20.02,-35.71,;21.28,-37.96,;19.95,-37.19,;25.2,-38.72,;26.1,-39.97,;25.62,-41.44,;27.56,-39.5,;27.56,-37.96,;28.81,-37.05,;26.1,-37.48,;25.62,-36.01,)|
COc1cc(F)c2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCOCC5)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(-4.1,-10.42,;-4.1,-11.96,;-2.77,-12.73,;-2.77,-14.28,;-1.43,-15.05,;-1.43,-16.58,;-.1,-14.27,;1.37,-14.74,;2.27,-13.49,;1.37,-12.24,;1.96,-10.82,;1.2,-9.49,;1.82,-8.08,;.67,-7.06,;.67,-5.53,;-.65,-4.75,;-1.98,-5.53,;-3.32,-4.77,;-3.33,-3.22,;-2,-2.45,;-4.67,-2.46,;-4.68,-.93,;-3.35,-.16,;-3.36,1.37,;-4.7,2.13,;-6.02,1.35,;-6.01,-.18,;-4.71,3.67,;-3.39,4.45,;-6.04,4.42,;-6.05,5.96,;-7.38,6.72,;-8.71,5.95,;-8.7,4.41,;-7.36,3.65,;-1.98,-7.07,;-.65,-7.82,;-.33,-9.33,;-1.36,-10.48,;-.1,-12.73,;-1.44,-11.96,;3.81,-13.49,;4.72,-14.74,;4.24,-16.21,;6.18,-14.27,;6.18,-12.73,;7.43,-11.82,;4.71,-12.24,;4.24,-10.78,)|
COc1cc(F)c2[nH]c(c(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N(C)CCN(C)C)cc4C3=O)c2c1)-c1c(C)nn(C)c1C |(16.64,-8.95,;16.64,-10.49,;17.98,-11.27,;17.98,-12.81,;19.32,-13.58,;19.32,-15.12,;20.65,-12.81,;22.12,-13.28,;23.02,-12.03,;22.12,-10.78,;22.71,-9.36,;21.95,-8.02,;22.57,-6.62,;21.42,-5.6,;21.42,-4.06,;20.1,-3.29,;18.76,-4.07,;17.42,-3.3,;17.42,-1.76,;18.75,-.99,;16.08,-1,;16.07,.53,;17.4,1.31,;17.39,2.84,;16.05,3.6,;14.73,2.81,;14.74,1.29,;16.04,5.13,;17.36,5.91,;14.71,5.89,;14.69,7.42,;13.38,5.11,;12.05,5.87,;10.73,5.09,;9.39,5.85,;10.74,3.56,;18.77,-5.6,;20.1,-6.36,;20.42,-7.87,;19.38,-9.02,;20.65,-11.26,;19.31,-10.49,;24.56,-12.03,;25.46,-13.28,;24.99,-14.74,;26.93,-12.8,;26.93,-11.26,;28.18,-10.35,;25.46,-10.78,;24.99,-9.32,)|
COc1ccc2[nH]cc(\C=C3\Oc4ccc(NC(=O)Nc5ccc(cc5)C(=O)N5CCN(C)CC5)cc4C3=O)c2c1
CNC(=O)Nc1ccc2O\C(=C\c3c([nH]c4ccc(OC)cc34)-c3c(C)nn(C)c3C)C(=O)c2c1 |(-6.21,5.21,;-4.89,5.98,;-3.55,5.22,;-2.22,5.99,;-3.55,3.68,;-2.21,2.91,;-.87,3.69,;.45,2.92,;.45,1.39,;1.6,.37,;.97,-1.04,;1.74,-2.37,;1.14,-3.79,;2.05,-5.04,;1.14,-6.29,;-.32,-5.82,;-1.66,-6.59,;-2.99,-5.82,;-2.99,-4.28,;-4.33,-3.51,;-4.33,-1.97,;-1.66,-3.51,;-.32,-4.27,;3.59,-5.04,;4.49,-6.29,;4.01,-7.75,;5.95,-5.81,;5.95,-4.27,;7.2,-3.36,;4.49,-3.79,;4.01,-2.33,;-.56,-.88,;-1.59,-2.03,;-.87,.63,;-2.2,1.38,)|
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
O=C(Nc1ccc(cc1)C#N)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
COc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1OC
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
OCCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN(C)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN(C)CCOc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)cc1
CN1CCN(Cc2ccc(NC(=O)Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3C4CCC3COC4)cc2)CC1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1cccnc1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
Clc1cc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2C3CCC2COC3)ccn1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1ccc(nc1)-c1cccnc1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1cncnc1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)Nc1ccnnc1
O[C@H]1CC2COCC1N2c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1 |r,TLB:0:1:8:5.4.6|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C(C)C)c1=O
COc1ccc(cn1)-c1cc2c(OC)nc(N)nc2n(C(C)C)c1=O
Cc1c2c(nc(n1)N)N(C(=O)C(=N2)c3c[nH]nc3)C(C)C
CC(C)n1c2nc(N)nc(C)c2nc(-c2cc[nH]n2)c1=O
CC(C)n1c2nc(N)nc(C)c2nc(-c2c[nH]nn2)c1=O
COc1ncccc1-c1nc2c(C)nc(N)nc2n(C(C)C)c1=O
COc1ccc(cn1)-c1nc2c(C)nc(N)nc2n(C(C)C)c1=O
COc1ncc(cn1)-c1nc2c(C)nc(N)nc2n(C(C)C)c1=O
COc1cc(ccn1)-c1nc2c(C)nc(N)nc2n(C(C)C)c1=O
Cc1ccc(cn1)-c1nc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:18.19,wD:21.26,(6.04,1.56,;4.72,.78,;4.73,-.76,;3.4,-1.53,;2.06,-.77,;2.05,.76,;3.37,1.55,;.74,-1.54,;-.6,-.78,;-1.93,-1.56,;-3.26,-.79,;-3.27,.75,;-4.59,-1.56,;-4.59,-3.11,;-5.93,-3.88,;-3.26,-3.88,;-1.93,-3.1,;-.59,-3.87,;-.59,-5.41,;.75,-6.17,;.75,-7.72,;-.59,-8.49,;-1.92,-7.71,;-1.92,-6.18,;-.59,-10.03,;-1.93,-10.8,;-1.93,-12.34,;-3.26,-13.1,;.74,-3.09,;2.08,-3.86,)|
Cc1nc(N)nc2n(C3CCOCC3)c(=O)c(nc12)-c1cc[nH]n1
COc1ccc(cn1)-c1nc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:19.20,wD:22.24,(6.1,-15.1,;4.76,-14.34,;3.43,-15.12,;3.44,-16.66,;2.11,-17.44,;.77,-16.67,;.76,-15.14,;2.09,-14.36,;-.55,-17.45,;-1.88,-16.69,;-3.21,-17.46,;-4.55,-16.7,;-4.55,-15.16,;-5.87,-17.47,;-5.88,-19.01,;-7.21,-19.78,;-4.54,-19.78,;-3.21,-19,;-1.87,-19.77,;-1.87,-21.31,;-.53,-22.08,;-.54,-23.62,;-1.87,-24.39,;-1.87,-25.93,;-3.2,-23.62,;-3.2,-22.08,;-.54,-19,;.8,-19.76,)|
Cc1ccc(cn1)-c1nc2c(C)nc(N)nc2n(C2CCOCC2)c1=O
Cc1ccc(cn1)-c1nc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:21.23,wD:18.19,(6.09,-29.48,;4.76,-30.26,;4.77,-31.8,;3.44,-32.58,;2.1,-31.81,;2.09,-30.28,;3.42,-29.5,;.78,-32.59,;-.55,-31.83,;-1.88,-32.6,;-3.22,-31.84,;-3.22,-30.3,;-4.54,-32.61,;-4.55,-34.15,;-5.88,-34.92,;-3.21,-34.92,;-1.88,-34.14,;-.54,-34.91,;-.54,-36.45,;-1.87,-37.22,;-1.87,-38.76,;-.54,-39.53,;-.54,-41.07,;.79,-38.76,;.8,-37.22,;.79,-34.14,;2.13,-34.9,)|
OC(=O)N1CCN(CC1)c1ccc(Nc2ccnc3ccc(cc23)-c2cnc3ccccc3c2)cc1C(F)(F)F
COCCC(=O)N1CCN(CC1)c1ccc(Nc2ccnc3ccc(cc23)-c2cnc3ccccc3c2)cc1C(F)(F)F
CN(C)CCC(=O)N1CCN(CC1)c1ccc(Nc2ccnc3ccc(cc23)-c2cnc3ccccc3c2)cc1C(F)(F)F
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
COc1ccc(cc1)-c1ccc2ncc3ccc(=O)n(-c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2c1
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1csc2ccccc12
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cccc2Sc3ccccc3Sc12
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cncc2ccccc12
COc1ncc(c(OC)n1)-c1ccc2ncc3ccc(=O)n(-c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2c1
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc2ccccc2c1
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc2OCCOc2c1
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc2OCOc2c1
CS(=O)(=O)Nc1ccc(cc1)-c1ccc2ncc3ccc(=O)n(-c4ccc(N5CCNCC5)c(c4)C(F)(F)F)c3c2c1
FC(F)(F)c1cc(ccc1N1CCNCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccsc1
FC(F)(F)c1cc(ccc1N1CCOCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
O=c1ccc2cnc3ccc(cc3c2n1-c1ccc(cc1)S(=O)(=O)N1CCNCC1)-c1cnc2ccccc2c1
COc1cc(ccc1-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1)N1CCC(N)CC1 |(15.76,-21.17,;15.76,-22.71,;14.43,-23.49,;13.09,-22.72,;11.76,-23.49,;11.76,-25.03,;13.09,-25.81,;14.43,-25.04,;15.75,-25.83,;15.77,-27.35,;17.1,-28.11,;18.42,-27.34,;18.4,-25.81,;17.07,-25.05,;17.05,-23.51,;17.11,-29.65,;15.77,-30.43,;14.43,-29.66,;13.11,-30.42,;11.78,-29.66,;11.78,-28.12,;13.11,-27.35,;14.43,-28.12,;10.44,-27.35,;10.45,-25.8,;9.11,-25.03,;7.78,-25.81,;6.44,-25.04,;5.1,-25.81,;5.11,-27.37,;6.45,-28.13,;7.78,-27.36,;9.11,-28.12,;10.43,-22.72,;9.1,-23.48,;7.76,-22.72,;7.76,-21.17,;6.43,-20.41,;9.1,-20.39,;10.43,-21.17,)|
CN1CCN(Cc2ccc(cc2)-n2c3c(ccc2=O)cnc2ccc(cc32)-c2cnc3ccccc3c2)CC1
FC(F)(F)c1cc(ccc1N1CCN(CC1)C(=O)C1CC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CN(C)CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CN1CCN(CC(=O)N2CCN(CC2)c2ccc(cc2C(F)(F)F)-n2c3c(ccc2=O)cnc2ccc(cc32)-c2cnc3ccccc3c2)CC1
CN(C)CCn1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CCC(=O)N1CCC(=CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 |c:7|
FC(F)(F)c1cc(ccc1C1CCN(CC1)C(=O)CN1CCOCC1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)cc(C)c1=O
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)c(C)cc1=O
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c3cc(ccc3ncc2c(=O)n(C)c1=O)-c1cnc2ccccc2c1
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)N1C(=O)NCc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)N1C(=O)N(C)Cc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)N1C(=O)OCc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
CC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
c1cncc(c1)C#Cc1n[nH]c2ncccc12
c1cnc2[nH]nc(C#Cc3ccncc3)c2c1
N#Cc1ccc(cc1)C#Cc1n[nH]c2ccccc12
c1cc(cs1)C#Cc1n[nH]c2ccccc12
FC(F)(F)c1cc(cc(c1)C(F)(F)F)C#Cc1n[nH]c2ccccc12
Nc1ccccc1C#Cc1n[nH]c2ccccc12
C1CC1C#Cc1n[nH]c2ccccc12
C1CCC(C1)C#Cc1n[nH]c2ccccc12
Nc1cccc(c1)C#Cc1n[nH]c2ccccc12
c1ccc(nc1)C#Cc1n[nH]c2ccccc12
CN(C)CC#Cc1n[nH]c2ccccc12
c1ccc2c(n[nH]c2c1)C#Cc1ccncc1
c1ccc2c(n[nH]c2c1)C#Cc1cccnc1
Fc1cc(F)cc(c1)C#Cc1n[nH]c2ccccc12
c1ccc(cc1)C#Cc1n[nH]c2ccccc12
Nc1ccc(cc1)C#Cc1n[nH]c2ccccc12
COc1ccc(NC(=O)c2c(C)ccc3c(N)nc(C)nc23)cn1
COc1ccc(NC(=O)c2cc(C)cc3c(N)nc(C)nc23)cn1
Cc1nc(N)c2ccc(C)c(C(=O)Nc3ccn[nH]3)c2n1
Cc1cc(C(=O)Nc2ccn[nH]2)c2nc(C)nc(N)c2c1
Cc1nc(N)c2cc(CN3CCOCC3)cc(C(=O)Nc3ccn[nH]3)c2n1
CN(C)Cc1cc(C(=O)Nc2ccn[nH]2)c2nc(C)nc(N)c2c1
Cc1ccc(NC(=O)c2cccc3c(N)nc(C)nc23)cn1
Cc1ccc(NC(=O)c2c(C)ccc3c(N)nc(C)nc23)cn1
Cc1cc(C(=O)Nc2ccc(C)nc2)c2nc(C)nc(N)c2c1
CN(C)c1ccc(NC(=O)c2cccc3c(N)nc(C)nc23)cn1
CN(C)c1ccc(NC(=O)c2cc(C)cc3c(N)nc(C)nc23)cn1
Cc1nc(N)c2cccc(C(=O)Nc3cnc4[nH]ccc4c3)c2n1
Cc1nc(N)c2ccc(C)c(C(=O)Nc3cnc4[nH]ccc4c3)c2n1
Cc1cc(C(=O)Nc2cnc3[nH]ccc3c2)c2nc(C)nc(N)c2c1
Cc1nc(N)c2cccc(C(=O)Nc3cn[nH]c3)c2n1
Cc1cc(C(=O)Nc2cn[nH]c2)c2nc(C)nc(N)c2c1
COc1ccc(Nc2cc(nc(n2)N2CCOCC2)-c2cnc(N)nc2)cn1
CS(=O)(=O)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1
Cc1nc(N)nc(n1)-n1c(Nc2cccc(c2)C(N)=O)nc2ccccc12
CNC(=O)Nc1ccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)cc1
CC(=O)Nc1ccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)cc1
CC(=O)Nc1cccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)c1
Cc1nc(N)nc(n1)-n1c(Nc2ccc3cc[nH]c3c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccc3cn[nH]c3c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn(C)n2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn(n2)C(F)F)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccon2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2n[nH]c3ccccc23)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2cn[nH]c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccnn2C)nc2ccccc12
CNC(=O)c1ccc(Nc2nc3ccccc3n2-c2nc(C)nc(N)n2)o1
Cc1nc(N)nc(n1)-n1c(Nc2nnc[nH]2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(NC2CCOCC2)nc2ccccc12
CNc1nc(C)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(NCC#N)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(NCCC#N)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(NCC#C)nc(n1)-n1c(Nc2ccn[nH]2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccn[nH]2)nc2cc(F)c(F)cc12
Cc1nc(N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2ccccc2)nc2ccccc12
Cc1nc(N)nc(n1)-n1c(Nc2cc(O)cc(O)c2)nc2ccccc12
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(NCc3ccccn3)n2)c1
Nc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Oc1cccc(Nc2nc3ccccc3n2-c2ncncn2)c1
COc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Nc1cc(ncn1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nc(NCC#N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
CCc1nc(N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
CCCc1nc(N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nc(N)cc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1nccc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
COc1nc(NCC#N)nc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(NCC#N)n2)c1
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(NCC(F)(F)F)n2)c1
Oc1cccc(Nc2nc3ccccc3n2-c2ncnc(Nc3ccccc3)n2)c1
CNc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4cccc(c4)C(F)(F)F)c3c2c1
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(c4)C(F)(F)F)c3c2c1
Nc1ncc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(c4)C(F)(F)F)c3c2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
Fc1ccc(cc1Cl)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
Nc1ncc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(Cl)c4)c3c2c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(Cl)c4)c3c2c1
Fc1ccc(cc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc(N)nc1
Fc1ccc(cc1Cl)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
COc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(C)c4)c3c2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(nc1)C#N
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
Fc1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc2[nH]ncc2c1
Fc1ccc(c(c1)C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 |(-4.38,-16.19,;-3.05,-16.97,;-3.06,-18.52,;-1.74,-19.3,;-.4,-18.55,;-.38,-17,;-1.7,-16.22,;.96,-16.25,;.98,-14.71,;2.5,-16.24,;2.05,-15.15,;.92,-19.33,;.9,-20.86,;2.22,-21.65,;3.56,-20.9,;3.59,-19.37,;2.26,-18.58,;2.28,-17.04,;2.21,-23.2,;.85,-23.95,;-.47,-23.16,;-1.82,-23.9,;-3.14,-23.1,;-3.1,-21.56,;-1.76,-20.82,;-.44,-21.61,;-4.42,-20.77,;-4.38,-19.22,;-5.7,-18.42,;-7.05,-19.17,;-8.36,-18.37,;-9.72,-19.12,;-9.74,-20.67,;-8.42,-21.46,;-7.08,-20.71,;-5.76,-21.51,)|
Fc1ccc(c(c1)C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1 |(23.22,-16.91,;24.55,-17.69,;24.53,-19.24,;25.86,-20.02,;27.19,-19.26,;27.22,-17.72,;25.89,-16.93,;28.56,-16.97,;28.58,-15.43,;30.09,-16.96,;29.64,-15.86,;28.52,-20.05,;28.5,-21.58,;29.82,-22.37,;31.16,-21.62,;31.18,-20.09,;29.86,-19.3,;29.87,-17.76,;29.8,-23.92,;28.45,-24.67,;27.12,-23.88,;25.77,-24.62,;24.46,-23.82,;24.49,-22.28,;25.84,-21.54,;27.15,-22.33,;23.18,-21.48,;21.69,-21.89,;20.85,-20.6,;21.81,-19.41,;23.24,-19.95,)|
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(c4)C(F)(F)F)c3c2c1
Cc1cc(ccc1F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnn(C)c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(Cl)c4)c3c2c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)c(F)c4)c3c2c1
Cn1cc(cn1)-c1ccc2ncc3ccc(=O)n(-c4ccc(F)cc4C(F)(F)F)c3c2c1 |(7.5,-18.43,;7.9,-19.92,;9.34,-20.46,;9.27,-22,;7.78,-22.4,;6.94,-21.12,;10.59,-22.79,;10.55,-24.33,;11.87,-25.13,;13.22,-24.39,;14.54,-25.19,;15.9,-24.44,;15.92,-22.88,;17.26,-22.14,;17.28,-20.6,;15.95,-19.81,;15.97,-18.27,;14.62,-20.56,;13.29,-19.78,;11.95,-20.53,;10.63,-19.75,;10.64,-18.2,;9.32,-17.42,;11.99,-17.45,;13.31,-18.23,;14.66,-17.48,;14.68,-15.94,;16.19,-17.48,;15.74,-16.38,;14.6,-22.09,;13.25,-22.84,;11.93,-22.05,)|
Cc1nc(no1)-c1cnc2ccc(cn12)-c1cncc(NS(=O)(=O)c2ccccc2)c1
c1ccc2c(c1)Sc3cccc(c3S2)C4=CC(=O)C=C(O4)N5CCOCC5
Cn1cnc2c1C(=O)N(C(=O)N2C)C
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(SCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Oc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Nc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Cc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(CCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccccc2F)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccccc2C)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2cccc(C)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2ccc(C)cc2)n1
COc1ccccc1Sc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1cccc(Sc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)c1
COc1ccc(Sc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2cccc(C)c2)n1
COc1cccc(COc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccc(C)cc2)n1
COc1ccc(COc2nccc(n2)-c2ccc3nc(NC(C)=O)sc3c2)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCc2ccncc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCc2ccncc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCc2cccnc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(OCCCN2CCOCC2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NC(C)(C)c2ccccc2)n1
COc1ccc(cc1)C(=O)Nc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)N(C)c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
CCN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccc(OC)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccccc2F)n1
CN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccccc1F
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccc(C)cc2)n1
CN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccc(C)cc1
COc1ccc(cc1)S(=O)(=O)Nc1cc(ccn1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cncc(c1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cncc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C#N)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(c2)C(C)(C)C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(F)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
C[C@@H]1CC[C@H]2C[C@@H](/C(=C/C=C/C=C/[C@H](C[C@H](C(=O)[C@@H]([C@@H](/C(=C/[C@H](C(=O)C[C@H](OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@@]1(O2)O)[C@H](C)C[C@@H]4CC[C@H]([C@@H](C4)OC)OC(=O)C(C)(CO)CO)C)/C)O)OC)C)C)/C)OC
CC[C@@H]1\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H](CC1=O)[C@H](C)C[C@@H]1CC[C@@H](OC(=O)C(C)(CO)CO)[C@@H](C1)OC)OC |r,c:3,22,t:18,20|
CC[C@H]1C[C@@H](C)C(=O)[C@H](OC)[C@H](O)\C(C)=C\[C@@H](C)C(=O)C[C@H](OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H](CC[C@H]2C)C[C@H](OC)\C(C)=C\C=C\C=C\1)[C@H](C)C[C@@H]1CC[C@@H](OC(=O)C(C)(CO)CO)[C@@H](C1)OC |r,t:14,50,52,54|
CC[C@@H]1CC[C@H]2C[C@H](OC)\C(C)=C\C=C\C=C\[C@@H](C)C[C@@H](C)C(=O)[C@H](OC)[C@H](O)\C(C)=C\[C@@H](C)C(=O)C[C@H](OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@]1(O)O2)[C@H](C)C[C@@H]1CC[C@@H](OC(=O)C(C)(CO)CO)[C@@H](C1)OC |r,t:11,13,15,30|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CCOC)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CO)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CO)c(n1)N1CCOCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CO)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CO)c(n1)N1CCOCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CC(C)(C)O)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CC(C)(C)O)c(n1)N1CCOCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CC(C)(C)O)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CC(C)(C)O)c(n1)N1CCOCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2sc(cc2n1)C(C)(C)O
CCNC(=O)Nc1ccc(cc1)-c1nc2CCCOc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCOCc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2COCc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2c(COC2(C)C)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(C(=O)OC2(C)C)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(C(=O)OC2(C)C)c(n1)N1CCOCC1
C[C@H]1COCCN1c1nc(nc2c1COC2(C)C)-c1ccc(NC(=O)NCCO)cc1 |r|
C[C@H]1COCCN1c1nc(nc2c1COC2(C)C)-c1ccc(NC(=O)NCCC#N)cc1 |r|
C[C@H]1COCCN1c1nc(nc2c1COC2(C)C)-c1ccc(NC(=O)NC2COC2)cc1 |r|
C[C@H]1COCCN1c1nc(nc2c1COC2(C)C)-c1ccc(NC(=O)Nc2cnn(C)c2)cc1 |r|
C[C@H]1COCCN1c1nc(nc2c1COC2(C)C)-c1ccc(NC(=O)NC[C@@H](O)CO)cc1 |r|
C[C@H]1COCCN1c1nc(nc2c1COC2(C)C)-c1ccc(Nc2cccc(=O)[nH]2)cc1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CC2CC2)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CC2CC2)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CCO)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CCO)c(n1)N1CCOCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CCO)c(n1)N1C[C@@H]2CC[C@H](C1)O2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CCO)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CCO)c(n1)N1CCOCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CCO)c(n1)N1C[C@@H]2CC[C@H](C1)O2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CCC#N)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CCC#N)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CCN(C)C)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@]2(C)CCN(C)C)c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CO[C@@]2(C)CCOC)c(n1)N1CCOC[C@@H]1C |r|
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CNC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
FC(F)(F)c1cc(ccc1-c1ccc(COC2CCCCO2)cc1)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
OCc1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
OC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
COC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc(N)nc1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cn[nH]c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnn(C)c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2[nH]ccc2c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccccc21
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1ccc(N)nc1
CNC(=O)c1ccc2-c3sc(cc3CCOc2c1)C(=O)N(C)c1ccc(cc1Cl)C(=O)N(C)C
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN(C)CCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(O[C@H]3CCOC3)nc(n2)N2CCOCC2)cc1 |r|
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN2CCCCC2)cc1)N1CCOCC1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)CCN(C)C)cc1)N1CCOCC1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CNCCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(OC)nc(n2)N2CCOCC2)cc1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
COc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCNC(C)(C)C2)cc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(OC3COC3)nc(n2)N2CCOCC2)cc1
CC(C)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCN(C)CC2)cc1)N1CCOCC1
CC(C)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N(C)CCN(C)C)cc1)N1CCOCC1
CC(C)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)NCCN(C)C)cc1)N1CCOCC1
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(O[C@H]3CCOC3)nc(n2)N2CCOCC2)cc1 |r|
O=C(Nc1ccc(cc1)C(=O)NCCN1CCCCC1)Nc1ccc(cc1)-c1nc(O[C@H]2CCOC2)nc(n1)N1CCOCC1 |r|
O=C(Nc1ccc(cc1)C(=O)NCCN1CCCC1)Nc1ccc(cc1)-c1nc(O[C@H]2CCOC2)nc(n1)N1CCOCC1 |r|
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(O[C@H]3CCOC3)nc(n2)N2CCOCC2)cc1 |r|
CN1C2CCC1CC(C2)Oc1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(N)=O)cc1)N1CCOCC1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc([nH]c(=O)n2)N2CCOCC2)cc1
Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncsc2c1
CC(=O)Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2n1
CC(=O)Nc1cn2cc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1cn2cc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1
CC(=O)Nc1nc2ccc(cc2[nH]1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1nc2ccc(cc2[nH]1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nc[nH]c2c1
CC(=O)Nc1nc2ccc(cc2o1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1nc2ccc(cc2o1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncoc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nncn2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2sncc2c1
CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(NC(=O)CN3CCOCC3)c(OC)c2c1
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2ncn([C@H]3CCN(CC4CC4)C3)c(=O)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2ncn([C@H]3CCN(C3)C(=O)C3CC3)c(=O)c2c1 |r|
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3ccncc3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(NCCN3CCOCC3)nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCOCC3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(N3CCN(Cc4ccncc4)CC3)c2c1
CC(C)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(-c3cccnc3)c2c1
CN(\N=C\c1cnn2ccc(cc12)C#N)S(=O)(=O)c1cc(ccc1C)[N+]([O-])=O
Cc1ccc(cc1S(=O)(=O)N(CCO)\N=C\c1cnn2ccc(cc12)C#N)[N+]([O-])=O
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3COC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCO[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CNC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN(C=O)[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN([C@@H]3c3ccc(F)cc3)C(C)=O)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN([C@@H]3c3ccccc3)C(C)=O)n2)c2c(N)ncnc12 |r|
Clc1cccc(Nc2nc(nc(n2)-n2cccn2)N2CCOCC2)c1
Cc1nccn1-c1nc(nc(n1)-c1cccc(O)c1)N1CCOCC1
Cc1nccn1-c1nc(nc(n1)-c1cnc(N)nc1)N1CCOCC1
CCc1nccn1-c1nc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
CCc1cc(nn1-c1nc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1)C(F)(F)F
Cc1nccn1-c1nc(nc(n1)-c1ccc(C)c2[nH]ccc12)N1CCOCC1
COc1cccc(Cn2c3nc(cnc3[nH]c2=O)-c2ccc(O)cc2)c1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1nnc[nH]1
COc1ccccc1Cn1c2nc(cnc2[nH]c1=O)-c1ccc(O)cc1
COc1ccc(Cn2c3nc(cnc3[nH]c2=O)-c2ccc(O)cc2)cc1
Oc1ccc(cc1)-c1cnc2[nH]c(=O)n(Cc3cccc(O)c3)c2n1
Oc1ccc(cc1)-c1cnc2[nH]c(=O)n(Cc3ccccc3)c2n1
Oc1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
COCCn1c2nc(cnc2[nH]c1=O)-c1ccc(O)cc1
CC(C)Cn1c2nc(cnc2[nH]c1=O)-c1ccc(O)cc1
Oc1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCOCC3)c2n1
CN1CCC(Cn2c3nc(cnc3[nH]c2=O)-c2ccc(O)cc2)CC1
Oc1ccc(cc1)-c1cnc2[nH]c(=O)n(C3CCCCC3)c2n1
Oc1ccc(cc1)-c1cnc2[nH]c(=O)n(C3CCOCC3)c2n1
NC(=O)[C@H]1CC[C@H](CC1)n1c2nc(cnc2[nH]c1=O)-c1ccc(O)cc1 |r,wU:6.9,3.2,(20.63,-21.46,;19.09,-21.48,;18.3,-20.16,;18.33,-22.82,;19.12,-24.15,;18.37,-25.49,;16.84,-25.51,;16.04,-24.19,;16.79,-22.85,;16.09,-26.86,;14.63,-27.34,;13.29,-26.58,;11.97,-27.35,;11.97,-28.89,;13.3,-29.66,;14.63,-28.88,;16.1,-29.35,;17,-28.1,;18.54,-28.1,;10.64,-26.58,;9.3,-27.35,;7.97,-26.58,;7.97,-25.04,;6.64,-24.27,;9.3,-24.27,;10.63,-25.03,)|
NC(=O)[C@H]1CC[C@@H](CC1)n1c2nc(cnc2[nH]c1=O)-c1ccc(O)cc1 |r,wU:6.9,wD:3.2,(40.89,-22.62,;39.35,-22.64,;38.56,-21.32,;38.6,-23.98,;37.05,-24.01,;36.3,-25.35,;37.1,-26.67,;38.64,-26.65,;39.38,-25.31,;36.35,-28.01,;34.89,-28.5,;33.55,-27.73,;32.24,-28.51,;32.23,-30.05,;33.56,-30.82,;34.89,-30.04,;36.36,-30.51,;37.26,-29.26,;38.8,-29.25,;30.9,-27.74,;29.56,-28.51,;28.23,-27.74,;28.23,-26.2,;26.9,-25.43,;29.56,-25.42,;30.89,-26.19,)|
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccccc1
OCc1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
OC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
NCc1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
NC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
CNC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
COC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
CC(C)NC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
CC(C)(O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1nnc[nH]1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1ncc[nH]1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1ncc[nH]1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1c[nH]cn1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-n1ccnc1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-n1ccnn1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1cnco1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1cc[nH]n1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1cn[nH]c1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-n1cccn1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2[nH]ncc2c1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1cnc2nc[nH]c2c1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc2nc[nH]c2c1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2nc[nH]c2c1
Nc1nc2ccc(cc2[nH]1)-c1cnc2[nH]c(=O)n(CC3CCOCC3)c2n1
Nc1nc2ccc(cc2[nH]1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
CNc1nc2ccc(cc2[nH]1)-c1cnc2[nH]c(=O)n(CC3CCOCC3)c2n1
O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc2[nH]ccc2c1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2[nH]ccc2c1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc2cc[nH]c2c1
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O |c:14,33,t:29,31|
CC(C)n1c2nc(cnc2[nH]c1=O)-c1ccc(O)cc1
O=c1[nH]c2ncc(nc2n1CC1CCCCC1)-c1ccc(cc1)-c1nnn[nH]1
Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12
CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cccc3[nH]ncc23)CC1
CS(=O)(=O)N1CCN(Cc2nc3c(nc(cn3c2Br)-c2cccc3[nH]ncc23)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2cn3c(C#N)c(nc(N4CCOCC4)c3n2)-c2cccc3[nH]ncc23)CC1
CS(=O)(=O)N1CCN(Cc2cn3c(Cl)c(nc(N4CCOCC4)c3n2)-c2cccc3[nH]ncc23)CC1
CNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cccc2[nH]ncc12
O=C(NCCN1CCOCC1)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cccc2[nH]ncc12
CN(C)CCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cccc2[nH]ncc12
COCCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cccc2[nH]ncc12
C[C@H]1COCCN1c1cc(nn2ccnc12)-c1ccc(NC(=O)Nc2cccnc2)cc1 |r|
C[C@H]1COCCN1c1cc(nn2ccnc12)-c1ccc(NC(=O)Nc2ccncc2)cc1 |r|
Fc1cc(F)cc(c1)N1CCC[C@@H]1c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Cc1cc(cnc1N)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Cc1cc(N)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cnc(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1ccc(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)(F)c1cc(Br)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
FC(F)(F)c1cc(Cl)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CC(=O)Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Cc1nc(N)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CONc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Oc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Nc1ncc(cc1C(F)(F)F)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
CNC1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
OCCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
CCC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1)Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1
CC(=O)Nc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
CC(=O)Nc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
OCc1cccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)c1
OCCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
CC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
CCOC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
CS(=O)(=O)Nc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
ClCC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
NC(=N)NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cccnc2n1)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
CS(=O)(=O)Nc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
OCc1cccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)c1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cccnc2n1)Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
NC(=N)NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cccnc2n1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cccnc2n1)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
CNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3cccnc3n2)cc1
FC(F)n1cc(cn1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
Nc1ccc(cn1)-c1ccc2ncc3ncc(=O)n(C4CCN(CCO)CC4)c3c2c1
NC(=O)CN1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(N)nc2)ncc1=O
O=c1cnc2cnc3ccc(cc3c2n1C1CCN(CC#N)C1)-c1cnc2ccccc2c1
COc1ccc(cc1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
Nc1ccc(cn1)-c1ccc2ncc3ncc(=O)n(C4CCN(CC#N)CC4)c3c2c1
Fc1cc2ncc3ncc(=O)n(C4CCN(CC#N)CC4)c3c2cc1-c1cnc2ccccc2c1
Fc1cc2ncc3ncc(=O)n(C4CCN(CC#N)CC4)c3c2cc1-c1cn[nH]c1
Cn1cc(cn1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
Nc1ccc(cn1)-c1ccc2ncc3ncc(=O)n(C4CCN(CC#N)C4)c3c2c1
Cc1ccc(cn1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
COc1ccc(cn1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
Nc1ccc(cn1)-c1ccc2ncc3ncc(=O)n(C4CCN(CC4)C=O)c3c2c1
Fc1cc2ncc3ncc(=O)n(C4CCN(CC#N)CC4)c3c2cc1-c1cccnc1
Nc1ccc(cc1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
Nc1ccc(cn1)-c1ccc2ncc3ncc(=O)n([C@H]4CCCN(CC#N)C4)c3c2c1 |r|
Nc1ccc(cn1)-c1cc2c(cc1F)ncc1ncc(=O)n(C3CCN(CC#N)CC3)c21
COC(=O)CN1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(N)nc2)ncc1=O
O=c1cnc2cnc3ccc(cc3c2n1[C@H]1CCCN(CC#N)C1)-c1cnc2ccccc2c1 |r|
NC(=O)N1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(N)nc2)ncc1=O
O=c1cnc2cnc3ccc(cc3c2n1C1CCN(CC#N)CC1)-c1cnc2ccccc2c1
CNC(=O)c1nc(-c2nc(-c3cnc4ccccn34)c(C)nc2N)n(C)n1
COC1C[C@H](CC(C)[C@H]2OC(=O)C3CCCCN3C(=O)C(=O)[C@]3(O)CC([C@H](C[C@H]3C)OC)[C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]2C)OC)CC[C@H]1CC(=O)Nc1ccc(CCCC(=O)OC)cc1 |t:40|
COC1C[C@H](CC(C)[C@H]2OC(=O)C3CCCCN3C(=O)C(=O)[C@]3(O)CC([C@H](C[C@H]3C)OC)[C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]2C)OC)CC[C@H]1CC(=O)Nc1ccc(CCCC(O)=O)cc1 |t:40|
CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)[C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H]([C@H](C[C@H]2C)OC)[C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]1C)OC |r,t:45|
CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)N[C@H](CCc2ccccc2)C(=O)NCC(=O)N(C)CC(=O)O[C@H]1C
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2C[C@H](O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)[C@@H](O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)c2c[nH]c3c(C)cccc23)CC[C@H]1O |r,c:14,33,t:29,31|
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)c2cccc3c(C)c[nH]c23)CC[C@H]1O |r,c:14,33,t:29,31|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccsc1 |r|
CN1CCN(CC1)c1nc(N2CCOCC2)c2sc(CO)cc2n1
C1CN(CCO1)c1nc(N2CCOCC2)c2sccc2n1
C1CN(CCO1)c1nc(N2CCOCC2)c2cc[nH]c2n1
CC(O)c1cc2nc(nc(N3CCOCC3)c2s1)N1C[C@H](C)O[C@H](C)C1 |r|
OC(=O)c1cc2nc(nc(N3CCOCC3)c2s1)N1CCOCC1
CC(=O)c1cc2nc(nc(N3CCOCC3)c2s1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(CC1)c1nc(N2CCOCC2)c2sc(CO)cc2n1
OCc1cc2nc(nc(N3CCOCC3)c2s1)N1CCSCC1
OCc1cc2nc(nc(N3CCOCC3)c2s1)N1CCOc2ccccc12
C[C@@H]1COCCN1c1nc(N2CCOCC2)c2sc(CO)cc2n1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1cccc2[nH]ncc12 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccco1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccoc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccc[nH]1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccn[nH]1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(-c3ccn[nH]3)c(C)c2n1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1cn[nH]c1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1cnn(C)c1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)C(N)=O |r|
CCC(O)c1cc2nc(nc(N3CCOCC3)c2s1)N1C[C@H](C)O[C@H](C)C1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)C(O)Cc1ccccc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccccc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccccc1O |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccccn1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1cccnc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccncc1 |r|
COc1ccc(cn1)-c1cc2nc(nc(N3CCOCC3)c2s1)N1C[C@H](C)O[C@H](C)C1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccc(N)nc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1cncnc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(CO)cc2n1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccnn1C |r|
C1CN(CCO1)c1nc(N2CCOCC2)c2nc[nH]c2n1
OCc1cc2nc(nc(N3CCOCC3)c2s1)N1CCOCC1
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1cnc(N)nc1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)C1COC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1cc(N2CCOC[C@@H]2C)c2nc(C)n(CC)c2n1 |r|
CCCn1c(C)nc2c(cc(nc12)-c1ccc(NC(=O)NCC)cc1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1cc(N2CCOC[C@@H]2C)c2nc(C)n(CC(C)C)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1cc(N2CCOC[C@@H]2C)c2ncn(COCCOC)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1cc(N2CCOCC2)c2ncn(CC)c2n1
CCCn1cnc2c(cc(nc12)-c1ccc(NC(=O)NCC)cc1)N1CCOCC1
CCCn1cnc2c(cc(nc12)-c1ccc(NC(=O)NCC)cc1)N1CCOC[C@@H]1C |r|
CCCCn1cnc2c(cc(nc12)-c1ccc(NC(=O)NCC)cc1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1cc(N2CCOC[C@@H]2C)c2ncn(COCC)c2n1 |r|
CN(C)C(=O)c1cc(C2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1
CC(Nc1cc(F)cc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCN(C)C
CNCCNC(=O)c1cc(C(C)Nc2cccc(F)c2)c2nc(cnc2c1)N1CCOCC1
CN(C)C(=O)c1cc([C@H]2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1 |r|
CN(C)C(=O)c1cc([C@@H]2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1 |r|
C[C@H]1CN(C[C@@H](C)N1)C(=O)c1cc(C2CCCN2c2cc(F)cc(F)c2)c2nc(cnc2c1)N1CCOCC1 |r|
C[C@@H](Nc1cccc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCO |r|
C[C@H](Nc1cccc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCO |r|
C[C@@H](Nc1cc(F)cc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCN(C)C |r|
C[C@H](Nc1cc(F)cc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCN(C)C |r|
CN(C)CCNC(=O)c1cc(CNc2cccc(F)c2C)c2nc(cnc2c1)N1CCOCC1
O=C(Nc1cccs1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)Nc1cccnc1
O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1)Nc1ccnnc1
COC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
OC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN(C)CCNC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
CN1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
O=C(Nc1ccc(cc1)C(=O)N1CCC(CC1)N1CCCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(Nc1ccc(cc1)C(=O)N1CCC(CC1)N1CCCCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
O=C(NN1CCCCC1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CN(C)CCN(C)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
O=C(Nc1ccccc1)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Cc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(F)c1
OCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
OCCc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
COc1ccc(Cn2ncc(NC(=O)c3cc(NC(=O)Nc4ccc(Cl)c(c4)C(F)(F)F)ccc3C)c2N)cc1
Clc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1nnc[nH]1
Clc1ccc(-c2c(sc(N3CCOCC3)c2C#N)-c2nnc[nH]2)c(Cl)c1 |(13.97,-25.89,;13.2,-24.55,;13.97,-23.21,;13.2,-21.89,;11.67,-21.88,;10.91,-20.55,;11.39,-19.08,;10.14,-18.17,;8.88,-19.08,;7.54,-18.32,;7.53,-16.78,;6.2,-16.02,;4.87,-16.79,;4.88,-18.33,;6.21,-19.1,;9.36,-20.55,;8.46,-21.8,;7.56,-23.05,;12.84,-18.6,;14.09,-19.51,;15.33,-18.61,;14.86,-17.14,;13.32,-17.14,;10.89,-23.21,;9.36,-23.21,;11.66,-24.55,)|
Fc1cc(ccc1-c1c(sc(N2CCOCC2)c1C#N)-c1nnc[nH]1)C#N |(23.39,-23.59,;24.93,-23.6,;25.69,-24.93,;27.23,-24.94,;28,-23.6,;27.24,-22.27,;25.7,-22.27,;24.94,-20.94,;25.42,-19.47,;24.17,-18.56,;22.91,-19.47,;21.57,-18.7,;21.56,-17.16,;20.23,-16.4,;18.89,-17.18,;18.9,-18.72,;20.24,-19.48,;23.39,-20.94,;22.49,-22.19,;21.58,-23.43,;26.88,-18.99,;28.12,-19.89,;29.37,-18.99,;28.89,-17.52,;27.35,-17.52,;28,-26.27,;28.77,-27.6,)|
CC1CN(CCO1)c1cc(=O)n2nc(C)n(Cc3cccc(c3C)C(F)(F)F)c2n1
Cc1cn2c(nc(cc2=O)N2CCOCC2)n1Cc1cccc(c1C)C(F)(F)F
CS(=O)(=O)Cc1cc(nc(NC(=O)c2ccno2)n1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc(NS(C)(=O)=O)cc1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2[nH]ccc2c1)N1CC2CCC(C1)O2
C[C@@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc2[nH]ccc2c1 |r|
C[C@H]1COCCN1c1cc(CS(C)(=O)=O)nc(n1)-c1ccc2[nH]ccc2c1 |r|
CS(=O)(=O)Cc1cc(nc(n1)-c1cnc2[nH]ccc2c1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccc2nc[nH]c2c1)N1CCOCC1
COCc1cccc(c1)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc(CO)c1)N1CCOCC1
Cn1ccc2cc(ccc12)-c1nc(CS(C)(=O)=O)cc(n1)N1CCOCC1
O=S(=O)(CCc1cnccn1)Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1
CC(C)S(=O)(=O)Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)Cc1cc(nc(n1)-c1ccccn1)N1CCOCC1
CS(=O)(=O)Cc1cc(nc(n1)-c1ccccc1)N1CCOCC1
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3cc(c(nc3)OC)F)N4CCCC4
Cc1nc(N)nc2n(N3CCCC3)c(=O)c(cc12)-c1cn[nH]c1
CC(C)CNn1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O
CCN(CC)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O
CC(C)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O
Cc1nc(N)nc2n(C3CC3)c(=O)c(cc12)-c1cn[nH]c1
Cc1nc(N)nc2n(C3CCC3)c(=O)c(cc12)-c1cn[nH]c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n(C2CCCC2)c1=O
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3c[nH]nc3)C4CCCC4
COCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
Nc1ncc(cn1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(=O)NC1CCOCC1
Nc1ncc(cn1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(=O)NCCN1CCOCC1
Nc1ncc(cn1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:28.32,wD:25.28,(-9.8,-30.99,;-8.46,-30.22,;-8.46,-28.68,;-7.13,-27.91,;-5.8,-28.69,;-5.8,-30.22,;-7.12,-31,;-4.47,-27.92,;-3.13,-28.69,;-1.8,-27.92,;-.33,-28.39,;.57,-27.14,;-.33,-25.9,;-1.8,-26.38,;-3.13,-25.61,;-4.47,-26.32,;-3.13,-24.07,;-4.46,-23.31,;-4.46,-21.77,;-3.13,-20.99,;-1.8,-21.77,;-1.8,-23.31,;2.11,-27.14,;2.88,-25.8,;2.89,-28.47,;2.12,-29.81,;.58,-29.81,;-.19,-31.13,;.58,-32.47,;-.2,-33.8,;2.12,-32.47,;2.89,-31.13,)|
COCCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
CN(C)CCCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
CN(C)CCNC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
NC(=O)c1cn2cc(nc(N3CCOCC3)c2n1)-c1cnc(N)nc1
Fc1ccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1-c1ccccc1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2ccncc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2cccnc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2ccccn2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2cccs2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3cccc(-c4ccccc4)c3o2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3c(cccc3o2)-c2ccccc2)[nH]1)N1CCOCC1
Brc1cccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc12
Cc1cccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc12
Cc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc2c1
Cc1ccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1
Cc1cccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc12
Fc1cccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc12
Fc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)oc2c1
Fc1ccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1
Fc1cccc2oc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc12
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2ccc(cc12)-c1ccccc1
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cc(ccc12)-c1ccccc1
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cccc(-c3ccccc3)c12
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2c(cccc12)-c1ccccc1
O=c1cc(nc(Cc2nc3c(cccc3[nH]2)-c2ccccc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3n2Cc2ccccc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3n2-c2ccccc2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3n2C2CCCCC2)[nH]1)N1CCOCC1
COCCn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cc(F)ccc12
Fc1ccc2n(C3CC3)c(Cc3nc(cc(=O)[nH]3)N3CCOCC3)nc2c1
CCn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2ccccc12
FC(F)(F)c1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
COc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Cc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Brc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2ccc(F)cc12
Cn1c(Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc2cc(F)ccc12
Cn1c(Cc2nc3ccc(F)cc3[nH]2)nc(cc1=O)N1CCOCC1
Fc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
Cn1c2ccccc2nc1CC3=NC(=CC(=O)N3)N4CCOCC4
O=c1cc(nc(Cc2nc3ccccc3o2)[nH]1)N1CCOCC1
O=c1cc(nc(Cc2nc3ccccc3[nH]2)[nH]1)N1CCOCC1
c1ccc(cc1)NC(=O)CC2=NC(=CC(=O)N2)N3CCOCC3
Cn1c(Cc2nc3ccccc3o2)nc(cc1=O)N1CCOCC1
Clc1ccc2nc(Cc3nc(cc(=O)[nH]3)N3CCOCC3)[nH]c2c1
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1C[C@@H]2CC[C@H](C1)O2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCCS(=O)(=O)c2c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)c2c(n1)N1CCOC[C@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1C[C@@H]2CC[C@H](C1)O2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1C[C@@H]2C[C@H]1CO2 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1CCOC[C@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CS(=O)(=O)Cc2c(n1)N1CCOC[C@@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOC[C@H]1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCS(=O)(=O)Cc2c(n1)N1CCOC[C@@H]1C |r|
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccc(cc1)-n1cccn1 |r|
Cc1cc(NC(=O)CCNC(=O)Nc2nc(C)c(s2)-c2ccc(cc2)-n2cccn2)no1
Cc1c(sc(n1)NC(=O)NCCC(=O)NC(C)(C)C)c2ccc(cc2)C(=O)C
CCn1nnc(CCNC(=O)Nc2nc(C)c(s2)-c2ccc(c(F)c2)S(C)(=O)=O)n1
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
c1cc(cc(c1)C(=O)N2CCCCC2)c3ccnc(n3)Nc4ccc(cc4)S(=O)(=O)N
C1CN(CCO1)c1cc(ccn1)-c1ccnc(Nc2ccccc2)n1
N#Cc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
Cc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
NS(=O)(=O)c1ccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)cc1
Clc1ccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)cc1
Clc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
CCN(CC)S(=O)(=O)c1cc(Nc2nccc(n2)-c2ccnc(c2)-c2ccc(NC(=O)NC)cc2)ccc1C
CCN(CC)S(=O)(=O)c1cc(ccc1Cl)Nc2nccc(n2)c3ccnc(c3)c4ccc(cc4)NC(=O)NC
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(C)c(c2)S(=O)(=O)N(C)C)n1
CCN(CC)S(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)-c2ccc(NC(=O)NC)cc2)c1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(C)c(c2)S(=O)(=O)NC)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2cccc(c2)S(N)(=O)=O)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2cccc(c2)S(=O)(=O)NC)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(Cl)c(c2)S(=O)(=O)N(C)C)n1
CNC(=O)Nc1ccc(cc1)-c1cc(ccn1)-c1ccnc(Nc2ccc(Cl)c(c2)S(=O)(=O)NC)n1
COc1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
CN1CCN(CC1)c1cc(ccn1)-c1ccnc(Nc2cccc(c2)S(N)(=O)=O)n1
NS(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)N2C3CCC2COC3)c1
FC(F)(F)c1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
OCCCNc1cc(ccn1)-c1ccnc(Nc2cccc(Cl)c2)n1
NS(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCOCC2)c1
NS(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(NCCCO)c2)c1
NS(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CC3CCC(C2)O3)c1
NS(=O)(=O)c1cccc(Nc2nccc(n2)-c2ccnc(c2)N2CCCCC2)c1
CCN(CC)c1cc(ccn1)-c1ccnc(Nc2cccc(c2)S(N)(=O)=O)n1
COc1ccc(Nc2ncc(CN3CCS(=O)(=O)CC3)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
COc1ccc(Nc2ncc(CN3CCN(CC3)C(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cn1
COC(=O)N1CCN(Cc2cnc(Nc3ccc(OC)nc3)c(c2)-c2nc(C)nc(N)n2)CC1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)N2CCN(C)CC2)cn1
COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)N2CCOCC2)cn1
COCc1cnc(Nc2ccc(OC)nc2)c(c1)-c1nc(C)nc(N)n1
COc1ccc(Nc2cccnc2-c2nc(C)nc(N)n2)cn1
Cc1cc(nc(N)n1)-c1cccnc1Nc1cccc(O)c1
COc1ccc(cn1)N(C)c1ncccc1-c1nc(C)nc(N)n1
Cc1cc(nc(N)n1)-c1cccnc1Oc1cccc2[nH]ccc12
Cc1ncnc(n1)-n1c(Nc2cccc(O)c2)nc2ccccc12
Cc1cc(on1)-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cnn(c1)C1CC1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cncn1C
CC(=O)Nc1cccc(c1)-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cncnc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cncnc1
Cc1cc(ccn1)-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
COc1ncccc1-c1ccc2nc(Nc3ccn[nH]3)c(-c3nc(C)nc(N)n3)n2c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cnccc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1ccccc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cccnc1C
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cccnc1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1ccncc1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1cccc(F)c1
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccc(cn12)-c1ccccc1F
Cc1nc(N)nc(n1)-c1c(Nc2ccn[nH]2)nc2ccccn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2ccc(cn12)-c1cnco1
CC(C)n1cc(cn1)-c1ccc2nc(Nc3ccn(C)n3)c(-c3cc(NC(C)=O)nc(C)n3)n2c1
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2ccc(cn12)-c1cccnc1C
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2ccccn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn[nH]2)nc2ccccn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn(C)n2)nc2cccnn12
COc1cnnc(Nc2cc(nc(C)n2)-c2c(Nc3ccn[nH]3)nc3cccnn23)c1
Cc1nc(Nc2cnn(c2)C2CCOC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2ccc(nn2)N2CCOCC2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2cccnn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2cccnc2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(Nc2cnccn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
CC(=O)Nc1cc(nc(C)n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nccc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
CNc1cc(nc(C)n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(N)cc(n1)-c1c(Nc2ccn[nH]2)nc2ccccn12
Cc1nc(N)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12
Cc1nc(N)nc(n1)-c1c(Nc2ccn(C)n2)nc2ccc(cn12)-c1cncnc1
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F |r|
COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F |r|
Cc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(Cl)nc1
Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1ccc(=O)[nH]c1
CC1(C)COC1c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
CC1(C)OCCc2c1sc1c(nc(nc21)-c1cnc(N)nc1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1nnc(C)o1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1nc(C)ns1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1cccnn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1cnccn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1CC)c1ncccn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1ncccn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)c1ncccn1
CCOC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)c1ccccc1
CCNC(=O)Oc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)c1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)c1ccccc1
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)OC
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)S(C)(=O)=O
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)C(=O)OC(C)(C)C
CCNC(=O)Nc1ccc(cc1)-c1nc2CNCCc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOC[C@@H]1C)c1cnccn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOCC1)c1cnccn1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOC[C@@H]1C)c1ncccn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOCC1)c1ncccn1
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOC[C@@H]1C)C(C)=O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOC[C@@H]1C)S(C)(=O)=O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOC[C@@H]1C)C(=O)OC(C)(C)C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOCC1)C(=O)OC(C)(C)C
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(Cc2c(n1)N1CCOCC1)C(=O)OC(C)(C)C
CCNC(=O)Nc1ccc(cc1)-c1nc2CNCc2c(n1)N1CCOCC1
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(Cc2c(n1)N1CCOCC1)S(C)(=O)=O
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(Cc2c(n1)N1CCOCC1)C(=O)NCC
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(Cc2c(n1)N1CCOCC1)c1ncccn1
CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
CCC(=O)N1CC[C@@H](C1)Nc2c3c(ncn2)CCN(C3)c4cc(c(nc4)OC)C(F)(F)F
CC(C)(C)OC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncn(CCC3OCCO3)c2n1
COc1ccc(cc1)C(=O)NNC(=O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2ccnc(n2)N2CCOCC2)cc1-c1cccnc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1-c1ccccc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1-c1cccnc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1-c1ccccn1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1-c1ccncc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1-c1cccnc1
Clc1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1-c1ccncc1
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C2)OC)[C@H](C)C[C@@H]1CC[C@@H](OCCO)[C@@H](C1)OC |r,c:32,51,t:47,49|
Cn1ncc2c(Oc3ccc(cc3)S(C)(=O)=O)cc(nc12)-c1cccc2[nH]ncc12
Cc1c(CN2CCN(CC2)C(=O)CN)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
C[C@H](N)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)-c2cnc(N)nc2)N2CCOCC2)CC1 |r|
Cc1c(CN2CCN(CC2)C(=O)C(C)(C)N)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)C(C)(C)O)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2C(F)(F)F)CC1
CS(=O)(=O)N1CCN(Cc2nc3c(nc(cn3c2Br)-c2cnc(N)nc2)N2CCOCC2)CC1
Cc1c(CN2CCN(CC2)S(C)(=O)=O)nc2c(nc(cn12)-c1cnc(N)nc1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2cn3c(Cl)c(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)OCCCc1cccnc1 |r|
CS(=O)(=O)C1(CCOCC1)c1cc(nc(n1)-c1cccc2[nH]ccc12)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccc2OCCOc2c1)N1CCOCC1
O=c1cc(oc2c(csc12)-c1ccccc1)N1CCOCC1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(C4CCN(C)CC4)c3c2n1
COc1ccc(cn1)-c1ccc2ncc3n(C)c(=O)n(-c4ccc(cc4)C(C)(C)C#N)c3c2n1
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)S(C)(=O)=O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)C1CCCC1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)C(C)C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1nccn1C |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1cc(C)ncn1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1ccnc(C)n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOC[C@@H]1C)c1ncc(F)cn1 |r|
C[C@H]1COCCN1c1nc(nc2CN(CCc12)c1ncccn1)-c1ccc(Nc2nccc(=O)[nH]2)cc1 |r|
O=c1cccc(Nc2ccc(cc2)-c2nc3CN(CCc3c(n2)N2CCOCC2)c2ncccn2)[nH]1
CCNc1c(Nc2ccc(cc2)-c2nc3CN(CCc3c(n2)N2CCOC[C@@H]2C)c2ncccn2)c(=O)c1=O |r|
C[C@H]1COCCN1c1nc(nc2CN(CCc12)c1ncccn1)-c1ccc(Nc2nn(C)c(=O)[nH]2)cc1 |r|
C1CN(CCO1)c1nc(nc2CN(CCc12)c1ncccn1)-c1ccc(Nc2ncccn2)cc1
FCCNC(=O)Nc1ccc(cc1)-c1nc2CN(CCc2c(n1)N1CCOCC1)c1ncccn1
OP(O)(=O)O[C@H]1[C@@H](OCc2ccccc2)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@H]1OP(O)(O)=O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@H]3CC[C@@H](Cc2c(n1)N1CCOC[C@@H]1C)N3C(C)(C)C(=O)NC |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@H]3CC[C@@H](Cc2c(n1)N1CCOC[C@@H]1C)N3C(=O)COC |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@H]3CC[C@@H](Cc2c(n1)N1CCOC[C@@H]1C)N3C(C)=O |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@H]3CC[C@@H](Cc2c(n1)N1CCOC[C@@H]1C)N3S(C)(=O)=O |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@H]3CC[C@@H](Cc2c(n1)N1CCOC[C@@H]1C)N3C1COC1 |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@@H]3CC[C@H](Cc2c(n1)N1CCOC[C@@H]1C)N3C |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2[C@H]3CC[C@@H](Cc2c(n1)N1CCOC[C@@H]1C)N3C |r,THB:31:30:19.14.20:17.16|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@@H]3CC[C@@H](N3C(C)=O)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.24.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@@H]3CC[C@@H](N3S(C)(=O)=O)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.25.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@H]3CC[C@H](N3C3COC3)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.25.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@@H]3CC[C@@H](N3C3COC3)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.25.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@@H]3CC[C@@H](N3CC)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.23.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@H]3CC[C@H](N3C)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.22.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2C[C@@H]3CC[C@@H](N3C)c2c(n1)N1CCOC[C@@H]1C |r,THB:21:20:14.22.15:18.17|
CCNC(=O)Nc1ccc(cc1)-c1nc2CCN(Cc2c(n1)N1CCOC[C@@H]1C)C1COC1 |r|
CC(C)(O)c1ccc(cn1)-c1cnc2[nH]c(=O)n(CC3CCOCC3)c2n1
O=c1[nH]c2ncc(nc2n1CCC1CCOCC1)-c1ccc(cc1)-c1nnc[nH]1
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:11.14,wD:8.7,(66.59,-45.15,;66.6,-46.69,;65.27,-47.46,;65.26,-49,;63.93,-49.77,;66.6,-49.77,;67.93,-49.01,;69.27,-49.78,;69.26,-51.32,;67.92,-52.08,;67.91,-53.62,;69.24,-54.4,;70.58,-53.63,;70.59,-52.09,;69.23,-55.94,;67.89,-56.7,;66.56,-55.92,;65.22,-56.68,;66.57,-54.38,;70.62,-49.01,;71.95,-49.78,;70.62,-47.46,;69.27,-46.67,;67.93,-47.45,;71.96,-46.7,;73.29,-47.47,;74.62,-46.71,;74.62,-45.17,;75.95,-44.41,;75.96,-42.86,;74.62,-42.09,;73.29,-42.86,;73.29,-44.39,;71.96,-45.16,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:22.27,wD:19.20,(40.72,-44.52,;39.39,-43.75,;38.06,-44.52,;38.05,-46.06,;36.72,-46.82,;35.39,-46.05,;35.39,-44.51,;36.72,-43.74,;34.05,-46.8,;32.7,-46.02,;31.36,-46.8,;30.03,-46.04,;30.02,-44.5,;28.7,-46.81,;28.7,-48.35,;27.36,-49.12,;30.03,-49.12,;31.36,-48.35,;32.7,-49.13,;32.69,-50.67,;31.35,-51.43,;31.34,-52.96,;32.67,-53.74,;34.01,-52.98,;34.02,-51.44,;32.66,-55.28,;31.32,-56.04,;29.99,-55.26,;28.66,-56.03,;30,-53.73,;34.05,-48.36,;35.38,-49.13,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:23.28,wD:20.21,(27.28,-44.28,;25.95,-43.51,;24.61,-44.28,;24.61,-45.82,;23.27,-46.58,;21.94,-45.81,;21.94,-44.27,;23.27,-43.5,;23.27,-41.96,;20.6,-46.56,;19.26,-45.78,;17.92,-46.56,;16.58,-45.8,;16.58,-44.26,;15.25,-46.57,;15.25,-48.11,;13.92,-48.88,;16.58,-48.88,;17.91,-48.12,;19.25,-48.89,;19.24,-50.43,;17.9,-51.19,;17.9,-52.72,;19.22,-53.51,;20.56,-52.74,;20.57,-51.2,;19.21,-55.04,;17.88,-55.81,;16.55,-55.03,;15.21,-55.79,;16.56,-53.49,;20.6,-48.12,;21.93,-48.89,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:22.27,wD:19.20,(13.86,-44.58,;12.52,-43.81,;11.19,-44.58,;9.85,-43.81,;8.52,-44.58,;8.52,-46.11,;9.85,-46.88,;11.18,-46.12,;7.18,-46.87,;5.83,-46.08,;4.49,-46.86,;3.16,-46.1,;3.16,-44.56,;1.83,-46.87,;1.83,-48.41,;.5,-49.18,;3.16,-49.18,;4.49,-48.42,;5.83,-49.19,;5.82,-50.73,;4.48,-51.49,;4.48,-53.02,;5.8,-53.81,;7.14,-53.04,;7.15,-51.5,;5.79,-55.34,;4.45,-56.11,;3.13,-55.33,;1.79,-56.09,;3.14,-53.79,;7.18,-48.42,;8.51,-49.19,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wD:8.7,11.14,(67.89,-30.91,;67.89,-32.45,;66.56,-33.22,;66.56,-34.76,;65.23,-35.53,;67.9,-35.53,;69.23,-34.77,;70.56,-35.54,;70.56,-37.08,;71.89,-37.85,;71.88,-39.39,;70.54,-40.16,;69.21,-39.38,;69.22,-37.84,;70.53,-41.7,;69.19,-42.46,;67.86,-41.68,;66.52,-42.44,;67.87,-40.14,;71.91,-34.77,;73.24,-35.54,;71.91,-33.21,;70.57,-32.43,;69.23,-33.21,;73.25,-32.46,;74.59,-33.23,;75.92,-32.47,;75.92,-30.93,;77.25,-30.16,;77.25,-28.62,;75.91,-27.85,;74.59,-28.62,;74.58,-30.15,;73.25,-30.92,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnn(C)c1 |r,wD:8.7,11.14,(54.57,-30.85,;54.57,-32.39,;53.24,-33.16,;53.24,-34.71,;51.91,-35.48,;54.58,-35.48,;55.9,-34.71,;57.24,-35.49,;57.24,-37.03,;58.57,-37.79,;58.56,-39.34,;57.22,-40.1,;55.89,-39.32,;55.9,-37.79,;57.21,-41.64,;55.87,-42.4,;54.54,-41.63,;53.2,-42.39,;54.55,-40.09,;58.59,-34.72,;59.92,-35.49,;58.59,-33.16,;57.25,-32.38,;55.91,-33.16,;59.93,-32.4,;61.32,-33.04,;62.36,-31.91,;61.61,-30.57,;62.24,-29.17,;60.1,-30.88,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wD:8.7,11.14,(43.18,-30.37,;43.19,-31.91,;41.86,-32.68,;41.85,-34.23,;40.52,-34.99,;43.19,-35,;44.52,-34.23,;45.86,-35.01,;45.85,-36.54,;47.18,-37.31,;47.17,-38.86,;45.83,-39.62,;44.5,-38.84,;44.51,-37.31,;45.82,-41.16,;44.48,-41.92,;43.15,-41.14,;41.81,-41.9,;43.16,-39.6,;47.21,-34.23,;48.54,-35.01,;47.21,-32.68,;45.86,-31.89,;44.52,-32.67,;48.55,-31.92,;49.94,-32.56,;50.98,-31.43,;50.22,-30.09,;48.71,-30.4,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:19.20,22.27,(40.28,-30.68,;38.94,-29.91,;37.61,-30.68,;37.6,-32.22,;36.27,-32.99,;34.94,-32.21,;34.94,-30.68,;36.27,-29.91,;33.6,-32.97,;32.25,-32.19,;30.91,-32.97,;29.58,-32.2,;29.57,-30.66,;28.25,-32.97,;28.25,-34.52,;26.91,-35.28,;29.58,-35.29,;30.91,-34.52,;32.25,-35.3,;32.24,-36.83,;33.57,-37.6,;33.56,-39.15,;32.22,-39.91,;30.89,-39.13,;30.9,-37.6,;32.21,-41.45,;30.87,-42.21,;29.55,-41.43,;28.21,-42.19,;29.56,-39.89,;33.6,-34.52,;34.93,-35.3,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:20.21,23.28,(27.43,-30.66,;26.1,-29.89,;24.76,-30.66,;24.76,-32.2,;23.42,-32.96,;22.09,-32.19,;22.09,-30.65,;23.42,-29.88,;23.42,-28.34,;20.75,-32.94,;19.4,-32.16,;18.06,-32.94,;16.73,-32.18,;16.73,-30.64,;15.4,-32.95,;15.4,-34.49,;14.07,-35.26,;16.73,-35.26,;18.06,-34.49,;19.4,-35.27,;19.39,-36.81,;20.72,-37.58,;20.71,-39.12,;19.37,-39.88,;18.05,-39.1,;18.05,-37.57,;19.36,-41.42,;18.02,-42.18,;16.7,-41.41,;15.36,-42.17,;16.71,-39.87,;20.75,-34.5,;22.08,-35.27,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:19.20,22.27,(14.55,-30.27,;13.22,-29.49,;11.88,-30.26,;10.54,-29.49,;9.21,-30.26,;9.21,-31.79,;10.54,-32.57,;11.88,-31.8,;7.87,-32.55,;6.53,-31.77,;5.19,-32.55,;3.85,-31.78,;3.85,-30.24,;2.52,-32.55,;2.52,-34.1,;1.19,-34.87,;3.86,-34.87,;5.19,-34.1,;6.52,-34.88,;6.51,-36.41,;7.85,-37.18,;7.83,-38.73,;6.5,-39.49,;5.17,-38.71,;5.18,-37.18,;6.49,-41.03,;5.15,-41.79,;3.82,-41.01,;2.48,-41.77,;3.83,-39.47,;7.87,-34.1,;9.2,-34.88,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:11.14,wD:8.7,(65.77,-15.8,;65.77,-17.34,;64.44,-18.11,;64.44,-19.65,;63.11,-20.42,;65.77,-20.42,;67.1,-19.65,;68.44,-20.43,;68.43,-21.96,;67.09,-22.73,;67.09,-24.26,;68.41,-25.04,;69.75,-24.28,;69.76,-22.73,;68.4,-26.58,;67.07,-27.34,;65.74,-26.56,;69.79,-19.66,;71.12,-20.43,;69.79,-18.1,;68.45,-17.32,;67.11,-18.1,;71.13,-17.34,;72.46,-18.12,;73.8,-17.36,;73.79,-15.82,;75.12,-15.05,;75.13,-13.51,;73.79,-12.74,;72.46,-13.51,;72.46,-15.04,;71.13,-15.81,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:11.14,wD:8.7,(54.37,-15.83,;54.38,-17.37,;53.05,-18.15,;53.05,-19.69,;51.71,-20.46,;54.38,-20.46,;55.71,-19.69,;57.05,-20.47,;57.04,-22.01,;55.7,-22.77,;55.69,-24.3,;57.02,-25.08,;58.36,-24.32,;58.37,-22.78,;57.01,-26.62,;55.67,-27.39,;54.34,-26.61,;58.4,-19.7,;59.73,-20.47,;58.4,-18.14,;57.05,-17.36,;55.71,-18.14,;59.74,-17.38,;61.13,-18.03,;62.17,-16.89,;61.41,-15.55,;62.05,-14.15,;59.9,-15.86,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:11.14,wD:8.7,(43.23,-15.53,;43.23,-17.07,;41.9,-17.84,;41.9,-19.39,;40.57,-20.15,;43.23,-20.16,;44.56,-19.39,;45.9,-20.17,;45.89,-21.7,;44.56,-22.47,;44.55,-24,;45.88,-24.78,;47.21,-24.02,;47.23,-22.47,;45.87,-26.32,;44.53,-27.08,;43.2,-26.3,;47.25,-19.39,;48.58,-20.17,;47.25,-17.84,;45.91,-17.05,;44.57,-17.83,;48.59,-17.08,;49.98,-17.72,;51.02,-16.59,;50.26,-15.25,;48.76,-15.56,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCO)c1=O |r,wU:22.27,wD:19.20,(39.75,-16,;38.42,-15.23,;37.08,-15.99,;37.08,-17.53,;35.75,-18.3,;34.41,-17.52,;34.42,-15.99,;35.74,-15.22,;33.08,-18.28,;31.73,-17.5,;30.39,-18.28,;29.05,-17.51,;29.05,-15.97,;27.73,-18.28,;27.72,-19.83,;26.39,-20.6,;29.06,-20.6,;30.39,-19.83,;31.72,-20.61,;31.72,-22.14,;30.38,-22.91,;30.37,-24.44,;31.7,-25.22,;33.04,-24.46,;33.05,-22.91,;31.69,-26.76,;30.35,-27.52,;29.02,-26.74,;33.07,-19.84,;34.4,-20.61,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCO)c1=O |r,wU:23.28,wD:20.21,(26.25,-15.63,;24.91,-14.86,;23.58,-15.63,;23.58,-17.17,;22.24,-17.93,;20.91,-17.16,;20.91,-15.63,;22.24,-14.86,;22.24,-13.32,;19.57,-17.92,;18.23,-17.13,;16.89,-17.91,;15.55,-17.15,;15.55,-15.61,;14.22,-17.92,;14.22,-19.46,;12.89,-20.23,;15.55,-20.23,;16.88,-19.47,;18.22,-20.24,;18.21,-21.78,;16.88,-22.54,;16.87,-24.07,;18.19,-24.86,;19.53,-24.09,;19.54,-22.55,;18.18,-26.39,;16.85,-27.16,;15.52,-26.38,;19.57,-19.47,;20.9,-20.24,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wD:8.7,11.14,(3.1,-15.67,;3.11,-17.2,;1.78,-17.98,;1.78,-19.52,;.44,-20.29,;3.11,-20.29,;4.44,-19.52,;5.78,-20.3,;5.77,-21.84,;7.1,-22.6,;7.09,-24.15,;5.75,-24.91,;4.42,-24.13,;4.43,-22.6,;5.74,-26.45,;4.4,-27.21,;3.07,-26.43,;7.12,-19.53,;8.46,-20.3,;7.13,-17.97,;5.78,-17.19,;4.44,-17.97,;8.47,-17.21,;9.8,-17.99,;11.13,-17.23,;11.13,-15.69,;12.46,-14.92,;12.47,-13.38,;11.12,-12.61,;9.8,-13.38,;9.8,-14.91,;8.47,-15.68,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wD:8.7,11.14,(66.3,-1.69,;66.31,-3.23,;64.98,-4,;64.98,-5.54,;63.64,-6.31,;66.31,-6.31,;67.64,-5.55,;68.98,-6.32,;68.97,-7.86,;70.3,-8.63,;70.29,-10.17,;68.95,-10.94,;67.62,-10.16,;67.63,-8.62,;68.94,-12.48,;67.6,-13.24,;66.27,-12.46,;70.33,-5.55,;71.66,-6.32,;70.33,-3.99,;68.98,-3.21,;67.64,-3.99,;71.67,-3.24,;73.06,-3.88,;74.1,-2.74,;73.34,-1.4,;73.98,-0,;71.83,-1.71,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wD:8.7,11.14,(55.51,-1.14,;55.51,-2.68,;54.18,-3.45,;54.18,-5,;52.85,-5.77,;55.52,-5.77,;56.85,-5,;58.18,-5.78,;58.18,-7.31,;59.51,-8.08,;59.5,-9.63,;58.16,-10.39,;56.83,-9.61,;56.84,-8.08,;58.15,-11.93,;56.81,-12.69,;55.48,-11.91,;59.53,-5.01,;60.86,-5.78,;59.53,-3.45,;58.19,-2.67,;56.85,-3.45,;60.87,-2.69,;62.26,-3.33,;63.3,-2.2,;62.55,-.86,;61.04,-1.17,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:19.20,22.27,(52.42,-2.69,;51.08,-1.92,;49.75,-2.69,;49.75,-4.23,;48.41,-4.99,;47.08,-4.21,;47.08,-2.68,;48.41,-1.91,;45.74,-4.97,;44.39,-4.19,;43.06,-4.97,;41.72,-4.21,;41.72,-2.67,;40.39,-4.98,;40.39,-6.52,;39.06,-7.29,;41.72,-7.29,;43.05,-6.52,;44.39,-7.3,;44.38,-8.84,;45.71,-9.6,;45.7,-11.15,;44.36,-11.91,;43.04,-11.13,;43.04,-9.6,;44.35,-13.45,;43.01,-14.21,;41.69,-13.43,;45.74,-6.53,;47.07,-7.3,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:19.20,22.27,(23.9,-1.62,;22.57,-.85,;21.24,-1.62,;19.89,-.85,;18.57,-1.62,;18.56,-3.15,;19.9,-3.93,;21.23,-3.16,;17.23,-3.91,;15.88,-3.12,;14.54,-3.9,;13.21,-3.14,;13.2,-1.6,;11.88,-3.91,;11.87,-5.45,;10.54,-6.22,;13.21,-6.22,;14.54,-5.46,;15.88,-6.23,;15.87,-7.77,;17.2,-8.54,;17.19,-10.08,;15.85,-10.85,;14.52,-10.07,;14.53,-8.53,;15.84,-12.39,;14.5,-13.15,;13.17,-12.37,;17.22,-5.46,;18.56,-6.24,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(O)=O)c1=O |r,wU:22.27,wD:19.20,(12.89,-1.02,;11.56,-.25,;10.23,-1.01,;8.89,-.24,;7.56,-1.01,;7.56,-2.54,;8.89,-3.32,;10.22,-2.55,;6.22,-3.3,;4.87,-2.52,;3.53,-3.3,;2.2,-2.53,;2.19,-.99,;.87,-3.3,;.87,-4.85,;-.48,-5.62,;2.2,-5.62,;3.53,-4.85,;4.87,-5.63,;4.86,-7.16,;3.52,-7.93,;3.51,-9.46,;4.84,-10.24,;6.18,-9.48,;6.19,-7.93,;4.83,-11.78,;3.49,-12.54,;2.16,-11.76,;2.16,-10.22,;.82,-12.52,;6.22,-4.86,;7.55,-5.63,)|
CC(C)n1ncnc1-c1nc-2c(CCOc3cc(ccc-23)-c2cnn(CCO)c2)s1
CC(C)n1nc(C)nc1-c1cn2CCOc3cc(ccc3-c2n1)-c1cnn(c1)C(C)(C)C(N)=O
Cc1c(sc(n1)NC(=O)N2CCC[C@H]2C(=O)N)c3ccnc(c3)C(C)(C)C(F)(F)F
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2ncn(C)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2nc(n(C)c2n1)C(C)(C)O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2nc(n(CCO)c2n1)C(C)(C)O |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2C[C@@H]3C[C@H]2CO3)c2n(C)ncc2n1 |r,THB:14:15:20.21:18|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)nc(C)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)ncc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)ncc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)ccc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)ccc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCCOCC2)c2n(C)cnc2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2CC)c2n(C)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@H]2C)c2n(C)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2n(C)cnc2n1
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(CC)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2ncn(CC)c2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)cnc2n1 |r|
CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOC[C@@H]2C)c2n(C)c(nc2n1)C(C)(C)O |r|
CC(C)(O)c1nc2c(nc(nc2n1CCO)-c1cnc(N)nc1)N1CCOCC1
CCN1CCN(CC(=O)Nc2ccc(-c3cccc4c3oc(cc4=O)N3CCOCC3)c3sc4ccccc4c23)CC1
Cc1nnc(o1)-c1cccc(c1)-c1cnn2ccc(NCCN)nc12
CS(=O)(=O)Cc1cc(nc(n1)N1CCOCC1)-c1cnc(N)cc1C(F)(F)F
C[C@H]1COCCN1c1nc(cc(n1)C1(CC1)S(C)(=O)=O)-c1cnc(N)cc1C(F)(F)F |r|
C[C@H]1COCCN1c1nc(cc(n1)C1(CC1)S(C)(=O)=O)-c1cnc(N)cc1F |r|
CS(=O)(=O)C1(CC1)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)cc1C(F)(F)F
C[C@H]1Cc2ccccc2N1C(=O)CC3=NC(=CC(=O)N3)N4CCOCC4
COc1ccc(CCNC(=O)c2sc3nc(cc(-c4ccccc4)c3c2N)-c2ccccc2)cc1OC
C(CNc1ncnc2n(Cc3ccco3)c(c(-c3ccccc3)c12)-c1ccccc1)Cn1ccnc1
CNS(=O)(=O)c1cc(ccc1C)-c1nnc(Nc2ccc(OCC(N)=O)cc2)c2ccccc12
N=C1N2N=C(SC2=NC(=O)\C1=C\c1ccc2OCOc2c1)c1cccnc1 |c:3,7|
Cn1ncc2c(Nc3ccc(NC(=O)c4ccco4)cc3)ncnc12
Cc1c(CC(O)=O)c(=O)oc2cc3occ(-c4ccc5ccccc5c4)c3cc12
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nc(N)nc(C)c2c1
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n1[C@H]1CC[C@@H](CC1)OCCO |r,wU:22.28,wD:19.21,(34.08,-10.67,;33.31,-9.34,;31.77,-9.34,;31,-10.68,;29.46,-10.68,;28.69,-9.34,;29.46,-8.01,;30.99,-8.01,;27.16,-9.35,;26.24,-8.09,;24.77,-8.57,;23.44,-7.81,;23.43,-6.27,;22.11,-8.58,;22.11,-10.12,;20.77,-10.89,;23.44,-10.89,;24.77,-10.12,;26.25,-10.6,;27.01,-11.93,;26.24,-13.26,;27,-14.59,;28.54,-14.61,;29.32,-13.27,;28.55,-11.93,;29.3,-15.94,;28.52,-17.27,;26.98,-17.26,;26.2,-18.59,)|
COc1ccc(cn1)-c1cn([C@H]2CC[C@@H](CC2)OCCO)c2nc(N)nc(C)c12 |r,wU:14.18,wD:11.11,(14.58,-4.93,;13.04,-4.99,;12.32,-6.35,;13.14,-7.66,;12.42,-9.02,;10.88,-9.07,;10.06,-7.77,;10.78,-6.41,;10.15,-10.43,;11.07,-11.68,;10.16,-12.93,;10.92,-14.27,;10.15,-15.6,;10.91,-16.93,;12.45,-16.94,;13.23,-15.61,;12.46,-14.27,;13.21,-18.28,;12.43,-19.61,;10.89,-19.6,;10.11,-20.93,;8.68,-12.45,;7.35,-13.23,;6.01,-12.46,;4.68,-13.22,;6.02,-10.91,;7.35,-10.14,;7.34,-8.6,;8.68,-10.9,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C(C)C)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C2CCOCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:34.37,wD:31.33,(17.7,-35.44,;16.37,-34.67,;15.04,-35.44,;13.76,-34.69,;12.37,-35.44,;12.37,-36.94,;13.76,-37.79,;15.03,-36.93,;16.39,-37.65,;16.44,-39.19,;14.9,-39.18,;15.66,-40.51,;17.8,-39.91,;19.09,-39.1,;20.45,-39.81,;20.51,-41.36,;21.87,-42.08,;19.2,-42.17,;17.85,-41.45,;16.54,-42.26,;11.09,-37.79,;9.7,-36.94,;8.42,-37.79,;7.03,-36.94,;7.03,-35.44,;5.75,-37.79,;5.75,-39.28,;4.36,-40.03,;7.03,-40.03,;8.42,-39.28,;9.7,-40.03,;9.7,-41.63,;8.31,-42.43,;8.3,-44.03,;9.69,-44.84,;9.69,-46.38,;11.09,-44.04,;11.09,-42.43,;11.09,-39.28,;12.37,-40.03,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)s1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1cccc(F)c1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1OC)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)C1CC1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(C)(=O)=O)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:34.40,wD:31.33,(42.88,-5.02,;41.55,-4.24,;40.21,-5.01,;38.93,-4.26,;37.54,-5.01,;37.54,-6.51,;38.93,-7.37,;40.21,-6.5,;41.57,-7.23,;41.62,-8.77,;40.08,-8.76,;40.84,-10.09,;42.98,-9.49,;44.28,-8.68,;45.63,-9.39,;45.69,-10.94,;47.05,-11.66,;44.38,-11.75,;43.02,-11.03,;41.72,-11.84,;36.26,-7.37,;34.87,-6.51,;33.59,-7.37,;32.19,-6.51,;32.19,-5.01,;30.91,-7.37,;30.91,-8.86,;29.52,-9.61,;32.19,-9.61,;33.59,-8.86,;34.87,-9.61,;34.84,-11.14,;33.49,-11.88,;33.46,-13.42,;34.78,-14.22,;36.13,-13.47,;36.16,-11.93,;34.74,-15.76,;33.39,-16.5,;32.08,-15.7,;30.73,-16.44,;36.26,-8.86,;37.54,-9.61,)|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]ncc2c1
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]cnc2c1
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2n(C)ccc2c1
Cc1nc(N)cc2n(C3CCCC3)c(=O)c(cc12)-c1cnc2[nH]ccc2c1
COc1ncc(cc1F)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ncc(cn1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)cc2n(C2CCCC2)c1=O
COc1ccc(cn1)-c1cc2c(C)nc(N)cc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:22.27,wD:19.20,(19.19,-4.99,;17.85,-4.23,;16.53,-5,;16.53,-6.64,;15.1,-7.41,;13.79,-6.64,;13.79,-5,;15.1,-4.23,;12.36,-7.41,;11.03,-6.64,;9.6,-7.41,;8.29,-6.64,;8.29,-5,;6.86,-7.41,;6.86,-8.95,;5.54,-9.72,;8.29,-9.72,;9.6,-8.95,;11.03,-9.72,;11.03,-11.38,;9.6,-12.15,;9.6,-13.68,;11.03,-14.56,;12.36,-13.68,;12.36,-12.15,;11.03,-16.1,;9.6,-16.87,;8.29,-16.1,;6.97,-16.87,;12.36,-8.95,;13.79,-9.72,)|
C[C@H](Nc1c(nnc2ccc(cc12)-c1ccc(OCCCN(C)C)nc1)C(N)=O)C1CCOCC1 |r|
CNC(=O)c1nnc2ccc(cc2c1N[C@@H](C)C1CCOCC1)-c1ccc(OCCCN(C)C)nc1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(O[C@@H]2CCOC2)c2nc(N)nc(C)c2c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
CNc1nc(C)c2cc(cc(OC3CCOCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CNc1nc(C)c2cc(cc(O[C@@H]3CCOC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1 |r|
CS(=O)(=O)N1CCN(Cc2cc3c(nc(cn3n2)-c2cnc(N)nc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2nc3c(nc(cn3n2)-c2cnc(N)nc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2cn3nc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
CS(=O)(=O)N1CCN(Cc2cc3c(nc(c(Cl)n3n2)-c2cnc(N)nc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2nc3c(nc(-c4cnc(N)nc4)c(Cl)n3n2)N2CCOCC2)CC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(cc1)N1CCN(C)CC1
CCN1CCN(CC1)c1ccc(cn1)-c1nn(CC2CCCC2)c2nc(NC)ncc12
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCN(CC1)C(=O)C(C)(C)C
CCN1CCN(CC1)c1ccc(cn1)-c1nn(Cc2cn(Cc3ccccc3)nn2)c2nc(NC)ncc12
CNc1ncc2c(nn(Cc3cn(nn3)-c3ccsc3C(=O)OC)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(CC3OCCO3)c2n1)-c1ccc(OC)cc1
CNc1ncc2c(nn(CC3OCCO3)c2n1)-c1ccc(nc1)N1CCNCC1
Nc1nc(Nc2ccc3CC[C@@H](CCc3c2)N2CCCC2)nn1-c1cc2CCCc3ccccc3-c2nn1 |r|
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(cc1)N1CCNCC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(CC1)C(=O)C(C)(C)C
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(N)nc2s1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc2c(C)nc(NC(C)=O)nc2s1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C#N)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(C)(C)C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(CN)nc2n1)N1CCOCC1
COC(Cc1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(OC)c(CO)c1)OC |r|
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)C(C)(C)C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(CO)CO)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(CS(C)(=O)=O)nc2n1)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(CC#N)nc2n1)N1CCOCC1
COc1ccc(cc1CO)-c1ccc2c(nc(C)nc2n1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(C)C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C1=CCOCC1)N1CCOC[C@@H]1C |r,t:23|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C1CCOCC1)N1CCOC[C@@H]1C |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)C(N)=O)N1CCOCC1
C=CC(=O)Nc1ccc(cc1)-n1c2c(ccc1=O)oc1ccc(cc21)-c1cccnc1
COc1ncc(cc1NS(=O)(=O)c1cc(F)ccc1F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(Cl)c(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(=O)n2c1
Fc1ccc(c(F)c1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(Cl)cc1)-c1ccc2nccc(=O)n2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1OC)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1cccc(F)c1)-c1ccc2nccc(=O)n2c1
Fc1ccccc1S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C#N)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(C)c(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1cc(F)cc(F)c1)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)-c1ccc2nccc(=O)n2c1
COc1ncc(cc1NS(=O)(=O)c1ccccc1C)-c1ccc2nccc(=O)n2c1
C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(CC1)[S@](C)(=N)=O |r|
C[C@@H]1COCCN1c1cc(nc(n1)-c1cncc2[nH]ccc12)C1(CC1)S(C)(=O)=O |r|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)[S@](C)(=N)=O)N1CCOC[C@H]1C |r|
CNc1nc2ccccc2n1-c1nc(cc(n1)C1(CC1)S(C)(=O)=O)N1CCOC[C@H]1C |r|
CO\C=C\C(=O)c1cc2C=Nc3c(N)cc(NC(=O)C(C)C)c(n1)c23 |c:9|
CCOC(=O)C1=C(CSc2nc3cc(ccc3[nH]2)[N+]([O-])=O)N(C)C(=O)NC1c1ccccc1 |c:5|
CCOC(=O)C1=C(CSC(=S)N(C2CCCCC2)C2CCCCC2)N(C)C(=O)NC1c1ccccc1 |c:5|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2
CC1(C)CN(CCO1)c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC(C)(C)C1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
Nc1cc(C(F)F)c(cn1)-c1nc(cc(n1)N1C2CCC1COC2)N1C2CCC1COC2
CCC(CC)n1cnc2c(nc(nc12)N1CC2CCC(C1)O2)-c1cnc(N)cn1
COC(OC)c1cc(N)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
[H][C@]12CN(c3nc(nc(n3)-c3cnc(N)cc3C(F)F)N3C[C@]4([H])C[C@@]3([H])CO4)[C@]([H])(CO1)C2 |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC11CCC1)N1CCOCC11CCC1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(CF)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
COc1cc(N)ncc1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CC1COC2)N1C2CC1COC2
CC[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1CC |r|
C[C@@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@H](C)COC[C@H]1C |r|
C[C@H]1COC[C@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@@H]1C |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1C[C@H](C)O[C@H](C)C1 |r|
Nc1cc(C(F)F)c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(c(cn1)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2)C(F)(F)F
Nc1cc(C(F)F)c(cn1)-c1cc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCCC1COC2)N1C2CCCC1COC2 |THB:14:16:22.23.24:18.19.20|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@H]1C |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2COCC1COC2)N1C2COCC1COC2 |THB:14:16:22.23.24:18.19.20|
Nc1cc(C(F)F)c(cn1)-c1nc(cc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(c(cn1)-c1nc(cc(n1)N1C2CCC1COC2)N1C2CCC1COC2)C(F)(F)F
Nc1cc(CO)c(cn1)-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CCOCC1
[H][C@@]12CN(c3nc(nc(n3)-c3cnc(N)cc3C(F)F)N3C[C@@]4([H])C[C@]3([H])CO4)[C@@]([H])(CO1)C2 |r|
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
Oc1ccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)cc1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ncccc2n1
O=C(Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1)Nc1cccnc1
CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2ncccc2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2cccnc2n1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2cccnc2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncccc2n1
Oc1cccc(NC(=O)Nc2ccc(cc2)-c2nc(N3CCOCC3)c3ncccc3n2)c1
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2ncccc2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2cccnc2n1
Oc1cccc(c1)-c1nc(nc2cccnc12)N1CCOCC1
Oc1cccc(c1)-c1nc(N2CCOCC2)c2ncccc2n1
CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(cc1)C(C)(C)C#N)-c1cnc2ccccc2c1
CCC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2ccc(N)nc2)C(N)=O)cc1C(F)(F)F
NC(=O)c1cnc2ccc(cc2c1Nc1cccc(c1)C(F)(F)F)-c1ccc(N)nc1
CC(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F
COc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(Nc3ccc(N4CCNCC4)c(c3)C(F)(F)F)c2c1
CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(N2CCNCC2)c(c1)C(F)(F)F)-c1cnc2ccccc2c1
NC(=O)c1cnc2ccc(cc2c1Nc1ccc(N2CCNCC2)c(c1)C(F)(F)F)-c1cnc2ccccc2c1
COc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(Nc3ccc(cc3)C(C)(C)C#N)c2c1
CS(=O)(=O)N1CCN(CC1)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1C(F)(F)F
FC(F)(F)c1cc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(=O)NC2CC2)ccc1N1CCNCC1
CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(cc1)C(C)(C)C#N)-c1ccc(N)nc1
Cn1nccc1-c1ccc2ncc(C(N)=O)c(Nc3ccc(cc3)C(C)(C)C#N)c2c1
Cn1nccc1-c1ccc2ncc(C(N)=O)c(Nc3ccc(N4CCN(CC4)S(C)(=O)=O)c(c3)C(F)(F)F)c2c1
CC(C)(C#N)c1ccc(Nc2c(cnc3ccc(cc23)-c2cnc3ccccc3c2)C(N)=O)cc1
CC(C)(C#N)c1ccc(Nc2c(cnc3ccc(cc23)-c2ccc(N)nc2)C(N)=O)cc1
NC(=O)c1cnc2ccc(cc2c1Nc1cccc(c1)C(F)(F)F)-c1cnc2ccccc2c1
CN1CCN(CC(=O)N2CCN(CC2)c2ccc(Nc3c(cnc4ccc(cc34)-c3cnc4ccccc4c3)C(N)=O)cc2C(F)(F)F)CC1
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
CN(C)C(=O)c1cc(CN2CCOc3c(F)cccc23)c2oc(cc(=O)c2c1)N1CCOCC1
C[C@@H]1COCCN1C2=CC(=O)N3CC[C@H](N(C3=N2)CC(=O)C(C)C)C(F)(F)F
COc1ncc(cc1F)-c1cc(OCCCCCCC(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1cc(OCCN(C)c2ncc(cn2)C(=O)NO)c2ncnc(C)c2c1
COc1ccc(cn1)-c1nc(N2CCOCC2)c2sc(CN(C)c3ncc(cn3)C(=O)NO)cc2n1
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cn3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOCC3)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3-c3ccc(N)nc3)N3CCOCC3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@@H]3C)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3N3CC4CCC(C3)O4)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3N3C4CCC3COC4)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3C4CCC3COC4)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOCC3(C)C)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3C)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)c(C)c3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3C(OC)OC)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3C(OC)OC)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3-c3ccc(N)nc3)N3CCOCC3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3N3CCOCC3)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3N3CCOC[C@@H]3C)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CC4CCC(C3)O4)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@@]12Cc3c(nc(nc3N3CCOCC3(C)C)-c3ccc(N)nc3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3OC)N1CCOC2 |r|
Cc1ccc(cn1)-c1ccc2ncc3oc(=O)n(-c4cccc(c4)C(F)(F)F)c3c2c1
CCC(=O)Nc1ccc(cn1)-c1ccc2ncc3ccc(=O)n(-c4cccc(c4)C(F)(F)F)c3c2c1
CC(=O)\C=C\c1cnc2ccc(cc2c1Nc1cccc(c1)C(F)(F)F)-c1ccc(N)cc1
COc1c(ccc2c1N=C(N3C2=NCC3)NC(=O)c4cnc(nc4)N)OCCCN5CCOCC5
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3nnc(CCN4CCN(C)CC4)o3)n2c1
Nc1cc(c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CC2CCC(C1)O2)C(F)(F)F
C[C@H]1COC[C@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOC[C@@H]1C |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)N1C2CCC1COC2)C(F)(F)F
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)N1C2CCC1COC2)C(F)(F)F
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
C[C@@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(cc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1C(F)F |r|
C[C@@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1[C@H](C)COC[C@H]1C |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CC2CCC(C1)O2)N1CCOCC1)C(F)(F)F
C[C@H]1COCCN1c1nc(cc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1 |r|
C[C@H]1COC[C@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1[C@@H](C)COC[C@@H]1C |r|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)(F)F)N1[C@@H](C)COC[C@H]1C |r|
C[C@H]1COCCN1c1cc(nc(n1)N1CCOCC1)-c1cnc(N)cc1C(F)F |r|
Brc1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
CC(C)(C)c1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Clc1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
FC(F)(F)c1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
[O-][N+](=O)c1ccccc1S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
Fc1ccc(cc1)S(=O)(=O)N1CCN(Cn2cc3c(n2)c2ccccc2oc3=O)CC1
CNC(=O)Nc1ccc(cc1)-c1ncc2NC(=O)C3COCCN3c2n1
O=C(NC1CC1)Nc1ccc(cc1)-c1nc2c(COC22CC2)c(n1)N1CCOCC1
CNC(=O)Nc1ccc(cc1)-c1ncc2N(CC3CC3)C(=O)[C@]3(C)COCCN3c2n1 |r|
C[C@@]12COCCN1c1nc(ncc1N(CC1CC1)C2=O)-c1ccc(NC(=O)NC2CC2)cc1 |r|
CC(F)(F)CN1C(=O)[C@]2(C)COCCN2c2nc(ncc12)-c1ccc(NC(=O)NC2CC2)cc1 |r|
CNC(=O)Nc1ccc(cc1)-c1ncc2NC(=O)CC3COCCN3c2n1
CNC(=O)Nc1ccc(cc1)-c1ncc2N(CC3CC3)C(=O)C3COCCN3c2n1
CNC(=O)Nc1ccc(cc1)-c1nc(C)c2nc3COCCn3c2n1
CNC(=O)Nc1ccc(cc1)-c1ncc2OCC3COCCN3c2n1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(c3ccc(F)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(C(C)C)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2OCC(=O)N(C3CC3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2OCC(=O)N(c3ccccc3)c2c1
Cc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2OCC(=O)Nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2OCC(=O)Nc2c1
Oc1ccc(cc1)-c1ccc2OCC(=O)Nc2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(c3ccccc3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2OCC(=O)N(c3ccccc3)c2c1
Oc1ccc(cc1)-c1ccc2OCC(=O)N(c3ccccc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(c3ccc(Cl)cc3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2OCC(=O)N(c3ccc(Cl)cc3)c2c1
Oc1ccc(cc1)-c1ccc2OCC(=O)N(c3ccc(Cl)cc3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(c3ccc(C)cc3)c2c1
Cc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc2ccccc2c1
Cc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1ccc(O)cc1
COc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc2ccccc2c1
Oc1ccc(cc1)-c1ccc2OCC(=O)N(c3ccc(F)cc3)c2c1
COc1cccc(c1)N1C(=O)COc2ccc(cc12)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1cccc(c1)N1C(=O)COc2ccc(cc12)-c1cnc2ccccc2c1
COc1cccc(c1)N1C(=O)COc2ccc(cc12)-c1ccc(O)cc1
CC(C)N1C(=O)COc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(C3CCCCC3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2OCC(=O)N(C3CCCCC3)c2c1
O=C1COc2ccc(cc2N1C1CCCCC1)-c1cnc2ccccc2c1
Oc1ccc(cc1)-c1ccc2OCC(=O)N(C3CCCCC3)c2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2OCC(=O)N(C3CC3)c2c1
Oc1ccc(cc1)-c1ccc2OCC(=O)N(C3CC3)c2c1
COc1cccc(c1)N1C(=O)COc2ccc(cc12)-c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
CC(C)N1C(=O)COc2ccc(cc12)-c1cnc2ccccc2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)N(C3CC3)c2c1
O=C1COc2ccc(cc2N1)-c1cnc2ccccc2c1
O=C1COc2ccc(cc2N1c1ccccc1)-c1cnc2ccccc2c1
Clc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc2ccccc2c1
Cc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1cccc(c1)N1C(=O)COc2ccc(cc12)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
CC(C)N1C(=O)COc2ccc(cc12)-c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2OCC(=O)N(C3CCCCC3)c2c1
O=C1COc2ccc(cc2N1C1CC1)-c1cnc2ccccc2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2OCC(=O)N(c3ccc(Cl)cc3)c2c1
COc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1ccc(O)cc1
CC(C)N1C(=O)COc2ccc(cc12)-c1ccc(O)cc1
COc1ccc(cc1)N1C(=O)COc2ccc(cc12)-c1cnc2ccccc2c1
CCn1c2nc(N)nc(C)c2cc(-c2cc[nH]n2)c1=O
CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1
CC(C)c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cn[nH]n1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1c[nH]cn1 |r|
C[C@@H]1COCCN1c1ncnc2sc(nc12)-c1cc[nH]n1 |r|
C[C@@H]1COCCN1c1nc(nc2sc(nc12)-c1cc[nH]n1)N1CCOCC1 |r|
C[C@@H]1COCCN1c1nc(nc2sc(nc12)-c1cc[nH]n1)N1CCN(C)CC1 |r|
C[C@@H]1COCCN1c1nc(nc2sc(nc12)-c1cc[nH]n1)C1CCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cccc(O)c1 |r|
C[C@@H]1COCCN1c1nc(nc2sc(nc12)-c1cc[nH]n1)N1CCCOCC1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cn[nH]c1 |r|
C[C@@H]1COCCN1c1nc(CN2CCOCC2)nc2sc(nc12)-c1cc[nH]n1 |r|
COc1ccc(Cn2c3cnc4ccc(cc4c3n(C)c2=O)-c2cnc3ccccc3c2)cc1
COc1ccc(Cn2c3cnc4ccc(cc4c3n(C)c2=O)-c2cnc(OC)c(NS(C)(=O)=O)c2)cc1
COc1ccc(Cn2c3c(cnc4ccc(cc34)-c3cnc(OC)c(NS(C)(=O)=O)c3)n(C)c2=O)cc1
CC[C@@H](C1=Nc2cccc(c2C(=O)N1c3ccccc3)F)Nc4c5c(nc[nH]5)ncn4
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(nc(N)nc12)C(F)(F)F
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(F)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(CO)nc(N)nc12
CCc1nc(N)nc2n(nc(-c3ccc4oc(N)nc4c3)c12)C(C)C
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(C)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc[nH]c2=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc(C)[nH]c2=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc(N)[nH]c2=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(Br)nc(N)nc12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c1nc([nH]c2=O)N(C)C
COc1nc(N)nc2n(nc(-c3ccc4oc(N)nc4c3)c12)C(C)C
CCCCn1nc(-c2ccc3oc(N)nc3c2)c2c(Cl)nc(N)nc12
CCCCn1nc(-c2ccc3oc(N)nc3c2)c2c(C)nc(N)nc12
CNc1nc2n(nc(-c3ccc4oc(N)nc4c3)c2c(=O)[nH]1)C(C)C
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(nc(N)nc12)C#N
CN1CCN(CC1)C(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CCCCCCC(=O)NO)c2n1
Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CCCCCCC(=O)NO)c2n1
CCN1CCN(CC1)C(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CCCCCCC(=O)NO)c2n1
C[C@@H]1CN(CCO1)C(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(CCCCCCC(=O)NO)c2n1 |r|
C=CC(=O)Nc1cccc(c1)-n1c2c(ccc1=O)oc1ccc(cc21)-c1cccnc1
c1ccc2ncc(cc2c1)-c1ccc2ncncc2c1
c1ccc(cc1)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
COc1ccc(cc1OC)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
CN1CCN(CC1)C(=O)c1cccc(c1)-c1ncnc2ccc(cc12)-c1cnc2ccccc2c1
CCNC(=O)Nc1ccc(cc1)-c1nc2c(CS(=O)(=O)C2(C)C)c(n1)N1CCOC[C@@H]1C |r|
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\C(C2)N1CCS1(=O)=O)[C@H](C)C[C@@H]1CC[C@@H](O)[C@@H](C1)OC |r,c:31,50,t:46,48|
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\C(C2)N1CCN(CCO)C1=O)[C@H](C)C[C@@H]1CC[C@@H](O)[C@@H](C1)OC |r,c:31,50,t:46,48|
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\C(C2)N1CCCS1(=O)=O)[C@H](C)C[C@@H]1CC[C@@H](OP(C)(C)=O)[C@@H](C1)OC |r,c:31,50,t:46,48|
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@@H](C2)N1CCCS1(=O)=O)[C@H](C)C[C@@H]1CC[C@@H](O)[C@@H](C1)OC |r,c:31,50,t:46,48|
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\C(C2)N1CCS1(=O)=O)[C@H](C)C[C@@H]1CC[C@@H]([C@@H](C1)OC)n1cnnn1 |r,c:31,50,t:46,48|
O=c1cc(oc(c1)-c1cccc2Cc3ccccc3Sc12)N1CCOCC1
COc1cc2ncnc(-n3nc(nc3N)-c3ccccn3)c2cc1OC
C[C@@H](Nc1c(cnc2ccc(cc12)C#N)C(N)=O)c1ccc(Cl)cc1 |r|
C[C@@H](Nc1c(cnc2ccc(cc12)-c1cccnc1)C(N)=O)c1ccc(Cl)cc1 |r|
COCc1ccc(cn1)-c1ccc2ncc(C(N)=O)c(N[C@@H](C)C3CCOCC3)c2c1 |r|
COCc1ccc(cn1)-c1cc2c(N[C@@H](C)c3ccn(C)n3)c(cnc2cc1F)C(N)=O |r|
CCC(CC)CNc1c(cnc2ccc(cc12)C#N)C(N)=O
COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(NC(=O)CN2CCOCC2)c1
Nc1nc2cc(ccc2o1)-c1nn(CC2CCCC2)c2ncnc(N)c12
C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c(n1)C(F)F
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
[H][C@]12CC[C@]([H])(COC1)N2c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1 |r|
[H][C@]12CC[C@]([H])(CN(C1)c1nc(nc(n1)-c1cnc(N)nc1C(F)F)N1CCOCC1)O2 |r|
O=S(=O)(N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1)c1ccccc1
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Cc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Cc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
COc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
COc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Oc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Oc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Oc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
[O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
[O-][N+](=O)c1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Clc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Clc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Fc1cccc(c1)S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
Fc1ccccc1S(=O)(=O)N1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CCOCC1
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2cnc(N)nc2)N2CCOCC2)cc1
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2ccc(N)nc2)N2CCOCC2)cc1
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2ccnc3[nH]ccc23)N2CCOCC2)cc1
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2cnc(N)s2)N2CCOCC2)cc1
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2cccc3[nH]ncc23)N2CCOCC2)cc1
Nc1ccc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
COc1ncc(cn1)-c1nc(N2CCOCC2)c2ncn(CCCCCCC(=O)NO)c2n1
Nc1ncc(cn1)-c1nc(N2CCOCC2)c2ccn(CCCCCCC(=O)NO)c2n1
CC(C)n1cnc2c(nc(nc12)N1CCOCC1)-c1cnc(N)nc1
CC(C)n1cnc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Nc1ncc(cn1)-c1nc(nc(N[C@@]2(CO)CCN(C2)C(=O)OCC(F)F)c1F)N1CCOCC1 |r|
Nc1ncnc2n(CC3CCN(CC3)C(=O)C=C)cc(-c3ccc4OCOc4c3)c12
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1C2CC1COC2 |r|
COC[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@@H]1CO |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1CO |r|
CC[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
CC[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
C[C@H]1CN(C[C@@H](C)O1)c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@@H](C)COC[C@@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1[C@H](C)COC[C@H]1C |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC11CCC1 |r|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOCC1(C)C |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)N1CCOC[C@H]1C |r|
Oc1ccc(cc1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
O=S(=O)(Nc1nccs1)c1ccc(Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
CNC(=O)Nc1nc(N2CCOCC2)c2ccccc2n1
OCCNC(=O)Nc1nc(N2CCOCC2)c2ccccc2n1
O=C(Nc1ccccc1)Nc1nc(N2CCOCC2)c2ccccc2n1
O=C(Nc1cncnc1)Nc1nc(N2CCOCC2)c2ccccc2n1
OCc1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
OCc1cccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)c1
OCCc1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
CC(=O)c1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
CC(=O)Nc1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
CNC(=O)c1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
NS(=O)(=O)c1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
CS(=O)(=O)Nc1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
NC(=N)NS(=O)(=O)c1ccc(NC(=O)Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)Nc1nc(N2CCOCC2)c2ccccc2n1
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1)Nc1nc(N2CCOCC2)c2ccccc2n1
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1)Nc1nc(N2CCOCC2)c2ccccc2n1
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3nc(N)ns3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3ccc(N)nn3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3nnc(N)s3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)s3)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3C(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3C(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)cc3C(F)(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)nc3C(F)(F)F)N1CCOC2 |r|
[H][C@]12Cc3c(nc(nc3N3CCOC[C@H]3C)-c3cnc(N)c(c3)C(F)(F)F)N1CCOC2 |r|
COC(=O)Nc1cc(c(cn1)-c1nc(N2CCOCC2)c2cc(CN3CCN(CC3)S(C)(=O)=O)cn2n1)C(F)(F)F
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C=C\C(=O)N3CCN(C)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N(C)CCO)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCOCC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCN(C)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C\C(=O)N3CCC(O)CC3)c2c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2nccc(\C(C)=C/C(=O)N3CCOCC3)c2c1
Fc1ccc(NC(=O)Nc2ccc(cc2)-c2c(sc(N3CCOCC3)c2C#N)-c2nc[nH]n2)cc1
Fc1ccccc1NC(=O)Nc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1nc[nH]n1
Clc1ccccc1NC(=O)Nc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1nc[nH]n1
Oc1cccc(\C=N\NC(=O)Nc2ccc(cc2)-c2c(sc(N3CCOCC3)c2C#N)-c2nc[nH]n2)c1
O=C(N\N=C\c1ccco1)Nc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1nc[nH]n1
O=C(N\N=C\c1ccccn1)Nc1ccc(cc1)-c1c(sc(N2CCOCC2)c1C#N)-c1nc[nH]n1
CN(C)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)[C@@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r|
NC(=O)[C@H]1CCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1 |r|
NC(=O)C1CCCCN1C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)C1CCCN(C1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)C1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
NC(=O)C1(N)CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
C[C@H](NC(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1)C(N)=O |r|
O=C(N1CCOCC1)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
CN1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
CS(=O)(=O)N1CCN(CC1)C(=O)c1ccc2nc(Nc3ccc(cc3)-c3nc(nc(n3)N3CCOCC3)N3CCOCC3)[nH]c2c1
CN(C)C1CCN(CC1)C(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)c1
Nc1nc2cc(ccc2o1)-c1nn(CCCCC(=O)NO)c2ncnc(N)c12
Nc1ccc(cn1)-c1nn(CCCCC(=O)NO)c2ncnc(N)c12
Nc1ncc(cn1)-c1nn(CCCCC(=O)NO)c2ncnc(N)c12
Nc1ncnc2n(CCCCC(=O)NO)nc(-c3cnc4ccccc4c3)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCCCCC(=O)NO)c2ncnc(N)c12
Nc1ccc(cn1)-c1nn(CCCCCCC(=O)NO)c2ncnc(N)c12
Nc1ncc(cn1)-c1nn(CCCCCCC(=O)NO)c2ncnc(N)c12
Nc1ncnc2n(CCCCCCC(=O)NO)nc(-c3cnc4ccccc4c3)c12
Nc1nc2cc(ccc2o1)-c1nn(Cc2ccc(cc2)C(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(Cc2ccc(cn2)C(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(Cc2ccc(o2)C(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(Cc2ccc(s2)C(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CC2CCN(CC2)C(=O)CCCCC(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CC2CCN(CC2)C(=O)c2ccc(cc2)C(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CC2CCN(CC2)C(=O)c2ccc(s2)C(=O)NO)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CC2CCN(CC2)c2ncc(cn2)C(=O)NO)c2ncnc(N)c12
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2cncnc12
CN1CCN(CC1)c1nc(nc2cc(Cl)ccc12)-c1ccc(cc1)C(=O)NO
O=S1(=O)CC2(OCCO2)c2cc3nccc(Nc4ccc5scnc5c4)c3cc12
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cnc(N)nc2)CC1
NC(=O)c1cccc2cc(oc12)C(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3o2)-c2cnc(N)nc2)CC1
Cc1c(CN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
COc1ncc-2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cccc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCC1CCN(CC1)c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)N1CCc3ccc(cc3C1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(ccn1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(F)c(c1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1F)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ccnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1cnc3ccc-2nn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1cnc3ccc-2nn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1cnc3ccc-2cn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCC1CCN(CC1)c1ncnc3ccc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1cnc3ccc-2cn13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ccnc3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1cnn3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1cnn3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1cnn3ccc-2nc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3sc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(Cc3cnc4sc-2nn34)c1
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3sc-2cc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(Cc3cnc4sc-2nn34)c1
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3[nH]c-2cc13
FC(F)(F)c1ccc(NC(=O)NCc2cccc(Br)c2)cc1
CN(Cc1ccccc1)C(=O)Nc1ccc(cc1)C(F)(F)F
Oc1ccc(CNC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Oc1ccc(CNC(=O)Nc2cccc(Cl)c2)cc1
Oc1ccc(CNC(=O)Nc2cccc(F)c2)cc1
CC(NC(=O)Nc1cccc(Cl)c1)c1ccccc1
CC(NC(=O)Nc1cccc(F)c1)c1ccccc1
CC(N(C)C(=O)Nc1ccccc1)c1ccccc1
CN(Cc1ccc(O)cc1)C(=O)Nc1ccccc1
Fc1cccc(NC(=O)Nc2nc3ccccc3[nH]2)c1
FC(F)(F)c1ccc(NC(=O)Nc2nc3ccccc3[nH]2)cc1
Fc1cccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)c1
Fc1cccc(NC(=O)NCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
FC(F)(F)c1ccc(NC(=O)NCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1
Cc1ccc(cc1Br)C(=O)NCCc1ccc(O)cc1
Cc1ccc(cc1Br)C(=O)NCc1ccc(O)cc1
Cc1ccc(cc1Br)C(=O)Nc1ccc2ccccc2n1
Cc1ccc(cc1Br)C(=O)Nc1cc2ccccc2cn1
FC(F)(F)Oc1ccc(cc1)C(=O)Nc1nc2ccccc2[nH]1
C\C(=N/NC(=O)c1ccc(C)c(Br)c1)c1ccc(O)cc1
C\C(=N/NC(=O)c1ccc(C)c(Br)c1)c1ccc(N)cc1
C\C(=N/NC(=O)c1cccc(Br)c1)c1cc(O)cc(O)c1
C\C(=N/NC(=O)c1cccc(Br)c1)c1ccc(N)cc1
C\C(=N/NC(=O)c1ccc(C)c(Br)c1)c1ccc(cc1)C(F)(F)F
C\C(=N/NC(=O)c1ccc(C)c(Br)c1)c1ccncc1
C\C(=N/NC(=O)c1ccc(C)c(I)c1)c1ccc(cc1)C(F)(F)F
C\C(=N/NC(=O)c1cccc(F)c1)c1ccc(O)cc1O
C\C(=N/NC(=O)c1ccc(C)c(I)c1)c1ccc(N)cc1
C\C(=N/NC(=O)c1cccc(I)c1)c1ccc(N)cc1
C\C(=N/NC(=O)c1ccc(C)c(F)c1)c1ccc(N)cc1
C\C(=N/NC(=O)c1cccc(Br)c1)c1ccc(cc1)C(O)=O
C\C(=N/NC(=O)c1cccc(I)c1)c1ccc(cc1)C(O)=O
C\C(=N/NC(=O)c1ccc(C)c(I)c1)c1ccncc1
C\C(=N/NC(=O)c1cccc(I)c1)c1ccncc1
C\C(=N/NC(=O)c1cccc(Br)c1)N1CCOCC1
C\C(=N/NC(=O)c1ccc(C)c(I)c1)N1CCOCC1
C\C(=N/NC(=O)c1cccc(F)c1)N1CCOCC1
C\C(=N/NC(=O)c1cccc(Br)c1)c1ccc(cc1)C(=O)Nc1cc[nH]n1
C\C(=N/NC(=O)c1ccc(C)c(F)c1)c1ccc(cc1)C(=O)Nc1cc(ccn1)N1CCOCC1
C\C(=N/NC(=O)c1cccc(F)c1)c1ccc(cc1)C(=O)Nc1nc2ccccc2[nH]1
C\C(=N/NC(=O)c1cccc(Br)c1)c1ccc(cc1)C(=O)Nc1nc2ccccc2[nH]1
C\C(=N/NC(=O)c1cccc(Br)c1)c1ccc(cc1)C(=O)Nc1cc(ccn1)N1CCOCC1
C\C(=N/NC(=O)c1cccc(Br)c1)c1ccc(cc1)C(=O)NN1CCOCC1
CC(C)n1cc(C(=O)Nc2ccc(Oc3ccnc(NC(=O)C4CC4)c3)c(F)c2)c(=O)n(-c2ccc(F)cc2)c1=O
[H][C@]12C[C@@]1([H])[C@H](Cc1ccccc1)N(C2)c1cc(cc(=O)[nH]1)N1CCOCC1 |r|
CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
CS(=O)(=O)c1ccc(F)c(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
CS(=O)(=O)c1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
NS(=O)(=O)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
CS(=O)(=O)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
FC(F)(F)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
Cc1cc(cnc1F)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1
Cc1nc2ccc(cc2n2c(nnc12)C1CCOCC1)-c1cncc(c1)C(F)F
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1F
FC(F)c1cncc(c1)-c1cc(F)c2ncc3nnc(C4CCOCC4)n3c2c1
FC(F)c1cncc(c1)-c1ccc2ncc3[nH]nc(C4CCOCC4)c3c2c1
Cn1nc(C2CCOCC2)c2c1cnc1ccc(cc21)-c1cncc(c1)C(F)F
Cn1nc2cnc3ccc(cc3c2c1C1CCOCC1)-c1cncc(c1)C(F)F
Cc1nc(C2CCOCC2)n2c1cnc1ccc(cc21)-c1cncc(c1)C(F)F
[H][C@@]12COC[C@]1([H])[C@H]2c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r|
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCOCC4)n3c2c1 |t:20|
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCOCC4)n3c2c1 |t:20|
[H][C@@]12CCC[C@]1([H])[C@H]2c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r|
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCCC4)n3c2c1 |t:20|
FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCCCC4)n3c2c1 |t:20|
CO[C@H]1CC[C@H](CC1)c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r,wU:5.8,2.1,(26.22,-45.52,;25.75,-46.98,;26.79,-48.11,;28.29,-47.78,;29.33,-48.92,;28.86,-50.39,;27.36,-50.72,;26.32,-49.58,;29.9,-51.52,;31.42,-51.35,;32.06,-52.74,;30.93,-53.78,;30.94,-55.33,;29.61,-56.11,;28.27,-55.34,;26.93,-56.12,;25.6,-55.34,;25.6,-53.8,;26.93,-53.03,;28.27,-53.79,;29.6,-53.02,;24.27,-53.03,;22.94,-53.8,;21.61,-53.04,;21.61,-51.49,;22.94,-50.72,;24.27,-51.49,;22.94,-49.19,;24.26,-48.42,;21.61,-48.42,)|
CO[C@H]1CC[C@@H](CC1)c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r,wU:5.8,wD:2.1,(43.27,-45.09,;42.81,-46.55,;43.84,-47.68,;43.38,-49.15,;44.41,-50.29,;45.91,-49.96,;46.38,-48.49,;45.35,-47.35,;46.95,-51.09,;48.48,-50.92,;49.11,-52.31,;47.98,-53.34,;48,-54.9,;46.66,-55.68,;45.32,-54.91,;43.99,-55.69,;42.65,-54.91,;42.66,-53.37,;43.99,-52.6,;45.32,-53.36,;46.65,-52.59,;41.32,-52.6,;40,-53.37,;38.67,-52.61,;38.66,-51.06,;39.99,-50.29,;41.33,-51.06,;39.99,-48.76,;41.32,-47.99,;38.66,-47.99,)|
CNC(=O)CCCCCCCn1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
Nc1ncnc2n(CCCCCCCCC(=O)NO)nc(-c3cnc4[nH]ccc4c3)c12
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cccc(c1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(s1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(ccn1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(o1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1csc(c1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(cs1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1nc(cs1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1sc(cc1C)-c1ncnc3cc-2sc13
COc1ccc2cc1C(=O)NCc1ccc(s1)-c1ncnc3cc(sc13)-c1cnc(OC)c(NS2(=O)=O)c1
COc1ncc-2cc1NS(=O)(=O)c1ccc(F)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1ccc(Cl)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3cc-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(s1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cncc(c1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCn1cc(cn1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1ccc(F)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NC[C@@H]1CN(CCO1)c1ncnc3c(C)c-2sc13 |r|
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NC[C@@H]1CCN(C1)c1ncnc3c(C)c-2sc13 |r|
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NC[C@H]1CCN(C1)c1ncnc3c(C)c-2sc13 |r|
CNC(=O)c1cccc(c1)S(=O)(=O)Nc1cc(cnc1OC)-c1sc2c(ncnc2c1C)-c1cccs1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1sc2c(ncnc2c1C)-c1ccc(CNC=O)s1
COc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1sc2c(ncnc2c1C)-c1cccs1
NC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)[C@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)C1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
[H][C@@]12C[C@]1([H])N([C@@H](C2)C(N)=O)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
COC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
OC(=O)C1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
CN(C)[C@@H]1C[C@H](N(C1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1)C(N)=O |r|
CN(C)[C@H]1C[C@H](N(C1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1)C(N)=O |r|
NC(=O)[C@@H]1CC(O)CN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)C1CCCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)C1CCCN(C1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
C[C@@H](NC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOCC2)N2CCOCC2)cc1)C(N)=O |r|
CN(C)C1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
NC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)[C@H]1CCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1 |r|
NC(=O)C1CCCCN1C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)cc1
C[C@@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC[C@H]2C(N)=O)cc1)N1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)C(N)=O)cc1)N1CCOCC1 |r|
C[C@H](NC(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2CCOC[C@@H]2C)N2CCOCC2)cc1)C(N)=O |r|
[H][C@]12CN(C[C@]1([H])OCCO2)c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC(CC2)N(C)C)cc1)N1CCOCC1 |r|
[H][C@]12CN(C[C@]1([H])OCCO2)c1nc(nc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC[C@H]2C(N)=O)cc1)N1CCOCC1 |r|
C[C@H]1COCCN1c1ccnc(n1)-c1ccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCC[C@H]2C(N)=O)cc1 |r|
NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(cc1)-c1nccc(n1)N1CCOCC1 |r|
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(F)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(Cl)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(cc1)C#N
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(cc1)C(F)(F)F
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
CC(=O)c1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
CNC(=O)c1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
COC(=O)c1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(C)cc1
COc1ccc(cc1)-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(O)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(N)cc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc(N)nc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc(N)nc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc(nc1)N1CCOCC1
Cc1noc(C)c1-c1ccc2ncc3nc(C)n(-c4ccc(F)cc4)c3c2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnn(C)c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1cnc2ccccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)cc1)-c1ccc2ccccc2c1
Cc1nc2cnc3ccc(cc3c2n1C)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1C1CC1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1CC1CCOCC1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1CC1CCOC1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1Cc1ccccc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccccc1)-c1cnc2[nH]ccc2c1
COc1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(F)nc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)C(F)(F)F)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(nc1)C(F)(F)F)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)C(C)(C)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3cc(F)c(cc3c2n1-c1ccc(cc1)C(C)(C)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(nc1)C(C)(C)C#N)-c1cnc2[nH]ccc2c1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(cc1)N1CCOCC1)-c1cnc2[nH]ccc2c1
C[C@@H](c1ccccc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
C[C@H](c1ccccc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
C[C@@H](c1ccc(F)cc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
C[C@H](c1ccc(F)cc1)n1c(C)nc2cnc3ccc(cc3c12)-c1cnc2[nH]ccc2c1 |r|
CC(C)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN3CCCC3)nc2)n(C)c1=O
CC(C)n1c2c(cnc3ccc(cc23)-c2ccc(OCCCN(C)C)nc2)n(C)c1=O
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCS(=O)(=O)CC1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCCCC1=O)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCN(C1=O)c1ccccc1)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCCC1=O)C(F)(F)F
Nc1cc(c(cn1)-c1cc(nc(n1)N1CCOCC1)N1CCOC1=O)C(F)(F)F
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOC2=O)c(n1)C(F)(F)F
C[C@H]1COC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
Nc1ncc(-c2cc(nc(n2)N2[C@@H](CO)COC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2[C@H](CO)COC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2C[C@@H](CO)OC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
Nc1ncc(-c2cc(nc(n2)N2C[C@H](CO)OC2=O)N2CCOCC2)c(n1)C(F)(F)F |r|
C[C@]1(CO)COC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@@H]1OC(=O)N([C@H]1CO)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1OC(=O)N([C@H]1CO)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
[H][C@]1(COC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1)[C@H](C)O |r|
[H][C@@]12COC[C@]1([H])N(C(=O)O2)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1OC(=O)N([C@H]1CC#N)c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1[C@@H](CO)OC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
C[C@H]1[C@H](CO)OC(=O)N1c1nc(cc(n1)-c1cnc(N)nc1C(F)(F)F)N1CCOCC1 |r|
Nc1cc(c(cn1)-c1cc(nc(c1)N1CCOCC1)N1CCOCC1)C(F)(F)F
COc1ccc2N(CCOc2c1)c1cc(nc(n1)N1CCOCC1)-c1cnc(N)nc1
Nc1ncc(-c2cc(nc(n2)N2CCOCC2)N2CCOCC2)c(=O)[nH]1
CC(C)S(=O)(=O)N1Cc2nc(nc(N3CCOCC3C)c2C1)-c1c[nH]c2ccccc12
CCN(CC)CCC[C@@H](C)Nc1ccnc2c1ccc(c2)Cl
CCC(=O)N1CC[C@@H](C1)Nc1ncnc2sc(cc12)-c1cnc(OC)c(OC)c1 |r|
COc1cc(cnc1OC)-c1cc2c(N[C@H]3CCN(C3)C(=O)C3CCC3)ncnc2s1 |r|
COc1cc(cnc1OC)-c1cc2c(O[C@H]3CCN(C3)C(=O)C3CCC3)ncnc2s1 |r|
C[C@H]1COCCN1c1nc(Oc2ccc(cc2)C(=O)N(C)C)nc(n1)-c1cnc(N)s1 |r|
CN(C)C(=O)C1CCC(CC1)Oc1nc(nc(n1)-c1ccc(N)nc1)N1CCOCC1 |(-7.33,-1.93,;-7.33,-.39,;-8.66,.38,;-6,.38,;-6,1.92,;-4.66,-.39,;-4.66,-1.93,;-3.33,-2.7,;-2,-1.93,;-2,-.39,;-3.34,.38,;-.66,-2.7,;.67,-1.93,;.67,-.38,;2,.38,;3.33,-.38,;3.33,-1.93,;2.01,-2.69,;4.67,-2.69,;6,-1.93,;7.33,-2.69,;7.33,-4.23,;8.66,-5,;6,-5,;4.67,-4.24,;2,1.92,;.67,2.69,;.67,4.23,;2,5,;3.34,4.23,;3.34,2.69,)|
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2cnc(N)cc2C(F)(F)F)N2CCOCC2)c(F)c1
C[C@H]1COC[C@H](C)N1c1nc(Oc2ccc(cc2)C(=O)N(C)C)nc(n1)-c1cnc(N)s1 |r|
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2ccc(N)nc2)N2CCOCC2)cc1C
CN(C)C(=O)c1ccc(Oc2nc(nc(n2)-c2cnc3[nH]ccc3c2)N2CCOCC2)c(F)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCN(CC1)C(=O)CCOCCOCCOCCONC(=O)c1ccc(F)c(F)c1Nc1ccc(I)cc1F
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncc(nc2c1)N1CCNCC1
CC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
NOCCOCCOCCOCCC(=O)N1CCN(CC1)c1cnc2ccc(cc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
COc1ccc(cc1)-c1ccc2c(cc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(CNCCO)cc1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(cc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
COc1ccc(cc1)-c1ccc2c(nc(cc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
C[C@H]1COCCN1c1cc2nc(ccc2c(n1)N1CCOC[C@@H]1C)-c1cccc(CO)c1 |r|
CC(C)CC1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CCC1(C)CN(c2c1ncnc2N)c1ccc2oc(N)nc2c1
CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2cnn3ncccc23)cc1C(F)(F)F
CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2ccnc(Cl)c2)cc1C(F)(F)F
CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2ccccc2)cc1C(F)(F)F
CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2cccc(Cl)c2)cc1C(F)(F)F
CN1CCN(CC1)c1ccc(Nc2nccc(n2)-c2cccc(c2)[N+]([O-])=O)cc1C(F)(F)F
CC(C)n1nc(-c2cccc(c2)C(=O)NC2=NCCS2)c2c(N)ncnc12 |t:16|
CC(C)n1nc(-c2ccc(Br)c(O)c2)c2c(N)ncnc12
CO[C@@H](C)Cn1c2c(cnc3ccc(cc23)-c2cncc(c2)C(C)(C)O)n(C)c1=O |r|
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3ccc(nc3)OC)C4CCC(CC4)OCCO
CC(C)n1c(C)nc2c(nc(nc12)N1CCOCC1)-c1cnc(N)nc1
COc1cccc2cc([nH]c12)-c1nc(C2CCC(CC2)C(O)=O)n2ncnc(N)c12 |(3.86,-5.15,;2.53,-4.38,;2.53,-2.84,;3.86,-2.07,;3.86,-.53,;2.53,.24,;1.2,-.53,;-.27,-.06,;-1.17,-1.3,;-.27,-2.55,;1.2,-2.07,;-2.71,-1.3,;-3.62,-2.55,;-5.08,-2.07,;-6.33,-2.98,;-6.17,-4.51,;-7.41,-5.41,;-8.82,-4.79,;-8.98,-3.26,;-7.74,-2.35,;-10.07,-5.69,;-9.91,-7.23,;-11.47,-5.07,;-5.08,-.53,;-6.23,.5,;-5.91,2,;-4.44,2.48,;-3.3,1.45,;-1.83,1.93,;-3.62,-.06,)|
c1c(cc(c(c1O)O)O)[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O
CN(C)C(=O)Oc1ccc2c(C)c(Cc3cccc(c3)N(C)S(=O)(=O)CCCNCCCC(=O)N3CCN(CC3)c3ccc(Nc4c(cnc5ccc(cc45)-c4cnc5ccccc5c4)C(N)=O)cc3C(F)(F)F)c(=O)oc2c1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3ccccn3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3ccncc3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3cnccn3)cc2)N2CCOCC2)CC1
Cn1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)-c2ccc(CN3CCN(CC3)S(C)(=O)=O)s2)N2CCOCC2)n1
Cn1nccc1NC(=O)Nc1ccc(cc1)-c1nc(nc(n1)-c1ccc(CN2CCN(CC2)S(C)(=O)=O)s1)N1CCOCC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nc3ncc[nH]3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)Nn3cnnc3)cc2)N2CCOCC2)CC1
CS(=O)(=O)N1CCN(Cc2ccc(s2)-c2nc(nc(n2)-c2ccc(NC(=O)NC3CN4CCC3CC4)cc2)N2CCOCC2)CC1 |THB:27:28:32.31:35.34,(-13.01,-6.11,;-12.24,-4.78,;-13.57,-4.01,;-12.24,-3.24,;-10.7,-4.78,;-9.93,-3.45,;-8.4,-3.45,;-7.63,-4.78,;-6.09,-4.78,;-5.32,-3.44,;-6.09,-2.11,;-5.06,-.96,;-3.65,-1.59,;-3.81,-3.12,;-2.32,-.82,;-2.32,.72,;-.98,1.49,;.35,.72,;.35,-.82,;-.98,-1.59,;1.68,-1.59,;1.68,-3.13,;3.02,-3.9,;4.35,-3.13,;5.68,-3.9,;7.02,-3.13,;7.02,-1.59,;8.35,-3.9,;9.68,-3.13,;10.62,-1.91,;12.15,-1.71,;12.32,.52,;11.49,-.78,;11.21,-2.93,;12.63,-3.52,;13.57,-2.3,;4.35,-1.59,;3.02,-.82,;-.98,3.03,;-2.32,3.8,;-2.32,5.34,;-.98,6.11,;.35,5.34,;.35,3.8,;-8.4,-6.11,;-9.93,-6.11,)|
Cc1cc(ccc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(\C=C2/SC(=O)N(CC3(C)CCCCC3)C2=O)cc1
CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(OC)cc(OC)c1
CCC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)OC)cc1)N1CCOCC1
COc1ccc(cc1CN)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOCC1 |r|
COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)C1CCOC[C@@H]1C |r|
FC(F)(F)C(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1cnc2ccccc2c1
COc1ccc(cn1)C1Cc2c(C)nc(N)nc2N([C@H]2CC[C@@H](CC2)OCCO)C1=O |r,wU:22.27,wD:19.20,(8.66,-3.08,;7.33,-3.85,;6,-3.08,;4.67,-3.85,;3.33,-3.08,;3.33,-1.54,;4.67,-.77,;6,-1.54,;2,-.77,;2,.77,;.67,1.54,;.67,3.09,;2,3.86,;-.67,3.86,;-2.01,3.09,;-3.34,3.86,;-2.01,1.53,;-.67,.77,;-.66,-.78,;-2,-1.55,;-3.33,-.78,;-4.66,-1.55,;-4.66,-3.09,;-3.33,-3.86,;-2,-3.09,;-6,-3.86,;-7.33,-3.09,;-7.33,-1.55,;-8.66,-.78,;.68,-1.54,;.68,-3.08,)|
C[C@H]1COCCN1c1nc(cc(n1)-c1cc(F)ccc1S(C)(=O)=O)-c1ccc(NC(=O)NCC(F)F)cc1 |r|
CCOC(=O)N1Cc2nc(nc(N3CCOC[C@@H]3C)c2C1)-c1ccc(NC(=O)NC2CC2)cc1 |r|
CC(C)n1nc2ncnc(N)c2c1C1C=c2cc(O)ccc2=N1 |c:24,t:16|
C[C@H](c1ccccc1)n1nnc2cnc3ccc(cc3c12)-c1ccc(OCCCN(C)C)nc1 |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1 |t:18|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1
Nc1cc(c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1)C(F)(F)F |t:15|
Nc1cc(c(cn1)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1)C(F)(F)F
Nc1ncc(-c2nc(nc(n2)C2=CCOCC2)N2CCOCC2)c(n1)C(F)F |t:12|
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)C2CCOCC2)c(n1)C(F)F
Nc1ncc(-c2nc(nc(n2)C2=CCOCC2)N2CCOCC2)c(n1)C(F)(F)F |t:12|
Nc1ncc(-c2nc(nc(n2)N2CCOCC2)C2CCOCC2)c(n1)C(F)(F)F
Nc1ncc(cc1C(F)(F)F)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1 |t:19|
Nc1ncc(cc1C(F)(F)F)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1
Nc1cnc(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCOCC1 |t:15|
Nc1cnc(cn1)-c1nc(nc(n1)N1CCOCC1)C1CCOCC1
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1=CCOCC1 |r,t:26|
C[C@@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1CCOCC1 |r|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1=CCOCC1 |r,t:26|
C[C@H]1COCCN1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1CCOCC1 |r|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1=CCOCC1 |r,t:27|
C[C@H]1COC[C@@H](C)N1c1nc(nc(n1)-c1cnc(N)cc1C(F)F)C1CCOCC1 |r|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1C2CCC1COC2 |t:18|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1C2CCC1COC2)C1CCOCC1
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)C1=CCOCC1)N1CCCCC1 |t:18|
Nc1cc(C(F)F)c(cn1)-c1nc(nc(n1)N1CCCCC1)C1CCOCC1
CNc1nc2ccccc2n1-c1nc(N2CCOC[C@H]2C)c2scc(c2n1)S(C)(=O)=O |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C2(C)C)S(C)(=O)=O)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CCN(C(C)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1ccc3OCOc3c1)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@@H]1COCCN1c1nc(nc2c1CN(C(=O)c1cccc(c1)S(C)(=O)=O)C2(C)C)-c1cccc2[nH]ccc12 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2c1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1cc2sc(nc2c(n1)N1CCOC[C@H]1C)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1cc2[nH]c(nc2c(n1)N1CCOC[C@H]1C)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2cc([nH]c2n1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc([nH]c2n1)-c1cc[nH]n1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc(O)ccc1F |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1ccccn1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1nccs1 |r|
C[C@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cscn1 |r|
C[C@@H]1COCCN1c1cc(nc2[nH]c(nc12)-c1ccccn1)N1C2CCC1COC2 |r|
C[C@@H]1COCCN1c1cc(nc2sc(nc12)-c1cc[nH]n1)-c1cncnc1 |r|
CC(C)c1cc(N2CCOC[C@H]2C)c2nc(sc2n1)-c1cc[nH]n1 |r|
C[C@@H]1COCCN1c1cc(nc2sc(nc12)-c1cc[nH]n1)C1(CC1)C#N |r|
C[C@@H]1COCCN1c1cc(nc2sc(nc12)-c1cc[nH]n1)C1(CCOCC1)C#N |r|
Fc1ccc(Cn2cccc(C(=O)N[C@@H](COc3ccc4[nH]c(=O)[nH]c4c3)c3ccccc3)c2=O)cc1F |r|
COC1CCC(CC1)N1C(=O)CNc2ncc(nc12)-c1ccc(nc1)C(C)(C)O |(-2.67,-5.01,;-4,-4.23,;-4,-2.7,;-2.67,-1.92,;-2.67,-.39,;-4,.38,;-5.33,-.39,;-5.33,-1.92,;-4,1.92,;-5.33,2.69,;-6.67,1.92,;-5.33,4.23,;-4,5.01,;-2.67,4.23,;-1.33,5,;-0,4.23,;0,2.7,;-1.33,1.92,;-2.67,2.69,;1.34,1.93,;2.67,2.7,;4,1.93,;4,.39,;2.67,-.38,;1.34,.38,;5.33,-.38,;4.56,-1.72,;6.1,-1.72,;6.67,.39,)|
O=C1NC(=O)\C(S1)=C\c1ccc2nccc(-c3ccncc3)c2c1
COc1ncc(cc1NS(C)(=O)=O)-c1ccc2ncc(C#N)c(N3CCOCC3)c2c1
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOC[C@@H]4C)c32)N2CCOC[C@@H]2C)c(O)cc1O |r|
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3cccc(Cl)c3)cc2)c(O)cc1O
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2)c(O)cc1O
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3cc(Cl)cc(Cl)c3)cc2)c(O)cc1O
CC(C)c1cc(C(=O)N2CCc3c(C2)sc2nc(nc(N4CCOCC4)c32)-c2ccc(NC(=O)Nc3ccc(F)c(Cl)c3)cc2)c(O)cc1O
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1ccc2ncc(-c3cn(CCCN4CCOCC4)nn3)n2n1
CNC(=O)Nc1ccc(cc1)-c1nc(nc2C(N=Cc12)C1CCOCC1)N1CCOCC1 |c:18|
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCO[N+]([O-])=O)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCO[N+]([O-])=O)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCCO[N+]([O-])=O)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCCCO[N+]([O-])=O)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCCCCO[N+]([O-])=O)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCc2c(no[n+]2[O-])-c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCc2ccc(OCc3c(no[n+]3[O-])-c3ccccc3)cc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCc2ccc(OCc3c(no[n+]3[O-])-c3ccccc3)cc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCc2ccccc2OCc2c(no[n+]2[O-])-c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCc2cccc(OCc3c(no[n+]3[O-])-c3ccccc3)c2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCCCCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCC#CCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)OCCOCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)NCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
Nc1nc2cc(ccc2o1)-c1nn(CCCC(=O)NCCCOc2no[n+]([O-])c2S(=O)(=O)c2ccccc2)c2ncnc(N)c12
CC(COc1no[n+]([O-])c1S(=O)(=O)c1ccccc1)NC(=O)CCCn1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
Cc1ccc(-c2ncc3N([C@H]4CC[C@H](O)CC4)C(=O)[C@]4(C)COCCN4c3n2)c2cc[nH]c12 |r,wU:19.20,13.13,wD:10.9,(7.33,-5.01,;6,-4.23,;4.67,-5,;3.33,-4.24,;3.33,-2.7,;2,-1.93,;.68,-2.69,;-.66,-1.93,;-.66,-.39,;-2,.38,;-3.33,-.39,;-4.66,.38,;-6,-.39,;-6,-1.93,;-7.33,-2.7,;-4.66,-2.7,;-3.33,-1.93,;-2,1.92,;-3.33,2.69,;-.66,2.69,;-2,3.46,;-.66,4.23,;.67,5.01,;2.01,4.23,;2.01,2.69,;.67,1.92,;.67,.38,;2,-.38,;4.67,-1.93,;5.01,-.4,;6.51,-.25,;7.12,-1.66,;6,-2.69,)|
Cc1cccc2c(c[nH]c12)-c1ncc2N([C@H]3CC[C@H](O)CC3)C(=O)[C@]3(C)COCCN3c2n1 |r,wU:24.27,18.20,wD:15.16,(7.87,-3.93,;6.79,-2.84,;7.12,-1.31,;5.97,-.25,;4.47,-.72,;4.12,-2.25,;2.79,-3.02,;3.12,-4.51,;4.66,-4.68,;5.28,-3.31,;1.46,-2.25,;.13,-3.02,;-1.21,-2.25,;-1.21,-.71,;-2.54,.06,;-3.87,-.71,;-5.21,.06,;-6.54,-.71,;-6.54,-2.25,;-7.87,-3.02,;-5.21,-3.02,;-3.87,-2.25,;-2.54,1.6,;-3.87,2.37,;-1.21,2.37,;-2.54,3.14,;-1.21,3.91,;.13,4.68,;1.46,3.91,;1.46,2.37,;.13,1.6,;.13,.06,;1.46,-.71,)|
Cc1ccc(-c2ncc3N([C@@H]4CC[C@H](O)CC4)C(=O)[C@]4(C)COCCN4c3n2)c2cc[nH]c12 |r,wU:19.20,wD:10.9,13.13,(7.33,-5.01,;6,-4.23,;4.67,-5,;3.33,-4.24,;3.33,-2.7,;2,-1.93,;.68,-2.69,;-.66,-1.93,;-.66,-.39,;-2,.38,;-3.33,-.39,;-3.33,-1.93,;-4.66,-2.7,;-6,-1.93,;-7.33,-2.7,;-6,-.39,;-4.66,.38,;-2,1.92,;-3.33,2.69,;-.66,2.69,;-2,3.46,;-.66,4.23,;.67,5.01,;2.01,4.23,;2.01,2.69,;.67,1.92,;.67,.38,;2,-.38,;4.67,-1.93,;5.01,-.4,;6.51,-.25,;7.12,-1.66,;6,-2.69,)|
Cc1cccc2c(c[nH]c12)-c1ncc2N([C@@H]3CC[C@H](O)CC3)C(=O)[C@]3(C)COCCN3c2n1 |r,wU:24.27,wD:15.16,18.20,(7.87,-3.93,;6.79,-2.84,;7.12,-1.31,;5.97,-.25,;4.47,-.72,;4.12,-2.25,;2.79,-3.02,;3.12,-4.51,;4.66,-4.68,;5.28,-3.31,;1.46,-2.25,;.13,-3.02,;-1.21,-2.25,;-1.21,-.71,;-2.54,.06,;-3.87,-.71,;-3.87,-2.25,;-5.21,-3.02,;-6.54,-2.25,;-7.87,-3.02,;-6.54,-.71,;-5.21,.06,;-2.54,1.6,;-3.87,2.37,;-1.21,2.37,;-2.54,3.14,;-1.21,3.91,;.13,4.68,;1.46,3.91,;1.46,2.37,;.13,1.6,;.13,.06,;1.46,-.71,)|
Cc1cccc2c(c[nH]c12)-c1ncc2N(C(=O)[C@]3(C)COCCN3c2n1)C1(CCCO)CC1 |r|
Clc1ccc(cc1)-c1nc(N\N=C\c2cccc(Cl)c2)nc(N2CCOCC2)c1C#N
Oc1cccc(\C=N\Nc2nc(N3CCOCC3)c(C#N)c(n2)-c2ccc(Cl)cc2)c1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3)ncc21
Cc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
Cc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
Cc1ccccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
COc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
COc1ccccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(Cl)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(Cl)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3Cl)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc([N+](=O)[O-])cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc([N+](=O)[O-])c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3[N+](=O)[O-])ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(N)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(N)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3N)ncc21
CC(=O)Nc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
CC(=O)Nc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
CC(=O)Nc1ccccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(C#N)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(C#N)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3C#N)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(C(F)(F)F)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(C(F)(F)F)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3C(F)(F)F)ncc21
CC(=O)c1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1
CC(=O)c1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(S(C)(=O)=O)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(S(C)(=O)=O)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3S(C)(=O)=O)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(OCc4ccccc4)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(OCc4ccccc4)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3OCc3ccccc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(O)cc3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3cccc(O)c3)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccccc3O)ncc21
Cn1c(=O)n(C2CCCC2)c2cc(Nc3ccc(C(C)(C)C#N)cc3)ncc21
Cc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C)c1
Cc1cccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1C
Cc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)cc1C
Cc1c(Cl)cccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(Cl)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1ccc(Cl)cc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(S(C)(=O)=O)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1ccc(S(C)(=O)=O)cc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(C#N)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c(C)c1
COc1ccc(C)c(Nc2cc3c(cn2)n(C)c(=O)n3C2CCCC2)c1
Cc1cc(OCc2ccccc2)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
Cc1cc(O)ccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
COCCn1c(=O)n(C)c2cnc(Nc3ccc(OC)cc3C)cc21
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCOCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3CCC2CCOCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(OC)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(OCc3ccccc3)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(O)CC2)c(C)c1
COc1ccc(-n2c(=O)n(C)c3cnc(Nc4ccc(OC)cc4C)cc32)cc1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3-c2ccc(O)cc2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCNCC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(NC(=O)OC(C)(C)C)CC2)c(C)c1
COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3C2CCC(N)CC2)c(C)c1
COc1ccc(nn1)[C@@H](O)c1cc(c(F)cc1Cl)-c1ncnc2cc(ccc12)N1CCOCC1 |r|
Cc1cc2ncnn2cc1Nc3ncc4c(n3)N(C(=O)N4C)C5CCOCC5
CNCc1ccc(cc1)-c1cc(on1)-c1nc(cnc1N)-c1ccc(cc1)S(=O)(=O)C(C)C
C[C@@H]1COCCN1c1cc(nc(n1)-c1cc[nH]c2nccc12)C1(CC1)[S@](C)(=N)=O |r|
COc1cccc2cc(-c3nc([C@H]4CC[C@H](C(=O)O)CC4)n4ncnc(N)c34)[nH]c12
C[C@@H]1COCCN1c1nc(-c2ccnc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
C[C@@H]1COCCN1c1nc(-c2cncc3[nH]ccc23)nc2c1ccn2S(C)(=O)=O
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
Cc1c(CN2CCN(C(=O)[C@H](C)O)CC2)sc2c(N3CCOCC3)nc(N)nc12
COc1ncc(-c2cc(OCCCCCCC(=O)Nc3ccccc3N)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
COc1ncc(-c2cc(OCCCc3ccc(C(=O)Nc4ccccc4N)cc3)c3ncnc(C)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
CC(C)(C)OC(=O)N1Cc2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc2C1=O
CC(C)(C)OC(=O)N1Cc2ccc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)cc2C1=O
CC(C)(C)OC(=O)N1Cc2ccc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)cc2C1
CN1Cc2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc2C1=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)C(=O)OC2
CC1OC(=O)c2cc(NC(=O)Nc3ccc(-c4nc(N5CCOCC5)nc(N5CCOCC5)n4)cc3)ccc21
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)CNC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)C(=O)NC2
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)C(=O)NC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)CNC2
C[C@H]1COCCN1c1nc(-c2ccc(NC(=O)Nc3ccc4c(c3)COC4=O)cc2)nc(N2CCOCC2)n1
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCO[C@@H](CO)C3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCO[C@H](CO)C3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CCOC[C@H]3CO)n2)cc1)Nc1ccc2c(c1)COC2=O
CN1CCN(c2nc(-c3ccc(NC(=O)Nc4ccc5c(c4)COC5=O)cc3)nc(N3CCOCC3)n2)CC1
CC(C)(C)OC(=O)N1CCN(c2nc(-c3ccc(NC(=O)Nc4ccc5c(c4)COC5=O)cc3)nc(N3CCOCC3)n2)CC1
CN(C)C1CCN(c2nc(-c3ccc(NC(=O)Nc4ccc5c(c4)COC5=O)cc3)nc(N3CCOCC3)n2)CC1
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3C[C@H]4C[C@@H]3CO4)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3C4CCC3COC4)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCCOCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3CC4CCC(C3)O4)n2)cc1)Nc1ccc2c(c1)COC2=O
CC(C)(C)OC(=O)N1CC2CCC(C1)N2c1nc(-c2ccc(NC(=O)Nc3ccc4c(c3)COC4=O)cc2)nc(N2CCOCC2)n1
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3C[C@H]4OCCO[C@@H]4C3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCNCC3)nc(N3CCOCC3)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3CCOCC3)nc(N3C4CCC3CNC4)n2)cc1)Nc1ccc2c(c1)COC2=O
O=C(Nc1ccc(-c2nc(N3C4CCC3COC4)nc(N3C4CCC3COC4)n2)cc1)Nc1ccc2c(c1)COC2=O
C[C@H]1COCCN1c1nc(-c2ccc(NC(=O)Nc3ccc4c(c3)COC4=O)cc2)nc(N2C3CCC2COC3)n1
C=C1C(=O)OCC1C(=O)N1Cc2cc3ccccc3nc2C1
Cn1c(=O)n(C(C)(C)C#N)c2c3cc(-c4cnc5ccccc5c4)ccc3ncc21
Nc1ncc(-c2nc(-c3ccc(CN4CCOCC4)s3)nc(N3CCOCC3)n2)cn1
CS(=O)(=O)N1CCN(Cc2ccc(-c3nc(-c4cnc(N)nc4)nc(N4CCOCC4)n3)s2)CC1
CNC(=O)Nc1ncc(-c2nc(-c3ccc(CN4CCN(S(C)(=O)=O)CC4)s3)nc(N3CCOCC3)n2)cn1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]nc(-c3ccccc3)c2c1
O=[N+]([O-])c1cccc(-c2n[nH]c3ncc(-c4cnc(Cl)c(NS(=O)(=O)c5ccccc5)c4)cc23)c1
Nc1cccc(-c2n[nH]c3ncc(-c4cnc(Cl)c(NS(=O)(=O)c5ccccc5)c4)cc23)c1
CN(C)c1cccc(-c2n[nH]c3ncc(-c4cnc(Cl)c(NS(=O)(=O)c5ccccc5)c4)cc23)c1
CN1CCN(Cc2cccc(-c3n[nH]c4ncc(-c5cnc(Cl)c(NS(=O)(=O)c6ccccc6)c5)cc34)c2)CC1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4cccc(CN5CCOCC5)c4)c3c2)cnc1Cl)c1ccccc1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4ccc(CN5CCOCC5)cc4)c3c2)cnc1Cl)c1ccccc1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]nc(-c3ccncc3)c2c1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4ccc(N5CCCC5)nc4)c3c2)cnc1Cl)c1ccccc1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4ccc(N5CCCCC5)nc4)c3c2)cnc1Cl)c1ccccc1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4ccc(N5CCOCC5)nc4)c3c2)cnc1Cl)c1ccccc1
O=S(=O)(Nc1cc(-c2cnc3[nH]nc(-c4ccncc4)c3c2)cnc1Cl)c1ccc(F)cc1
Clc1ncc(cc1NS(=O)(=O)c1ccccc1)-c1cnc2[nH]ncc2c1
Nc1nc2cc(-c3ccc4ncc(N5C[C@@H]6OCCO[C@@H]6C5)nc4c3)ccc2o1
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
Nc1nccn2c1c(-c1cc3cccc(Cl)c3[nH]1)nc2[C@H]1CC[C@H](C(=O)O)CC1
CCOc1cc(ccc1Nc2ncc3c(n2)N(c4ccccc4C(=O)N3C)C)N5CCC(CC5)O
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1
CC1=CN2C(=O)C=C(N=C2C(=C1)[C@@H](C)Nc3ccccc3C(=O)O)N4CCOCC4
COc1cc(ccc1Nc1nc2ccc(cn2n1)-c1ccc(NC(=O)[C@H](C)c2ccc(F)cc2)cc1)S(C)(=O)=O |r|
[H][C@@]12CC[C@@H](C)[C@@](O)(O1)C(=O)C(=O)N1CCCC[C@@]1([H])C(=O)O[C@@]([H])(CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C2)OC)[C@H](C)C[C@@H]1CC[C@@H](O)[C@@H](C1)OC |r,c:32,51,t:47,49|