2730 SMILES Strings for Oxysterols receptor LXR-beta

Compound Name
SMILES String
c1ccc(cc1)C(C[N@](CCCOc2cccc(c2)CC(=O)O)Cc3cccc(c3Cl)C(F)(F)F)c4ccccc4
COc1cccc(C2SC(=NN2C(=O)c2c(F)cc(F)cc2F)c2ccc(Cl)cc2)c1OC |c:9|
COc1cccc([C@H]2SC(=NN2C(=O)c2c(F)cc(F)cc2F)c2ccc(Cl)cc2)c1OC |r,c:9|
COc1cccc(C2SC(=NN2C(=O)c2c(F)cc(F)cc2F)c2ccc(F)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2c(F)cc(F)cc2F)c2ccc(C)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2c(F)cc(F)cc2F)c2ccc(Cl)c(Cl)c2)c1OC |c:9|
COc1ccccc1C1SC(=NN1C(=O)c1c(F)cc(F)cc1F)c1ccc(Cl)cc1 |c:11|
COc1cccc(c1)C1SC(=NN1C(=O)c1c(F)cc(F)cc1F)c1ccc(Cl)cc1 |c:11|
COc1cc(F)ccc1C1SC(=NN1C(=O)c1c(F)cc(F)cc1F)c1ccc(F)cc1 |c:12|
Fc1cc(F)c(C(=O)N2N=C(SC2c2ccccc2OC(F)(F)F)c2ccc(Cl)cc2)c(F)c1 |c:9|
FC(F)Oc1ccccc1C1SC(=NN1C(=O)c1c(F)cc(F)cc1F)c1ccc(F)cc1 |c:13|
Fc1cc(F)c(C(=O)N2N=C(SC2c2cccc3OC(F)(F)Oc23)c2ccc(Cl)cc2)c(F)c1 |c:9|
COc1ncccc1C1SC(=NN1C(=O)c1c(F)cc(F)cc1F)c1ccc(F)cc1 |c:11|
COc1ccccc1C1(C)SC(=NN1C(=O)c1c(F)cc(F)cc1F)c1ccc(F)cc1 |c:12|
COc1cccc(C2SC(=NN2C(=O)c2ccccc2F)c2ccc(Cl)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2ccc(F)cc2F)c2ccc(Cl)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2c(F)ccc(F)c2F)c2ccc(F)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2cc(F)c(F)cc2F)c2ccc(F)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2cccc(F)c2)c2ccc(F)c(F)c2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2cc(F)cc(F)c2)c2ccc(F)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2cccc(Cl)c2)c2ccc(F)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2cc(F)ccc2C)c2ccc(F)cc2)c1OC |c:9|
COc1cc(F)c(C(=O)N2N=C(SC2c2cccc(OC)c2OC)c2ccc(F)cc2)c(F)c1 |c:10|
COc1cccc(C2SC(=NN2C(=O)c2c(F)cc(Br)cc2F)c2ccc(F)cc2)c1OC |c:9|
COc1cccc(C2SC(=NN2C(=O)c2cc(F)c(F)c(OC)c2F)c2ccc(F)cc2)c1OC |c:9|
COc1cccc([C@@H]2SC(=NN2C(=O)c2c(F)cc(F)cc2F)c2ccc(Cl)cc2)c1OC |r,c:9|
c1ccc(cc1)S(=O)(=O)[N@@](CC(F)(F)F)c2ccc(cc2)C(C(F)(F)F)(C(F)(F)F)O
COc1ccc(cc1)NC2=C(C(=O)N(C2=O)Cc3ccccc3)c4ccccc4
O=C1N(Cc2ccccc2)C(=O)C(=C1Nc1ccccc1)c1ccccc1 |c:13|
Clc1ccc(NC2=C(C(=O)N(Cc3ccccc3)C2=O)c2ccccc2)cc1 |t:6|
CCN1C(=O)C(Nc2ccc(OC)cc2)=C(C1=O)c1ccccc1 |c:15|
COc1ccc(cc1)N=C1C(C(=O)N(C1=O)c1ccccc1)c1ccccc1 |w:8.8|
COc1ccc(NC2=C(C(=O)N(C)C2=O)c2ccccc2)cc1 |t:7|
CCN1C(=O)C(Nc2ccccc2)=C(C1=O)c1ccccc1 |c:13|
CCN1C(=O)C(Nc2ccc(Cl)cc2)=C(C1=O)c1ccccc1 |c:14|
CN1C(=O)C(Nc2ccccc2)=C(C1=O)c1ccccc1 |c:12|
C1[C@@H]([C@H]([C@@H]([C@H](N1)CO)O)O)O
c1cc(ccc1C2=COc3cc(cc(c3C2=O)O)O)O
O=C1N(C(=O)c2ccccc12)c1ccccc1CCc1ccccc1
CCCCCCc1ccccc1N1C(=O)c2ccccc2C1=O
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccccc2C1=S
Oc1ccc-2c(CCc3ccc(Oc4cc(CCc5ccc-2c(O)c5)ccc4O)cc3)c1
COc1ccc-2c(CCc3ccc(Oc4cc(CCc5ccc-2c(OC)c5)ccc4OC)cc3)c1
COc1ccc2CCc3ccc(c(OC)c3)-c3ccccc3CCc3ccc(Oc1c2)cc3
COc1ccc-2c(CCc3ccc(Oc4cc(CCc5ccc-2cc5)ccc4OC)cc3)c1
COc1ccc-2c(CCc3ccc(Oc4cccc(CCc5ccc-2c(OC)c5)c4)cc3)c1
COc1ccc2CCc3ccc(cc3)-c3ccccc3CCc3ccc(Oc1c2)cc3
COc1cc2CCc3cccc(Oc4ccc(CCc5ccccc5-c1cc2)cc4)c3
Oc1ccc2CCc3ccc(c(O)c3)-c3ccccc3CCc3ccc(Oc1c2)cc3
Oc1ccc-2c(CCc3ccc(Oc4cc(CCc5ccc-2cc5)ccc4O)cc3)c1
Oc1ccc-2c(CCc3ccc(Oc4cccc(CCc5ccc-2c(O)c5)c4)cc3)c1
Oc1ccc2CCc3ccc(cc3)-c3ccccc3CCc3ccc(Oc1c2)cc3
Oc1cc2CCc3cccc(Oc4ccc(CCc5ccccc5-c1cc2)cc4)c3
C1Cc2cccc(Oc3ccc(CCc4ccccc4-c4ccc1cc4)cc3)c2
Cc1cc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)[nH]n1
COC(=O)c1cc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)no1
FC(F)(F)c1cccc(CN(CCCOc2n[nH]c3ccccc23)CC(c2ccccc2)c2ccccc2)c1Cl
Cc1cc(C)c2c(OCCCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)n[nH]c2n1
Cc1cc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)n2ncnc2n1
COC(=O)Cc1c[nH]c2ccc(OCCCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)cc12
FC(F)(F)c1cccc(CN(CCCOc2ccc3[nH]ccc3c2)CC(c2ccccc2)c2ccccc2)c1Cl
FC(F)(F)c1cccc(CN(CCCOc2cccc3[nH]ccc23)CC(c2ccccc2)c2ccccc2)c1Cl
Cn1ccc2c(OCCCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)cccc12
CS(=O)(=O)n1ccc2c(OCCCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)cccc12
c1ccc(cc1)C(C[N@](CCCOc2cccc3c2ccn3CC(=O)O)Cc4cccc(c4Cl)C(F)(F)F)c5ccccc5
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1cccc(CCNS(=O)(=O)c2ccccc2)c1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNS(=O)(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CNS(=O)(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCCNS(=O)(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(NS(=O)(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNS(=O)(=O)c2cccs2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNS(=O)(=O)c2ccc(s2)-c2ccccn2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CNC(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCNC(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCCNC(=O)c2ccccc2)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CN)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CC#N)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC#N)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCCO)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(OCCO)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(O)=O)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(N)=O)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(\C=C\C(N)=O)cc1
CNC(=O)CCc1ccc(cc1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)CNC(=O)CCc1ccc(cc1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc(CCC(=O)Nc2ccccc2)cc1
O=C(c1ccccc1)n1c(cc2ccccc12)-c1ccc(CCC#N)cc1
O=C(NCCc1ccc(cc1)-c1cc2ccccc2n1C(=O)c1ccccc1)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2c(O)cccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2c(OCc3ccccc3)cccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2cc(O)ccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2cc(OCc3ccccc3)ccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2cc(F)ccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2cc(ccc12)C#N)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
COc1ccc2n(C(=O)OC(C)(C)C)c(cc2c1)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
Cc1ccc2n(C(=O)OC(C)(C)C)c(cc2c1)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccc(OCc3ccccc3)cc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
COc1ccc2cc(-c3ccc4CC(Cc4c3)NS(=O)(=O)c3ccccc3)n(C(=O)OC(C)(C)C)c2c1
Cc1ccc2cc(-c3ccc4CC(Cc4c3)NS(=O)(=O)c3ccccc3)n(C(=O)OC(C)(C)C)c2c1
CC(C)(C)OC(=O)n1c(cc2ccc(O)cc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2C[C@H](Cc2c1)NS(=O)(=O)c1ccccc1 |r|
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2C[C@@H](Cc2c1)NS(=O)(=O)c1ccccc1 |r|
O=S(=O)(NC1Cc2ccc(cc2C1)-c1cc2ccccc2[nH]1)c1ccccc1
COC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CCOC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)CCOC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)COC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CCCCC(C)COC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
O=S(=O)(NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1S(=O)(=O)c1ccccc1)c1ccccc1
O=C(CC1CC1)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
O=C(C1CCCC1)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CCCCCC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)CC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
Cn1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
CC(C)(C)OC(=O)Cn1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1
O=S(=O)(NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1CCCOCc1ccccc1)c1ccccc1
O=S(=O)(NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1Cc1ccccc1)c1ccccc1
COc1ccc(Cn2c(cc3ccccc23)-c2ccc3CC(Cc3c2)NS(=O)(=O)c2ccccc2)cc1
O=S(=O)(NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1CCc1ccccc1)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccc(Cl)cc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccc(F)cc1
CCc1ccc(cc1)S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
Cc1ccc(cc1)S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccc(cc1)C(F)(F)F
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1cccc(Cl)c1
Cc1cccc(c1)S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
COc1cccc(c1)S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1cccc(c1)C#N
COC(=O)c1ccccc1S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1C(O)=O
Cc1ccccc1S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
COc1ccccc1S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1C(F)(F)F
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1C#N
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1F
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1c(F)cccc1F
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccccc1Cl
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1cccs1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccc(s1)-c1ccon1
Cc1noc(C)c1S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(=O)(=O)Cc1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NS(C)(=O)=O
CCS(=O)(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NC(=O)c1ccccc1
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NC(=O)c1ccccc1F
COc1ccccc1C(=O)NC1Cc2ccc(cc2C1)-c1cc2ccccc2n1C(=O)OC(C)(C)C
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NC(=O)c1ccccc1O
CC(C)(C)OC(=O)n1c(cc2ccccc12)-c1ccc2CC(Cc2c1)NC(=O)Nc1ccccc1
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](C)(C(=O)OC)S(=O)(=O)c1ccccc1 |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](C)(C(=O)OC)S(=O)(=O)c1ccc(F)cc1 |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](C)(C(=O)OC)S(=O)(=O)c1ccc(Cl)c(Cl)c1 |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](C)(C(=O)OC)S(=O)(=O)c1cccc(Cl)c1 |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](C)(C(=O)OC)S(=O)(=O)c1ccccc1Cl |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](C)(C(=O)OC)S(=O)(=O)c1ccccc1OC |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccc(Cl)c1 |r|
[H][C@]1(CCc2c(C1)[nH]c1ccc(Cl)cc21)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccc(F)c1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccc(OC)c1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccc(Cl)c1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccc(F)c1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccc(Br)c1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1cccnc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1ccccn1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)nc3c2C1)[C@@](F)(C(=O)OC)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)NC)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(C(=O)N(C)C)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(c1nnco1)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(c1nnc(C)o1)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(c1nnc(o1)C1CC1)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(c1nnc(o1)N(C)C)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(c1nc(C)no1)S(=O)(=O)c1ccccc1 |r|
[H][C@@]1(Cc2[nH]c3ccc(Cl)cc3c2C1)[C@@](F)(c1nc(no1)N(C)C)S(=O)(=O)c1ccccc1 |r|
CC(C)(O)C1OC2CCC3(C)C4(C)C(Cc5c4[nH]c4ccccc54)CCC3(O)C2=CC1=O |c:33|
[H][C@](O)(CCC(C)C)[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC=C4C[C@@]([H])(O)CC[C@]4(C)[C@@]3([H])CC[C@]12C |r,t:19|
CN1\C(Sc2ccccc12)=C/C(=O)c1cccs1
N(c1nc(cs1)-c1cccs1)c1ccccn1
Cn1c(nc2cc3ccccc3cc12)-c1ccco1
Clc1cccc(c1)-c1nc(no1)-c1ccccn1
Cc1ccnc(NC(=O)Nc2cccc(F)c2)c1
O=C1C(C(=O)c2ccccc12)c1ccc2ccccc2n1
COc1ccc2c(c1)occ(-c1nc(C)cs1)c2=O
O=C(c1cccs1)c1ccc(s1)-c1cccs1
Nc1c(Br)cc2oc(nc2c1Br)-c1ccccc1
Cc1ccsc1C(=O)OCc1csc(n1)-c1ccccc1
Nn1c(nc2sc3CCCCc3c2c1=O)-c1cccs1
Cc1cc(C(=O)Cn2nnc3ccccc3c2=O)c(C)n1Cc1cccs1
Cn1cccc1C(=O)OCc1csc(n1)-c1ccccc1
COc1ccc(cc1)-c1cc(=O)c2ccccc2s1
Cc1ccc(cc1)N=C1Nc2ccccc2CS1 |w:7.7|
OP1(=O)C=C(OC(=C1)c1ccccc1)c1ccccc1 |c:3,6|
[#8]-c1ccccc1-[#7]\[#6]=[#6]-1/[#6](=O)-c2ccccc2-[#6]-1=O
O=C1C(C(=O)c2ccccc12)c1nccc2ccccc12
c1ccc(nc1)-c1noc(n1)-c1cccc2ccccc12
Fc1ccc(cc1)-c1nc2-c3ccccc3Cn2n1
COc1cccc(c1)-c1nc(no1)-c1ccccc1
Fc1ccc(cc1Cl)N=CCC(=O)c1ccco1 |w:8.8|
COc1ccc(cc1)-c1cn2c3CCCCc3sc2n1
c1ccc2oc(nc2c1)-c1ccc2ccccc2n1
CCOC(=O)c1c(C)nc(nc1N)-c1ccccc1
Cc1ccc(cc1)-c1nnc(Nc2ccccc2)[nH]1
Fc1ccccc1-c1nc(no1)-c1ccccc1
COc1ccccc1-c1nc(no1)-c1cccc(C)c1
Cc1sc(NC(=O)c2ccc(Cl)s2)c(C(N)=O)c1C
COc1ccc(cc1)-c1noc(n1)-c1ccccc1F
COc1ccccc1-c1nc(no1)-c1ccccn1
COc1cccc(c1)-c1nc2cc(C)ccc2o1
Cc1ccc(cc1)-c1noc(n1)-c1cccs1
O=[#6]-1\[#6](=[#6]\[#7]-[#6]-c2ccco2)-[#6](=O)-c2ccccc-12
Brc1ccc(o1)-c1nc(no1)-c1ccccn1
Cc1ccc(cc1)-c1nc2cc(C)ccc2o1
Cc1cc(C)c2c(N)c(sc2n1)C(=O)Nc1nccs1
Clc1ccc(NC(=O)COc2ccccc2Cl)nc1
COc1ccccc1Nc1nc(cs1)-c1cccs1
Cc1ccc(cc1)-c1noc(n1)-c1ccccc1Br
Oc1cccc(c1)N=CCC(=O)c1ccccc1 |w:7.7|
COc1ccc(cc1)-c1cn2ccc3ccccc3c2n1
O=C1C(C(=O)c2ccccc12)c1ccnc2ccccc12
Oc1ccc2ccccc2c1CNc1cnc2ccccc2c1
Cc1ccc2ccc(nc2c1)C1C(=O)c2ccccc2C1=O
Cc1ccc(cc1)-n1nc2cc(C)c(N)cc2n1
Cc1cccc(Nc2nc(cs2)-c2cccs2)n1
Cc1ccc2nc([nH]c2c1)-c1sc2nc(C)cc(C)c2c1N
Cc1ccc2nc([nH]c2c1)-c1sc2nc(C)ccc2c1N
Cc1ccc(cc1)-c1nc2-c3ccccc3Cn2n1
Clc1ccc(cc1)-c1nc2-c3ccccc3Cn2n1
COc1ccccc1-c1nc(no1)-c1ccc(Br)o1
Brc1ccc(cc1)-n1ncc2ccccc2c1=O
Clc1ccc(cc1)-n1ncc2ccccc2c1=O
Cc1ccc(CSc2nc3ccncc3[nH]2)cc1
COc1cc(ccc1N=CCC(=O)c1cccs1)[N+]([O-])=O |w:8.8|
O=[#6]-1\[#6](=[#6]\[#7]-c2ccccc2)-[#6](=O)-c2ccccc-12
Cc1ccc(cc1)-c1nc(N=NCc2ccncc2)c2ccccc2n1 |w:10.10|
Clc1ccccc1NN=c1c(=O)c2ccccc2c1=O |(11.95,-3.35,;12.72,-2.02,;14.26,-2.02,;15.03,-.68,;14.26,.65,;12.72,.65,;11.95,-.68,;10.41,-.68,;9.64,.65,;8.1,.65,;7.2,1.89,;7.68,3.35,;5.75,1.42,;4.41,2.19,;3.08,1.42,;3.08,-.12,;4.41,-.89,;5.75,-.12,;7.2,-.59,;7.68,-2.05,)|
CCc1ccc(NC(=O)c2cnn3ccccc23)cc1
[O-][N+](=O)c1cccc(c1)N=CCC(=O)c1cccs1 |w:9.9|
NC(=S)NN=Cc1ccc(o1)-c1ccc(Cl)c(Cl)c1 |w:4.3|
CN1\C(Sc2ccccc12)=C\C(=O)c1cccs1
CC(=Nc1ccc(C)cc1)c1sc2ccccc2c1O |w:2.2|
Cc1cc(N2CCOCC2)n2ncc(-c3ccccc3)c2n1
COc1ccc(cc1)-c1cc(n[nH]1)-c1ccccc1O
Cc1cc(NCCCn2ccnc2)n2ncc(-c3ccc(Cl)cc3)c2n1
Cc1ccc(C)c(NC(=O)c2ccc3ccccc3n2)c1
C1COc2cc(Nc3nc(cs3)-c3ccccc3)ccc2O1
COc1ccc(cc1)C(=O)Nc1nnc(s1)-c1cccs1
COc1ccc(Nc2nc(cs2)-c2ccccc2)cc1
Cc1ccc2nc(CSc3nc(C)ccc3C#N)[nH]c2c1
CC(N=Nc1nc2CCCCc2s1)c1ccccc1 |w:3.3|
Cc1[nH]n(C(N)=S)c(=O)c1N=Nc1ccc(C)cc1C |w:10.10|
Cc1ccc(CN=C2Nc3ccccc3CS2)cc1 |w:6.5|
Cn1cc(Cl)c(n1)C(=O)Nc1nc2ccccc2s1
COc1ccc(C(N)=S)c(OC)c1
[O-][N+](=O)c1ccccc1N=[NH+]Cc1c[n-]c2ccccc12 |w:10.11|
Cc1ccc2nc(CSc3nc(C)cc(C)c3C#N)[nH]c2c1
Fc1ccc(cc1)-c1cn2cc(cc(Cl)c2n1)C(F)(F)F
Clc1ccc2nc(cn2c1)-c1ccc(Br)s1
COc1ccc(cc1)C1=c2cc(OC)ccc2=NC(=NN1)c1cccs1 |c:9,18,20|
CSc1ccccc1-c1nnc(o1)-c1ccccc1
CSc1nnc(o1)-c1cc2CCc3ccccc3-c2s1
Clc1ccc(\C=C\c2nc3ccccc3[nH]2)c(Cl)c1
Cc1ccccc1-c1cc(on1)-c1ccccc1O
Oc1ccccc1-c1cc(no1)-c1ccccc1
Fc1cccc(c1)N=CCC(=O)c1cccs1 |w:7.7|
Fc1ccc(cc1)N=CCC(=O)c1cccs1 |w:7.7|
NC(=NOC(=O)c1ccccc1Cl)c1ccccc1 |w:2.2|
Cc1ccc(NC(=O)c2sc3ccccc3c2Cl)nc1
NC(=NOC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 |w:2.2|
Cc1cc(C)c2c(N)c3cccc(C)c3nc2n1
Cc1ccc(cc1Cl)N=CC(C(=O)c1ccco1)C(=O)C(F)(F)F |w:8.8|
CCOC(=O)c1sc2nc(ccc2c1N)-c1ccccc1
NNc1nc(nc2sc3CCCCc3c12)-c1ccccc1
Nc1nc(nc2sc3CCCCc3c12)-c1ccccc1
Cc1ccnc(NC(=S)NC(=O)c2cccs2)c1
NC(=O)c1ccsc1NC(=O)c1ccc2CCCCc2c1
Cn1c2ccccc2nc(\C=C\c2ccccc2)c1=O
Fc1cccc(F)c1\C=C\c1ccc2ccccc2n1
O=C(N\N=C\c1cn(nc1-c1cc2ccccc2o1)-c1ccccc1)c1cccnc1
O=C(\C=C\c1cccs1)N1CCc2ccccc12
c1cc2c(cc1F)sc(c2Cl)C(=O)NC3=NCCS3
CC(C)(C)NC(=O)NC(=O)COc1ccc(Br)cc1Br
CC(N=Nc1nc2ccccc2s1)c1cccs1 |w:3.3|
CN1C(=O)\C(=N/NC(=O)c2ccoc2C)c2ccccc12
Clc1ccccc1C=NNC1=Nc2cccc3cccc1c23 |w:8.9,t:11|
N(N=Cc1ccccc1)C1=Nc2cccc3cccc1c23 |w:1.0,t:10|
Cc1cnc(NC(=O)c2sc3ccccc3c2Cl)s1
OC(=O)c1cccc(c1)N=NCc1cccs1 |w:9.9|
CSC1=NC(=O)C(N1)=Cc1c[nH]c2ccccc12 |w:8.9,t:2|
Cc1[nH]n(C(N)=S)c(=O)c1N=Nc1ccc(C)c(C)c1 |w:11.12|
Cc1cc(-c2ccccc2)n2ncc(-c3ccccc3)c2n1
Cc1ccc(cc1)C1=Nc2ccccc2N=C(C1)C(Cl)Cl |c:17,t:8|
Oc1ccccc1C=Cc1noc(n1)-c1ccccc1O |w:8.9|
Cc1csc(NC(=O)Nc2ccccc2[N+]([O-])=O)n1
Brc1ccc(NC(=S)NC(=O)c2cccs2)nc1
Cc1nc(NC(=O)c2cccs2)ccc1Br
COc1cccc(c1)-c1nc(no1)-c1cccs1
Cc1cc(ccc1F)N=CCC(=O)c1cccs1 |w:8.8|
Oc1cccc(CN=Nc2cccc3cccnc23)c1 |w:8.8|
Cc1ccc(cc1)-c1cc2nc(C)cc(C)n2n1
Oc1cccc(c1)-c1nc2cc(ccc2o1)[N+]([O-])=O
Fc1cccc2sc(C(=O)Nc3ccccn3)c(Cl)c12
O=C(Nc1ccccc1)Nc1cccc2nsnc12
CC(C)c1ccc(cc1)-n1nc2ccc(N)cc2n1
Cc1ccc2c(cc3[nH]c4ccccc4nc23)c1
Cc1ccsc1CN=Nc1cccc(c1)C(O)=O |w:8.9|
CCOC(=O)c1s\c(=N/C(=O)c2cccs2)n(C)c1C
CCOC(=O)c1s\c(=N/C(=O)c2ccc(Cl)s2)n(C)c1C
Nc1nn(cc1-c1ccc(Cl)cc1)-c1cccc(F)n1
CC(C)c1ccc(cc1)-n1cnn(-c2ncccc2[N+]([O-])=O)c1=O
Cc1nn(-c2ccc(Cl)cc2)c(=O)c2ccccc12
Cc1c(-c2ccccn2)c(=O)[nH]n1-c1ccc(F)cc1
Cc1ccc(cc1)-c1nc2ccsc2c(=O)[nH]1
Cc1cccc(c1)-c1cc2c(N=O)c3ccccc3c2n[nH]1
O=C(Nc1nc2ccccc2s1)c1ccccc1
Cc1ccc2n(C)\c(=N\C(=O)c3cccs3)sc2c1
CC(C)NC1=NN=C(CS1)c1cccs1 |c:6,t:4|
Fc1cccc(F)c1CN=Nc1ccccn1 |w:10.11|
[O-][N+](=O)c1ccccc1-c1ccc(o1)C(=S)N1CCCC1
COc1ccc(cc1)C(=O)\N=c1/sc2ccccc2n1C
Fc1cccc(Cl)c1CN=Nc1ccccn1 |w:10.11|
N(N=Cc1ccccn1)C1=Nc2cccc3cccc1c23 |w:1.0,t:10|
Cc1csc(SCC(=O)Nc2sccc2C#N)n1
Cc1ccc(cc1)\N=N\c1cc(C)ccc1N
COc1ccc(-c2csc(n2)-c2ccccc2)c(OC)c1
Clc1nc2sccn2c1C(=O)N(C(=O)c1c(Cl)nc2sccn12)c1ccc(Cl)cn1
CN=c1scc(-c2ccccc2F)n1N=Cc1ccc(O)c(O)c1O |w:14.15,1.0|
CC(=O)Nc1ccc(CN=Nc2nc3ccccc3s2)cc1 |w:10.10|
[O-][N+](=O)c1cccc(c1)-c1nc(no1)-c1ccccn1
Cn1c2ccccc2n(CC(=O)c2ccccc2)c1=N
Nc1c2CCc3ccccc3-c2nc2sc3CCCCc3c12
Oc1c(N=Nc2ccccc2)sc2ccccc12 |w:3.2|
c1ccc(nc1)-c1nnc(s1)-c1ccccn1
Cc1ccc(cc1\N=N\c1cc(C)c(N)cc1N)\N=N\c1cc(C)c(N)cc1N
COc1ccc(cc1)C(=O)CC=Nc1cc(C)ccn1 |w:12.13|
NC(SCC=C)=NN=Cc1c(O)ccc2ccccc12 |w:7.6,1.0|
Cc1ccc(NN=C(C#N)C(=N)N2CCCCC2)cc1 |w:6.5|
Cc1cc(C=C2SC(S)=NC2=O)c(C)n1-c1ccccc1 |w:4.3,c:8|
OC(=O)c1cccc(NC(=O)C(=O)Nc2ccc(cc2)[N+]([O-])=O)c1
c1cc(sc1-c1ccccn1)-c1ccccn1
C(N=Nc1ccccc1)c1nc2ccccc2s1 |w:2.2|
C1C2CCc3ccccc3C2=NN1c1ccccc1 |c:12|
CCCC#Cc1ccc-2c(COc3n-2nc2ccccc32)c1
c1ccc(cc1)-c1cnc(nn1)-c1ccccc1
Cc1ccccc1NNC1=c2ccccc2=NC1=O |c:10,17|
CC(=O)n1nc(cc1-c1ccccc1)-c1ccccc1
CSc1ccc(cc1)C1=NNC(S1)c1ccccc1 |t:9|
c1cc2cccccc2c1\N=N\c1ccccc1
Cc1ccc(O)c(c1)-c1cc(no1)-c1ccc(F)cc1
CC(C)N(CCO)Cc1nc(oc1C)-c1ccc(cc1)-c1ccccc1
Cc1ccsc1C=NN=Cc1sccc1C |w:7.8,9.10|
Cc1csc(N=NCc2ccccc2F)n1 |w:5.4|
Cn1c2ccccc2n(CC(=O)c2ccc(Br)cc2)c1=N
CC(=NN=C(C)c1cccs1)c1cccs1 |w:2.2,4.4|
O=c1oc2ccccc2cc1-c1nc2ccccc2[nH]1
Cc1cc(C)nc(Nc2nc(cs2)-c2ccccc2)n1
Cc1ccc(-c2cc([nH]n2)-c2ccc(F)cc2)c(O)c1
CC([NH+]=Nc1ccccc1[N+]([O-])=O)[c-]1ccccc1=O |w:2.1|
Cc1ccc(Nc2nc(cs2)-c2ccccc2)nc1
NC(=O)c1c(NC(=O)c2ccc(F)cc2)sc2CCCc12
NC(=O)c1c(NC(=O)c2ccccc2)sc2CCCCc12
NC(=O)c1c(NC(=O)c2ccccc2)sc2CCCc12
N(c1nc(cs1)-c1ccccc1)c1ccccn1
Cc1cccc(Nc2nc(cs2)-c2ccccc2)n1
[O-][N+](=O)c1cc(ccc1Cl)C(=O)Nc1ccc(Nc2ccccc2)cc1
CCc1ccc(cc1)-n1nc2cc(C)c(N)cc2n1
Cc1[nH]n(C(N)=S)c(=O)c1N=Nc1ccc(Br)cc1 |w:10.10|
Cc1cc2ncc(nc2cc1C)-c1cccs1
Cc1nn(-c2ccc(Br)cc2)c(=O)c2ccccc12
Cc1ccccc1C(=O)ON=C(N)c1ccccc1 |w:10.10|
COc1ccccc1C(=O)NC(=O)Nc1cccc(Cl)c1
Cc1ccccc1-c1nc(no1)-c1ccc(Br)o1
Cc1ccc(cc1C)-c1cnc2ccccc2n1
Cc1cccc2=C(NNc3ccccc3)C(=O)N=c12 |c:5,t:18|
Fc1ccccc1-c1nc(no1)-c1ccc(Br)o1
Cc1ccc(Nc2nc(cs2)-c2cccnc2)cc1C
COc1cccc(NC(=O)n2ncc3c(C)cccc23)c1
Fc1cccc(Cl)c1\C=C\c1cnc2ccccc2n1
CN(C)c1ccc(cc1)\N=N\c1ccccc1Br
CCOC(=O)C(=NNc1ncnc2ccccc12)c1ccc(C)cc1 |w:6.6|
Nc1cccc2C(=O)N(CCOc3ccccc3F)C(=O)c12
Oc1ccccc1C(=O)Nc1ccc2ccccc2c1
Brc1ccccc1C1NC(=NO1)c1ccccc1 |c:10|
Nc1nc2c(nnn2c2ccccc12)-c1ccc(Br)cc1
Fc1ccccc1NC(=O)Nc1nc2ccccc2[nH]1
Clc1ccccc1-c1cc(no1)C(=O)N1CCCC1
CC1CCCCN1C(=O)CSc1nnc(o1)-c1ccccc1O
COc1ccccc1C(=O)NC(=S)Nc1cccnc1Cl
CCc1ccc(NC(=O)Nc2ccsc2C(=O)OC)cc1
Cc1ccnc(NC(=O)Cc2ccc(cc2)-c2ccccc2)c1
COc1ccc2oc(C(=O)Nc3ccccn3)c(C)c2c1
COc1c(Cl)scc1C(=O)Nc1nnc(s1)C1CC1
Cc1ccc(cc1)-c1cc(no1)-c1ccccc1
Cc1csc(NC(=O)c2oc3ccccc3c2C)n1
OC[C@H]1O[C@H](C[C@@H]1O)n1cc(Br)c(=O)[nH]c1=O |r|
COc1ccc(cc1)-c1cc2ccccc2cn1
CN(C)c1ccc(cc1)-c1cc2ccccc2c(=O)o1
O=C(CSc1nncs1)Nc1sccc1C#N
[H][C@]12COc3ccccc3[C@]1([H])N1C(=O)c3cc(Cl)ccc3NC(=O)[C@@]1(C)[C@H]2c1ccccc1
COc1ccc(cc1)-n1nc2cc(C)c(N)c(Br)c2n1
CC(C)c1ccc(CN=Nc2ccc(cn2)[N+]([O-])=O)cc1 |w:8.7|
O=C1C(Cc2ccccc12)=C1CCc2ccccc12
Clc1ccc(C=Cc2ccccn2)c(Cl)c1
NC(=O)c1c(NC(=O)c2cc3ccccc3o2)sc2CCCc12
CNc1ccc(C=C2C=Cc3ccccc23)cc1 |c:8|
Cc1cc2NP(=S)(Nc2cc1C)c1ccccc1
Fc1ccc(cc1)-c1nnc(o1)-c1ccc2ccccc2c1
Cc1ccc(cc1)-c1nnc(o1)-c1cccc2ccccc12
C(=Cc1nccc2ccccc12)c1c[nH]c2ccccc12
Cc1cc(ccc1N)-c1nc2ccccc2s1
Oc1cccc(c1)-c1nnc(nn1)-c1cccc(O)c1
C1C2COc3ccccc3C2=NN1c1ccccc1 |c:12|
Clc1ccccc1N=NCc1ccccn1 |w:7.7|
Nc1ccccc1-n1nc2ccc3ccccc3c2n1
COc1cccc(c1)-c1nc2-c3ccccc3CCn2n1
C1Oc2cc3nn-4c(OCc5ccccc-45)c3cc2O1
CCCc1nc2c(C)cc(Br)cn2c1Cc1ccc(C)cc1
C1Oc2ccc(Nc3nc(cs3)-c3ccccc3)cc2O1
NC(=NC(=S)Nc1ccc2OCOc2c1)c1ccccc1 |w:2.2|
CC(C)(C)c1ccc(Nc2n[nH]c3ccccc23)cc1
COc1ccc(cc1)-c1cc2ccccc2c(=O)o1
CCOC(=O)c1cc(oc1C)-c1cccc(O)c1
CC(C)(C)NC(=O)C(c1cc2ccccc2o1)n1c(nc2ccccc12)-c1ccc(cc1)-c1ccccc1
Cc1ccc2nc(oc2c1)-c1ccccn1
Cn1c(SCc2ccccc2F)nc2cccnc12
C1CN(CCO1)c1ccc(cc1)-c1nnc(o1)-c1cccs1
Cn1c(NCc2c[nH]c3ccccc23)nc2ccccc12
CCOC(=O)CSc1nc(ccc1C#N)-c1ccncc1
CN1CCN(CC1)\C=N\c1sc2CCCCCc2c1C#N
O=c1[nH]cnc2cc(sc12)-c1ccccc1
COc1cccc(c1)-c1noc(n1)-c1cccs1
Cc1nn(c(N)c1Sc1ccc(F)cc1)-c1nc(C)cc(C)n1
Oc1ccccc1-c1cc([nH]n1)-c1ccc2OCCOc2c1
O=C(NCCCn1ccnc1)c1cc(on1)-c1cccs1
CCOC(=O)c1c(C)oc2c1cc(O)c1ccccc21
N(c1nc(cs1)-c1cccnc1)c1ccccn1
O=C(NCCc1ccccc1)c1cc(on1)-c1ccco1
CCOC(=O)c1cnc(SCc2ccccc2)nc1N
COc1ccccc1-c1noc(n1)-c1ccco1
Clc1ccc(Nc2nc(cs2)-c2cccs2)nc1
Clc1ccc(NC(=O)c2cc3ccccc3o2)nc1
Cc1cc(cs1)C(=O)NC1=NCCS1 |t:10|
COC(=O)C1C(C)Cc2[nH]c(C(=O)OC3CCCCC3)c(C)c2C1=O
CC1CCC(CC1)OC(=O)c1[nH]c2CCCC(=O)c2c1C |(16.57,-1.54,;15.03,-1.54,;14.26,-.21,;12.72,-.21,;11.95,-1.54,;12.72,-2.87,;14.26,-2.87,;10.41,-1.54,;9.64,-.21,;10.41,1.13,;8.1,-.21,;7.2,-1.45,;5.75,-.98,;4.41,-1.75,;3.08,-.98,;3.08,.56,;4.41,1.33,;4.41,2.87,;5.75,.56,;7.2,1.03,;7.68,2.5,)|
CCOC(=O)N1CCC(CC1)NC(=O)c1cc2ccccn2n1
Cc1nn(C(=O)c2cccs2)c(N)c1-c1ccccc1
CC(C)Oc1cc(O)c2c(c1)occ(-c1ccc(O)cc1)c2=O
CCOc1ccc2nc(NC(=O)Nc3cccs3)sc2c1
Cn1c(NC(=O)CCc2ccccc2)cc(=O)n(C)c1=O
CCS(=O)(=O)Nc1cc(ccc1C)-c1nc2cccnc2s1
Cn1c(NC(=O)CCC2CCCCC2)cc(=O)n(C)c1=O
CCCS(=O)(=O)NCc1cn2c(C)csc2n1
CN(C)c1ccc(Nc2nc(cs2)-c2cccnc2)cc1
Clc1cccc(c1)-c1nnc(o1)-c1ccccc1
[#6]-[#6]-[#8]-[#6](=O)-[#6](=[#6]/[#6]=[#6]-1/[#6]=[#6]-[#7](-[#6]-[#6]=[#6])-[#6]=[#6]-1)\C#N |c:9,15|
Cc1nc2sc(nn2c(=O)c1Br)-c1ccccc1
CCc1ccc2oc(nc2c1)-c1cccc(N)c1
CCOC(=O)c1cnc(SCCc2ccccc2)nc1N
Cc1ccc(cc1)C(N)=NOC(=O)c1ccco1 |w:9.10|
Cc1cccc(c1)C(N)=NOC(=O)c1ccco1 |w:9.10|
COc1cccc(c1)-c1nc2ccccc2s1
Cc1ccc(cc1C)N=CC(C#N)c1ccsc1 |w:8.8|
COc1ccccc1-c1noc(n1)-c1cccs1
Cc1cc(NC(=O)c2nn3cccnc3c2Cl)no1
Cc1nnc(SCC(=O)Nc2nsc(n2)-c2ccc(cc2)C(C)(C)C)s1
Clc1ccc(CSc2nc3ccncc3[nH]2)cc1
CC(=Nc1ccccc1)c1sc2ccccc2c1O |w:2.2|
CC(=Nc1cccc(C)c1)c1sc2ccccc2c1O |w:2.2|
CC(C)c1cc([nH]n1)C(=O)NN=C(C)c1cccs1 |w:11.11|
CCOC(=O)c1sc2nc3CC(C)(CC)OCc3cc2c1N
Cc1nc(N)sc1N=Nc1ccc(Br)cc1 |w:8.9|
Cc1cccc(NC(=O)c2ccc3ccccc3n2)c1C
O=C(CCCC(=O)N(CC(=O)NC1CCCC1)C1CCCC1)Nc1ccccn1
Nc1nc(Nc2ccc(Cl)cc2)nc2ccccc12
Cc1ccc(cc1)S(=O)(=O)NC(=NC(=S)Nc1ccccc1)c1ccccc1 |w:12.13|
O=c1n(ncc2ccccc12)-c1ccc2ccccc2c1
Cc1ccsc1C=NNC(=O)c1sccc1C |w:7.8|
[O-][N+](=O)c1cccnc1NCCNc1ncc(cc1Cl)C(F)(F)F
FC(F)(F)c1cc(Cl)c2nc(cn2c1)-c1ccccc1
Cc1cccc(c1)C(N)=NOC(=O)c1cccs1 |w:9.10|
CCNC(=S)NNC(=O)c1cc(nc2ccccc12)-c1ccc(OCC)cc1
C(Cc1ccccc1)Sc1nccn1-c1ccccc1
Clc1ccc(cc1)-c1ccc(o1)C(=S)N1CCCCC1
Nc1c2CCCCCc2nc2sc3CCCCc3c12
CCc1ccc(cc1)C1CC(=NN1S(C)(=O)=O)c1ccco1 |c:11|
O=C(NN=Cc1cccs1)c1[nH]nc2CCCc12 |w:3.2|
Cc1ccnc(NC(=O)\C=C\c2cccs2)c1
Cc1n[nH]c(Nc2cccc(C)c2)c1[N+]([O-])=O
Cc1c(csc1-c1ccccc1)C(=O)Nc1ccccc1
O=C1\C(Sc2ccc3ccccc3c12)=C/c1cccs1
Cc1ccc(cc1)C(N)=NOC(=O)c1cccs1 |w:9.10|
Cc1cc(O)n(c1O)-c1ccc(NCc2ccc(Cl)cc2)c(c1)[N+]([O-])=O
N=C1N(CC(=O)c2ccccc2)Cc2ccccc12
Clc1ccccc1Nc1nnc(s1)-c1ccncc1
CC1=CN2C(S1)=NC(=O)\C(=C/c1ccco1)C2=N |c:6,t:1|
Cc1ccc(\C=N\NC(=O)c2ccccn2)s1
Cc1ccc(\C=N\NC(=O)c2ccoc2C)s1
C(Sc1ccc(nn1)-c1cccs1)c1ccccc1
CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)Nc1ccc(cc1)-c1nc2ccc(C)cc2s1
COc1ccccc1C=NN=C(N)c1ccccn1 |w:9.10,11.12|
Cc1nn(c(C)c1Br)-c1nnc(NC2CCCCC2)nn1
Cc1ccc(\C=N\N=C\c2ccc(C)s2)s1
Cc1cc(C(=O)NC2CCCCC2)c(C)n1-c1ccc(F)cc1
COCCNc1nc(cs1)-c1cc2ccccc2o1
Fc1ccccc1SCn1nnc2ccccc2c1=O
Cc1nn(c(Cl)c1CN=Nc1ccc(Cl)c(c1)C(O)=O)-c1ccccc1 |w:9.10|
[O-][N+](=O)c1n[nH]c(C(=O)Nc2ccn(Cc3ccccc3)n2)c1Cl
Cc1cccc(C=Cc2nc3ccccc3c(=O)[nH]2)c1 |w:7.7|
Cc1ccn(n1)-c1cccc(n1)-n1ccc(C)n1
Nc1ncc(Br)cc1\N=C\c1ccccc1
CCC(=NNC(=O)c1ccoc1C)c1ccc(C)o1 |w:3.3|
Cc1scc(C(=O)N\N=C\c2ccsc2)c1C
Cc1ccc(Nc2ncccc2C(N)=O)cc1
Cc1ccc(Nc2ncccc2C(N)=O)cc1[N+]([O-])=O
O=C(\C=C\c1ccccc1)N1CCC(C1)c1ccccc1
Fc1ccc(cc1)-n1nnc(n1)-c1cccnc1Cl
Cc1cc(ccc1NS(=O)(=O)c1cccs1)-c1nc2cccnc2s1
CCn1c(O)c(C=Nc2ccccc2)sc1=S |w:7.7|
CC(N(C)C(=O)CCc1nnc(CCC2CCCCC2)o1)c1cccs1
COCC1CCN(Cc2nc(no2)-c2cccs2)C1
O=C(NCCCn1ccnc1)c1cc(on1)-c1ccccc1
Cc1ccc2oc(nc2c1)-c1cccc(N)c1
COCCNC(=O)C(=C\c1cc(C)n(c1C)-c1ccc(C)cc1)\C#N
Clc1ccc(OCCSc2ncccn2)c(Br)c1
COc1cccc(c1)-c1nc(no1)-c1ccc(Br)o1
Brc1ccc(o1)-c1noc(n1)-c1ccccc1
NC(=NOC(=O)c1cc(Br)ccc1Cl)c1ccccn1 |w:2.2|
Cc1ccc(cc1)-c1csc(NC(=O)\C=C\c2ccco2)c1C(O)=O
CC(C)CN1CCN(Cc2ccc(C)s2)CC1CCO
CN1C(=O)\C(=N/NC(=O)c2ccco2)c2ccccc12
O=C(Nc1ccccn1)c1csc2CCCCc12
COC1=C\C(=C\c2c(N)n3nc(sc3nc2=O)-c2ccc(C)cc2)C=CC1=O |c:27,t:2|
OC(=O)c1cc(n[nH]1)-c1cccs1
COC(=O)c1sc2nc3CCCCc3cc2c1N
CCCSc1nsc(NC(=O)CC)n1
Cc1ccc(cc1)-c1cn2cccnc2n1
O=C(Nc1ccccn1)C(=O)Nc1ccccn1
COCCNC(=O)C(=C\c1cc(C)n(C2CCCCC2)c1C)\C#N
CN1CCS\C1=C/C=C1\N(C)C(=S)N(C)C1=O
Cc1ccc(NN=C(C#N)C(=N)N2CCCCCC2)cc1 |w:6.5|
C(Sc1ccc(nn1)-c1ccccn1)c1ccccn1
COc1ccc(Oc2cnn(-c3ccccc3)c(=O)c2Br)cc1
Nc1nn(cc1-c1ccccc1)-c1cccc(F)n1
CN(C)C(C)=CC(=O)c1sccc1Cl |w:5.5|
CN(C)C=NC(=S)Nc1ccc(Cl)cc1 |w:4.4|
C(N=C1Nc2ccccc2CS1)c1ccccn1 |w:1.0|
CN(C)c1ccc(nn1)C(C#N)c1ccccc1
C\C(=N\OCc1ccc(Br)cc1)c1ccccn1
Clc1ccc(NN=C(C#N)C(=N)N2CCCCCC2)cc1 |w:6.5|
Oc1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1
CCOC(=O)c1c(C)[nH]c(N=Nc2cccc(OC)c2)c1C |w:10.9|
Cc1cc(C(=O)CSc2cccc[n+]2[O-])c(C)n1-c1ccccc1
Cc1ccc(OCc2ccc(Br)cc2)c(n1)[N+]([O-])=O
CC(=NNC(=O)OC(C)(C)C)c1ccc[nH]1 |w:2.2|
[H]C12CC(C(=O)NCCN3C(=O)S\C(=C/c4ccc(OC)cc4)C3=O)C([H])(C1)C=C2 |c:31,THB:4:3:27:28.29|
CN=c1scc(-c2cccs2)n1N=C(C)c1ccco1 |w:12.13,1.0|
CCOc1cc(\C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OC(C)C(O)=O
Cc1cc(C(=O)CSc2ncccn2)c(C)n1Cc1ccco1
CSc1ccc(CN=Nc2ccc(Cl)c(c2)C(O)=O)cc1 |w:8.8|
Cc1ccc(cc1Cl)-n1ncc2ccccc2c1=O
Cc1cccc(c1)N=Nc1cnc(N)s1 |w:7.7|
Cc1ccc2N=C(CC(=Nc2c1)c1ccccc1)C(Cl)Cl |c:5,8|
Nc1nc(N)c(C#N)c(Nc2ccc(Br)cc2)n1
O=C1Nc2ccccc2C1C=Nc1ccccc1 |w:11.13|
COc1cc(\C=C2\N3C=CC=CC3=C(C#N)C2=O)ccc1O |c:8,10,t:13|
CCOC(=O)c1csc(n1)-c1sccc1Br
COc1ccc2[nH]c(cc2c1)C(=O)Nc1cccc(C)n1
CCOC(=O)c1cn[nH]c1NC(=S)Nc1ccccc1
Brc1ccc(C=NNC(=O)c2cccs2)s1
Clc1ccc(Nc2ccc3ccccc3n2)cc1
Cc1nc(cs1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
Cc1cc(ccc1O)N=Nc1ccc2ccccc2c1 |w:9.10|
OCc1ccc(cc1)\N=N\c1ccccc1
Oc1ccc(cc1)N=Nc1ccc2ccccc2c1 |w:8.9|
Cc1ccc(N=Nc2ccc(O)cc2)c(Br)c1 |w:5.4|
Cc1ccc(SCCSc2ncccn2)cc1
[O-][N+](=O)c1ccc2[nH+]c3[N-]c4ccccc4[N-]c3[nH+]c2c1
[H]C12CC3([H])CC([H])(C1)CC(C2)(C3)NC(=O)CCCc1ccccc1 |TLB:5:3:11:6.9.8,THB:2:1:9:3.12.5,2:3:9:1.11.8|
c1ccc2cc(ccc2c1)-c1nc(no1)-c1cccnc1
Nc1ccc(cc1)C(=O)Nc1ccccc1N
CS(=O)(=O)c1ccc2nc(NC(=O)Nc3ccccc3F)sc2c1
Cc1ccc(cc1C)-c1nc(no1)-c1ccncc1
Cc1cc2nn(nc2cc1N)-c1ccc(F)cc1
Clc1ccccc1\C=C\C(=O)Nc1ccccc1
CCOc1ccc(cc1)-c1[n+]([O-])c2ccccc2n(O)c1=O
Brc1ccc(o1)-c1noc(n1)-c1ccccn1
COc1cccc(\C=C\c2ccc3cccc(O)c3n2)c1
CSc1ccccc1-c1nc(no1)-c1ccncc1
Clc1ccc(cc1)-c1cn2cc(Cl)ccc2n1
Nc1c(cnc2c(cnn12)-c1ccc(F)cc1)-c1cccs1
Cc1ccc(cc1)-c1onc2ccc(cc12)C(O)=O
COc1ccc(Nc2nccc(n2)-c2cccc(N)c2)cc1
Oc1cccc(\C=C\c2ccc3cccc(O)c3n2)c1
Cc1cc2ncc(nc2cc1C)-c1ccccc1
Oc1ccccc1-c1cc([nH]n1)-c1ccc(Cl)cc1
N(c1nc(ns1)-c1ccccc1)c1ccccc1
Cc1csc(NC(=O)c2ccc3ccccc3n2)n1
Cc1cc(NC(=O)CSc2nc3CCCc3cc2C#N)no1
Cc1cnc(NC(=O)COc2ccc3CCCc3c2)s1
CC(C)c1cc(CNC(=O)c2cc(COc3cc(C)c(Cl)c(C)c3)on2)on1
Fc1ccccc1-c1cc(on1)C(=O)NCC1CCCO1
CC1CCN(CCSc2ccc(C)cc2)C(=O)CC1
Cc1ccnc(NC(=O)C2CCN(CC2)S(=O)(=O)c2c(C)c(C)cc(C)c2C)c1
Cc1ccnc(NC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1
Brc1ccc(o1)C(=O)Nc1ccc2ccccc2c1
CCc1cc(sc1C)C(=O)Nc1ncccc1O
Fc1ccccc1COc1ccc(\C=C2/C(=O)N=C3SC(CC(=O)N4CCOCC4)=NN3C2=N)cc1 |c:31,t:18|
CCc1sc(cc1C)C(=O)Nc1ncccc1O
Cc1cc2nc([nH]c2cc1C)-c1cccnc1SCC(=O)NCc1ccco1
C(=C/n1nnc2ccccc12)\c1ccccn1
Oc1cccnc1NC(=O)c1ccc(cc1)C(=O)c1ccccc1
COc1ccc2oc(C(=O)Nc3nccs3)c(C)c2c1
CCCCCc1nnc(NC(=O)C2=COCCO2)s1 |t:12|
Oc1cccnc1NC(=O)c1cc2ccccc2o1
NC(NC(=O)c1nc(Cl)c(N)nc1N)=Nc1ccccc1 |w:14.15|
CC1CCC(CC1)NC(=O)c1cccn1C |(4.46,-5.42,;4.46,-3.88,;5.79,-3.11,;5.79,-1.57,;4.46,-.8,;3.12,-1.57,;3.12,-3.11,;4.46,.74,;5.79,1.51,;7.12,.74,;5.79,3.05,;7.04,3.96,;6.56,5.42,;5.02,5.42,;4.54,3.96,;3.08,3.48,)|
Clc1ccccc1Nc1nc2ccccc2o1
CC1CCc2c(C1)sc(NC(=O)C1=COCCO1)c2C(N)=O |t:13|
C1[C@@H](N=C2Sc3ccccc3N12)c1ccccc1 |t:2|
COc1ccc2cc(ncc2c1)-c1ccsc1
Cc1ccc(NC(=S)NC(=O)C2CCCC2)c(Br)c1
Cc1cc(C(=O)COC(=O)c2cccnc2Cl)c(C)n1C
O=C(CSc1nnc(NCc2ccco2)s1)N1CCNC1=O
Cn1cccc1C(=O)OCC(=O)Nc1sccc1C#N
CCCn1c2nc3ccccn3c(=O)c2cc(C(=O)OCC)\c1=N/C(=O)c1ccco1
Cc1ccc(NC(=S)N=C(NS(=O)(=O)c2ccccc2)c2ccccc2)cc1 |w:8.7|
O=C(NNCc1ccccc1)c1ccccn1
CCCCSc1ncnc2n(cnc12)C1CCCCO1
O=C(CC(=O)c1ccncc1)c1cccs1
CCN(CC)S(=O)(=O)c1cc(ccc1F)C(=O)OCC(=O)Nc1ccc(cc1)-c1nc2ccc(C)cc2s1
O=NC(CCc1ccccc1)c1ccccc1
Fc1ccccc1CSc1ncnc2n(cnc12)C1CCCCO1
ClCCN(CCCl)P1(=O)Nc2ccccc2N1
C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)Br)CO)O
C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)I)CO)O
Nc1ncnc2n(C3OC(CO)C(O)C3O)c(Br)c(C#N)c12
Nc1ccc-2c(Cc3cc(N)c(Cl)cc-23)c1
CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O
O=c1n(CCc2ccccc2)nnc2ccccc12
C1CN=C(O1)c1ccc(cc1)\N=N\c1ccccc1 |c:2|
CN(C)c1ccc(cc1)\N=N\c1nccs1
Nc1c(OS(=O)(=O)c2ccccc2)cccc1OS(=O)(=O)c1ccccc1
CCSCC(C)(C)n1[nH]c2ccccc2c1=O
CN(C)CCNc1ncnc2n(cnc12)[C@H]1CN(Cc2cccnc2)C[C@@H](CO)O1
OC(c1nc(cs1)-c1cnc2ccccc2c1)c1ccccc1
Cc1cc(-c2ccncc2)n2ncc(-c3ccccc3)c2n1
OCCN1CCN(CC1)c1cnc(cn1)-c1ccsc1
CC(C)C(N)c1csc(Nc2nncc3ccccc23)n1
CN(C)c1cccc(c1)-c1cc(Nc2ccc(O)cc2C)ncn1
Cc1c(oc2ccccc12)C(=O)Nc1nccs1
CC(=Nc1ccc(Cl)cc1N)c1c(O)cc(C)oc1=O |w:2.2|
COc1ccc2oc3cc(NCCN(C)C)ccc3c(=O)c2c1
CN(C)c1ccc2c(n1)oc1ccccc1c2=O
Cc1cc(C)n2c(NC3CCCC3)c(nc2n1)-c1cc2ccccc2o1
CN(C)c1cccc(c1)-c1cnc(s1)N1CCC(CC1)C(N)=O
O=C(NC1CCC1)c1ccc(cn1)C#CC1CC1
CCCCCCCCN1C(=O)[C@@H](CC(=O)NCC#C)C[C@@]2([C@H](O[C@H](C=C12)C(C)C)C1CC1)C(=O)OC |t:24|
COC(=O)[C@@]12CCCCC=C1N(CC=C)C(=O)[C@H]2CC(=O)N1CCSCC1 |c:9|
N#Cc1cc2ccccc2nc1SCc1ccccn1
COc1ccc(cc1OC)-c1cn2ccccc2n1
O=C(Nc1ccccn1)c1ccc2ccccc2n1
CCOc1ccccc1-n1nnnc1SCc1nc2ccccc2s1
CCOC(=O)N1CCC(CC1)Nc1c(-c2ccc(C)cc2)c(=O)c1=O
CCOc1ccc(cc1OC)-c1noc(COC)n1
Cc1c(oc2ccccc12)C(=O)Nc1ccccn1
Oc1ccccc1-c1cc([nH]n1)-c1ccccc1Cl
CC(C)NC(=O)c1nc2ccccc2s1
Cc1ccc(NCc2nc3ccccc3n2C)cc1
Cc1ccc(NC(=O)c2ccc3ccccc3n2)nc1
Oc1cccc(c1)-c1nc2ccccc2s1
CC1CCCCN1CCNC(=O)CC1Oc2ccccc2NC1=O
CCC(C)Sc1nc2c3ccccc3[nH]c2c(=O)n1C
CC(=O)Nc1nc(nc(C)c1C(C)=O)-c1ccc(Cl)cc1
O=c1oc(nc2sc3CCCCc3c12)-c1cc2ccccc2o1
OC(CN1C(=O)c2ccccc2C1=O)CN1CCOCC1
Cc1ccc2nc(cc(O)c2c1)-c1ccccc1
Cc1ccc(CN=Nc2nnc(Cl)c3ccccc23)cc1 |w:7.7|
Cc1nn(-c2ccc(C)cc2)c2[nH]c(=O)cc(C)c12
COc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)NCCCN1CCc2ccccc2C1
COc1ccc2c(C)cc(SCC(=O)c3ccc4OCOc4c3)nc2c1
Cc1cnc(NC(=O)CCCc2nc3ccccc3s2)s1
OC(=O)C(=O)C(=C/c1ccccc1)\c1ccc2ccccc2n1
Clc1ccc2sc(SCC(=O)c3cc4ccccc4o3)nc2c1
Cc1ccc(cc1)C(=O)Nc1ccc2OCOc2c1
COc1cccc(c1)\N=c1/oc2ccc(OC)cc2cc1-c1nc2ccccc2[nH]1
Cc1cc(C)c(C#N)c(SCc2nc3ccccc3[nH]2)n1
C(N=Nc1nc2ccccc2s1)c1cccs1 |w:2.2|
C(N=Nc1nc2ccccc2s1)c1ccc2OCOc2c1 |w:2.2|
Cc1cccc(OCCNC(=O)c2cncc(Br)c2)c1
c1ccc(cc1)-c1ncc2c(ccc3ccccc23)n1
[O-][N+](=O)c1cc(Cl)ccc1-c1nc(no1)-c1ccccc1
Cc1ccc(-c2cc(no2)-c2ccccc2)c(O)c1
Fc1ccccc1N=CCC(=O)c1cccs1 |w:7.7|
N#C\C(=C\c1ccco1)c1nc2ccccc2s1
Cc1ccc2nsnc2c1NC(=O)c1cccnc1Cl
Cc1c(oc2ccccc12)C(=O)N1CCc2ccccc12
C\C(\C=N\NC(=O)Cn1cnc2ccccc12)=C/c1ccccc1
COc1cc(cc(OC)c1OC)-c1nc2ccccc2c(=O)n1N
CCC(C)n1c(=S)[nH]c2c3cc(ccc3sc2c1=O)[N+]([O-])=O
CN(\N=N\c1ccc(cc1)[N+]([O-])=O)c1ccccc1
Cc1ccsc1CN=Nc1nc2ccccc2s1 |w:8.9|
CCOc1ccc(NC(=O)Cc2cccc3ccccc23)c(c1)[N+]([O-])=O
CCOC(=O)C(=C\c1cn(CCOc2ccccc2)c2ccccc12)\C#N
Cc1cc2nc([nH]c2cc1C)-c1ccc(SCc2ccc(cc2)C(O)=O)nc1
Oc1cc2ccccc2c2C(C(C#N)C(=N)Oc12)c1ccsc1
Fc1ccccc1-c1ccc(CN=Nc2nc3ccccc3[nH]2)o1 |w:13.14|
Cc1csc(NC(=O)c2cc(nc3ccccc23)-c2ccco2)n1
CC1CCC(CC1)NC(=O)c1ccc(cc1)S(C)(=O)=O |(4.41,-7.32,;4.41,-5.78,;5.75,-5.01,;5.75,-3.47,;4.41,-2.7,;3.08,-3.47,;3.08,-5.01,;4.41,-1.16,;5.75,-.39,;7.08,-1.16,;5.75,1.16,;7.08,1.93,;7.08,3.47,;5.75,4.24,;4.41,3.47,;4.41,1.93,;5.75,5.78,;5.75,7.32,;7.29,5.78,;4.21,5.78,)|
NC1=NC(=NNc2nc(cs2)-c2ccc(F)cc2)c2ccccc12 |w:4.4,t:1|
CC(OC(=O)Cn1nc(C)c(c1C)[N+]([O-])=O)C(=O)Nc1ccccc1[N+]([O-])=O
Cc1cc(ccc1\C=C/[N+]([O-])=O)N1CCOCC1
CCOc1ccccc1C(=O)N[C@@H](C(C)C)C(=O)Nc1nc2CCCCc2s1
FC(F)(F)c1cc(NC(=O)CCNC(=O)c2ccccc2Cl)ccc1Br
CCCCN(C(=O)CSc1cc(C)c2ccc(OC)cc2n1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O
FC(F)(F)c1ccc2nnn(OCC(=O)Nc3c(Cl)cccc3Cl)c2c1
Cc1c(oc2ccccc12)C(=O)Nc1nc2ccccc2[nH]1
Cc1nn(Cc2ccccc2)c(Cl)c1\C=N\NC(=O)c1cccnc1
CCCn1nc(C(=O)Nc2ccc3nc(C)sc3c2)c2ccccc2c1=O
COc1ccc(OCc2nnc(SCn3nnc4ccccc4c3=O)n2CC=C)cc1
CC1CCc2sc(cc2C1)C(=O)NNC(=S)Nc1cccc(C)c1C
Cc1ccc(CN=Nc2ccc(Cl)c(c2)C(O)=O)s1 |w:7.7|
Cc1ccc2N=C(CC(C)=Nc2c1)c1ccccc1 |c:5,9|
CC(=O)NC(=S)Nc1ccccc1C(=O)NC1CCCCC1
O=C(Nc1ccccc1)c1nc2ccccc2s1
O=C(CSc1nc2n[nH]cc2c(=O)[nH]1)Nc1nccs1
CCN(CC)CCn1nc2-c3ccccc3-c3cccc(c23)c1=O
CC1=NN(C(=O)CCc2ccc3OCOc3c2)C(O)(C1)C(F)(F)F |t:1|
Nc1cc2nn(nc2cc1Cl)-c1ccccc1
Nc1nonc1OCCCCOc1nonc1N
FC(F)(F)c1ccc(Oc2ccc(Cl)cc2Br)nc1
CCNC1=NN=C(CS1)c1c[nH]c2ccccc12 |c:5,t:3|
Cc1cc(NC(=S)NC(=O)C=Cc2ccc(cc2)S(=O)(=O)N2CCOCC2)ccc1Br |w:11.11|
COc1ccc(Nc2nc(N)nc(CSC(=S)N3CCN(C)CC3)n2)cc1
CC(=O)Nc1ccc(cc1)-n1c(O)cc(Sc2nc3ccccc3s2)c1O
[H]C12CCC([H])(C1)C1C2C(=O)N(CCC(=O)Nc2ccccc2C(F)(F)F)C1=O |TLB:9:8:6:3.2,THB:27:7:6:3.2|
O=C(Nc1ccc2OCOc2c1)Nc1ccc2OCCOc2c1
[O-][N+](=O)c1ccc(cc1)C(=O)CCNc1ccc(Cc2ccncc2)cc1
COc1ccc(cc1)C1CC(=NN1C(=O)CN1CCCCC1)c1cccs1 |c:11|
COC(=O)c1ccccc1NC(=O)c1ccnn1C
[#6]-[#6]-n1c(-[#6])cc(\[#6]=[#6]-2/[#6](=O)-c3ccccc3-[#6]-2=O)c1-[#6]
COC(=O)c1ccccc1NC(=O)NCc1ccncc1
[H]C12CCC([H])(C1)C(C2)C(C)NC(=O)Nc1ccc(OC)cc1 |TLB:9:7:6:3.2|
Cc1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)nc1
CC(N(C)C(=O)CCc1nnc(Cc2c[nH]c3ccccc23)o1)c1nccs1
COc1cccc(-c2nc3ccccc3s2)c1O
Clc1ccc(cc1)C(=O)COC(=O)CNC(=O)c1cccs1
CC(=O)c1ccc2C(=O)N(CCc3ccccc3)C(=O)c3cccc1c23
Cc1cc(C)n2nc(cc2n1)-c1ccccc1
COc1cc(CC=C)ccc1OCCCCOc1ccc(cc1)C(O)=O
CCc1ccc(cc1)-c1csc2ncn(CC)c(=O)c12
Cc1ccc(cc1)C1(C)NC(=O)N(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)C1=O
Cc1ccc(cc1)-c1cn2cccc(C)c2n1
CC(=O)NC1(CCN(CC1)c1cc(C)nc(n1)-c1ccccc1)c1ccccc1
O=C(NCC1CCCO1)C(=C\c1ccc(o1)N1CCOCC1)\C#N
CNCC(O)Cn1c2CCCCc2c2ccccc12
Cc1ccccc1C(=O)N\N=C1\SCC(=O)N1Cc1ccccc1
Clc1ccccc1Cn1nnc(n1)-c1ccccc1
CCCCCCC1(C)NN(C(=S)N1)c1ccccc1
CN(\N=C\c1cccnc1)c1cnc2ccccc2n1
COc1ccc(cc1)C(=O)c1ccccc1
COc1ccc(CN=Nc2nc3ccccc3s2)cc1O |w:8.8|
Cn1c2ccccc2s\c1=N/C(=O)c1ccco1
COc1ccc(CSc2nnc3[nH]c(=O)cc(N)n23)cc1
O=C(CCn1c2ccccc2oc1=S)NC1CCCCC1
Fc1ccc(cc1)-c1cnn2c(ccnc12)-c1cccs1
CC(N=Nc1cccc2cccnc12)c1ccccc1O |w:3.3|
Fc1ccccc1CN=Nc1ncnc2ccccc12 |w:9.10|
O=c1[nH][nH]cc1C=Nc1ccc(Oc2ccccc2)cc1 |w:7.8|
CC1CN(CC(C)O1)C1c2c(OC1(C)C)c(ccc2C)[N+]([O-])=O
OC(=O)c1cccc(c1)N1C(=O)c2ccc(cc2C1=O)C(=O)c1cccc(c1)[N+]([O-])=O
O=C(CCNC(=O)c1ccccc1)NNC1=c2ccccc2=NC1=O |c:16,23|
NC(=NN=Cc1cccc(O)c1)c1nonc1N |w:2.2,4.4|
Cc1ccc(NC(=O)C2CC(=O)Nc3nncn23)cc1
CN1c2ccsc2C(NNc2ccc(F)cc2)=CS1(=O)=O |c:18|
FC(F)(F)c1cccc(c1)-n1nc2c(cc1=O)[nH][nH]c2=O
O=C(NCCc1c[nH]c2ccccc12)c1cnccn1
COc1ccc(cc1)C(=O)\C=C1/Sc2ccccc2N1C
Cn1ccnc1SCC(=O)c1c[nH]c2ccccc12
CCc1sc(cc1C)C(=O)N1CCc2ccccc12
Cc1ccc(NC(=O)c2ccccn2)c(Br)c1
OC(=O)c1ccc(CN=Nc2ccc(cn2)C(F)(F)F)cc1 |w:9.9|
[#6]C([#6])([#6])[#6]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#7]/[#7]-[#6](=S)-[#7]-c1cccnc1
OC(=O)c1ccc(cc1)\[NH+]=N\C=C\[CH-]c1ccccc1[N+]([O-])=O
OC(=O)c1ccccc1SCC(=O)N1CCc2ccccc12
Cc1c(cccc1[N+]([O-])=O)C(=O)O[N-]C(=[NH2+])c1ccccn1
Cn1cnc(NCc2ccccc2)c1[N+]([O-])=O
COc1ccc(cc1)C(N)=NOC(=O)c1cccs1 |w:10.11|
CN1C(=O)C(CC(=O)Nc2ccc(F)cc2)N(Cc2cccs2)C1=S
O=C(\C=C\c1ccccc1)c1c[nH]c2ccccc12
COc1cccc(NC(=O)C(=O)c2cn(CC(=O)N3CCOCC3)c3ccccc23)c1
[O-][N+](=O)c1cc2C(=O)N(CCN3CCCC3)C(=O)c3cccc(c1)c23
Clc1ccc(cc1)C(=O)CC=Nc1ccccc1C#N |w:11.12|
Cc1ccc(cc1NC(=O)C1CCCC1)[N+]([O-])=O
Cc1ccc(Nc2nc(N)c3ccccc3n2)cc1Cl
COc1ccc(C(=O)Nc2ccc3ccccc3c2)c(OC)c1
COc1ccc(NC(=O)c2cc3ccccc3cc2OC)cc1
NC(=O)c1ccccc1NC(=O)c1ccc2ccccc2c1
Cc1ccc(cc1Br)N=CCC(=O)c1ccccc1 |w:8.8|
[O-][N+](=O)c1ccccc1CC(=O)NCCc1ccc(F)cc1
Cc1ccc(CNc2nc3ccccc3n2C)cc1
COc1ccc(Cl)cc1C(=O)Nc1ccc2OCCOc2c1
Cn1c(CNc2ccc(F)cc2)nc2ccccc12
Fc1ccc(cc1)-c1csc(Nc2ccccn2)n1
O=C(Nc1ccccc1)C(=O)c1c[nH]c2ccccc12
Fc1ccccc1C(=O)Nc1ccc(Nc2ccccc2)cc1
Oc1cccc(NC(=O)c2c(O)c3ccccc3[nH]c2=O)c1
COCCNC(=O)Cn1nc(-c2ccc(Cl)cc2)c2ccccc2c1=O
COCCCNc1nc2c(nnn2c2ccccc12)-c1ccc(C)cc1
Oc1ccc(N=Nc2ccccc2)o1 |w:6.6|
COc1ccc(cc1)-c1nc2ccccn2c1Cl
OC(=O)C(=O)C(=C/c1ccsc1)\c1ccc2ccccc2n1
C(Sc1ccccn1)c1nc2ccccc2s1
COc1cc(SC)ccc1C(=O)Nc1ccc2CCCc2c1
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2OCOc2c1
Cc1c(oc2ccccc12)C(=O)Nc1ccc(C)cn1
Fc1ccccc1NC(=O)C(=C\c1ccc[nH]1)\C#N
Cc1ccnc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1
O=c1n2CCc3c([nH]c4ccccc34)-c2nc2ccccc12
COC(=O)[C@]1(C)N[C@H](CN(C)C(C)=O)[C@H]2[C@@H]1C(=O)N(Cc1ccccc1)C2=O
COc1ccc(cc1)-c1noc(CCC(=O)N2CCN(CC2)c2cccc(C)c2)n1
COc1cccc(c1)C(=O)Cn1c2ccccc2n(C)c1=N
[O-][N+](=O)c1ccc(cc1)C(=O)N1CCOCC1
Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)COC(=O)c2ccc(Br)o2)cc1
Nc1ccccc1C=C1Cc2ccccc2C1=O
CC1(C)NC(=S)C(C)(C)N1N=O
ClCCN(CCCl)c1ccc(CNNC(=O)Cc2c[nH]c3ccccc23)cc1
Cc1ccc(C(=O)C2CC2)c(C)c1
C(=Cc1ccc2ccccc2n1)c1c[nH]c2ccccc12
Cc1cc(ccc1N)-c1nc2cc(F)ccc2s1
CCN(CC)CCCNc1nc2ccccc2c2[nH]c3ccc(OC)cc3c12
CNc1c2cccc(C)c2nc2c(cccc12)C(=O)NCCN(C)C
Cc1cc2ccccn2c1C(=S)NC(=O)c1ccc(C)cc1
COc1cccc(CC(=O)Nc2ccc3n(-c4ccc(cc4)C(C)(C)C)n(C)c(=O)c3c2)c1
Cc1c(oc2cc(C)c(C)cc12)C(=O)NCC(N1CCCC1)c1ccco1
Cc1onc(c1C(=O)OCC(=O)c1ccc(F)cc1)-c1ccccc1
C[C@@H]1O[C@H](C[C@H](N)[C@@H]1O)O[C@@H]1C[C@](O)(Cc2c(O)c3C(=O)c4ccccc4C(=O)c3c(O)c12)C(C)=O
CN(CC(=O)Nc1cccc(F)c1)C(=O)c1cccc(c1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1
CNc1cncc(n1)-c1ccc(OC)c(OC)c1
Fc1ccc(cc1F)-c1coc2c(cccc12)C(=O)NCc1cccs1
CC(C)N(C)c1ncnc2n(cnc12)[C@H]1CN(Cc2cccnc2)C[C@@H](CO)O1
C(c1c(nc2c3ccccc3ccn12)-c1ccco1)c1ccccc1
Fc1cccc(Cc2c(nc3c4ccccc4ccn23)-c2ccco2)c1
Clc1cccc(c1)-c1nc2c3ccccc3ccn2c1Cc1ccsc1
CCc1ccc2cc3-c4ccccc4C(=O)c3cc2n1
Nc1nc(=O)n(cc1Cl)C1CC(O)C(CO)O1
C[C@H](N1C[C@@H](COCc2ccccc2)Oc2cc(ccc2S1(=O)=O)N1CCC[C@H]1C(N)=O)c1ccccc1
CC(C)N1CCCc2c(C1)sc(NC(C)=O)c2-c1nc2ccccc2s1
COC(=O)[C@@]12Cc3c([C@H](N1CC=C2)c1ccc(OC)c(OC)c1)n(c1ccccc31)S(=O)(=O)c1ccc(C)cc1 |c:12|
CC(C)C1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1cc1ccc(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1cc1ccc(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1cc1cc(CO)c(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1cc1cc(CO)c(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)C1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(C(C)=O)c(n1)C(F)(F)F |w:3.2|
CC(C)C1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(c(n1)C(F)(F)F)C(C)(C)O |w:3.2|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3ccc(cc23)S(C)(=O)=O)C1C(C)C |w:31.35|
CC(C)C1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |w:3.2|
CC(C)C1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(C(N)=O)c(n1)C(F)(F)F |w:3.2|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(C)=O)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(C)=O)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(c(n1)C(F)(F)F)C(C)(C)O |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(c(n1)C(F)(F)F)C(C)(C)O |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(C)O)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(C)O)c(n1)C(F)(F)F |r|
CCC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CCC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@@H]1C(C)C |r|
CCC(O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@@H]1C(C)C |r|
CCC(O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CCCC(O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(O)=O)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(O)=O)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(N)=O)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(N)=O)c(n1)C(F)(F)F |r|
CNC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CNC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@@H]1C(C)C |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(=O)N(C)C)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(=O)N(C)C)c(n1)C(F)(F)F |r|
COc1nc(ncc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(CO)c(C)n1 |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C1CC1 |r|
CC(C)[C@@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C1CC1 |r|
CC(C)[C@H]1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(C(C)=O)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(C(C)=O)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(c(n1)C(F)(F)F)C(C)(C)O |r|
CC(C)[C@@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(c(n1)C(F)(F)F)C(C)(C)O |r|
CC(C)[C@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(C(C)O)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(C(C)O)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |r|
CC(C)C1N(CCn2c1nc1cc(CO)c(cc21)S(C)(=O)=O)c1ncc(C(C)=O)c(n1)C(F)(F)F |w:3.2|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)C1C(C)C |w:33.37|
COC(=O)c1cnc(nc1C(F)(F)F)N1CCn2c(nc3cc(CO)c(cc23)S(C)(=O)=O)[C@H]1C(C)C |r|
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)(C)C)c1cccc(c1)S(C)(=O)=O |r|
CCC(C)[C@H]1CN(CCN1C(=O)OC(C)(C)C)c1cccc(c1)S(C)(=O)=O |r|
COC(=O)[C@H]1CN(CCN1C(=O)OC(C)(C)C)c1cccc(c1)S(C)(=O)=O |r|
CC(C)(C)OC(=O)N1CCN(CC1c1ccccc1)c1cccc(c1)S(C)(=O)=O
CC(C)(C)OC(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)(C)OC(=O)N1CCN(C[C@@H]1Cc1ccccc1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)(C)OC(=O)N1CCN(C[C@H]1Cc1ccccc1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)(C)OC(=O)N1CCN(CC1c1ccccc1Br)c1cccc(c1)S(C)(=O)=O
CC(C)(C)OC(=O)N1CCN(CC1(C)c1ccccc1)c1cccc(c1)S(C)(=O)=O
CC(C)(C)OC(=O)N1CCN(CC1C1CCCCC1)c1cccc(c1)S(C)(=O)=O
CC(C)(C)OC(=O)N1CCN(CC1c1ccc(Br)cc1)c1cccc(c1)S(C)(=O)=O
CCC(C)[C@@H]1CN(CCN1Cc1ccccc1)c1cccc(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccccc2)C(C1)c1ccccc1
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)c1ccc(cc1S(C)(=O)=O)N1CCN([C@H](C1)c1ccccc1)C(=O)OC(C)(C)C |r|
CCOC(=O)c1csc(n1)C1CN(CCN1C(=O)OC(C)(C)C)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)(C)C)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)(C)C)c1ccc(-c2ccc(cc2)C(F)(F)F)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1c1ncc(c(C)n1)S(C)(=O)=O)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)(C)C)c1ccc(C(N)=O)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1ccc(C(N)=O)c(c1Cl)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1cc(c(cc1Cl)C(N)=O)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(N)=O)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(N)=O)c1ccc(C(O)=O)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C(N)=O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@H](C1)c1ccccc1Cl |r,wU:18.18,21.25,wD:28.32,(4.67,6.55,;4.67,5.01,;6.21,5.01,;3.13,5.01,;4.67,3.47,;3.33,2.69,;3.33,1.15,;4.67,.38,;6,1.15,;6,2.69,;7.34,3.47,;8.67,2.69,;7.34,5.01,;2,.38,;.67,1.15,;-.67,.38,;-.67,-1.15,;-2,-1.93,;-3.33,-1.15,;-4.67,-1.93,;-6,-1.15,;-6,.38,;-4.67,1.15,;-3.33,.38,;-7.34,1.15,;-8.67,1.93,;-6.57,2.49,;-8.11,-.18,;.67,-1.93,;2,-1.15,;.67,-3.47,;-.67,-4.23,;-.67,-5.78,;.67,-6.55,;2,-5.78,;2,-4.23,;3.33,-3.47,)|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@@H](C1)c1ccccc1Cl |r,wU:28.32,18.18,21.25,(4.67,6.55,;4.67,5.01,;6.21,5.01,;3.13,5.01,;4.67,3.47,;3.33,2.69,;3.33,1.15,;4.67,.38,;6,1.15,;6,2.69,;7.34,3.47,;8.67,2.69,;7.34,5.01,;2,.38,;.67,1.15,;-.67,.38,;-.67,-1.15,;-2,-1.93,;-3.33,-1.15,;-4.67,-1.93,;-6,-1.15,;-6,.38,;-4.67,1.15,;-3.33,.38,;-7.34,1.15,;-8.67,1.93,;-6.57,2.49,;-8.11,-.18,;.67,-1.93,;2,-1.15,;.67,-3.47,;-.67,-4.23,;-.67,-5.78,;.67,-6.55,;2,-5.78,;2,-4.23,;3.33,-3.47,)|
CC(C)[C@@H]1CN(CCN1C(=O)OC1CC(F)(F)C1(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)(C)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1C(=O)OC(C)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1C(=O)OCC(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCC(C)OC(=O)N1CCN(CC1c1ccccc1)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)[C@@H]1CN(CCN1C(=O)OCC(C)(C)C)c1cccc(c1)S(C)(=O)=O |r|
CCC(C)OC(=O)N1CCN(C[C@H]1C(C)C)c1cccc(c1)S(C)(=O)=O |r|
CC(C)OC(=O)N1CCN(CC1c1ccccc1)c1cccc(c1)S(C)(=O)=O
CC(C)(C)OC(=O)N1CCN(C[C@H]1C(C)(C)O)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncccn1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(C)cc(C)n1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Cl)cn1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(cn1)C1CC1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(C)C)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C#N)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(C)cc(n1)C#N)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)c1cnc(nc1)N1CCN(C[C@H]1C(C)C)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C1CC1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(OC(F)F)cn1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Cl)c(C)n1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
COC(=O)c1cnc(nc1)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)c1ccnc(n1)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Br)cn1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(C)cc(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Br)c(C)n1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C#N)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C)N1CCN(CC1CC(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)(O)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC([C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O)C(F)(F)F |r|
CC([C@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O)C(F)(F)F |r|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)C(F)(F)F)c1nccc(n1)C(F)(F)F |r|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)C(F)(F)F)c1nccc(n1)C(F)(F)F |r|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@@H]1CN(CCN1c1cc(ccn1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cccc(n1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cc(ccn1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)c1ccc(cn1)C(F)(F)F |r|
CC(C)[C@@H]1CN(CCN1c1nc(ccc1Cl)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(cc1[N+]([O-])=O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1ccc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cnc(cn1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cncc(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cnc(C)cn1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cnc(cn1)C1CC1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cnc(cn1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccnc(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nsc(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2ccccc2o1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2ccc(cc2s1)C#N)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2c(F)cccc2s1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2ccc(F)cc2s1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2ccccc2s1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2cccnc2s1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2cnccc2s1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc2ncccc2s1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1cccc(c1)S(N)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccc(F)cc1)c1nccc(n1)C(F)(F)F |r|
CCOC(=O)c1nc(ncc1CC)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(=O)(=O)c1ccc(OC)cc1 |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C1CC1)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)c1cnc(nc1C(F)(F)F)N1CCN(CC1C(C)(C)C)c1ccc(F)c(c1)S(C)(=O)=O
CNS(=O)(=O)c1cc(ccc1F)N1CCN([C@@H](C1)C(C)C)c1ncc(C(=O)OC)c(n1)C(F)(F)F |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)CC)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1c1nc(C)cs1)c1cccc(c1)S(C)(=O)=O |r|
COC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1c1ccc(F)cc1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(CC(=O)OC)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(-c2nnc(C)o2)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(-c2ncon2)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(-c2nnc(C)s2)c(c1)S(C)(=O)=O |r|
CCOC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(-c2nc(co2)C(N)=O)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C(F)(F)F)C(C)(C)O)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C(F)(F)F)C(C)(C)O)c1ccc(F)c(c1)S(N)(=O)=O |r|
CNS(=O)(=O)c1cc(ccc1F)N1CCN([C@@H](C1)C(C)C)c1ncc(c(n1)C(F)(F)F)C(C)(C)O |r|
CC(C)(C)C1CN(CCN1c1ncc(c(n1)C(F)(F)F)C(C)(C)O)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)[C@H]1CN(CCN1c1ncc(c(n1)C(F)(F)F)C(C)(C)O)c1ccc(CO)c(c1)S(C)(=O)=O |r|
Cc1nc(ncc1C(C)(C)O)N1CCN(CC1CC(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C(F)(F)F)C(C)(C)O)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(o1)C(C)(C)O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)(O)[C@H]1CN(CCN1c1nc(c(o1)C(C)(C)O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)(O)[C@@H]1CN(CCN1c1nc(c(o1)C(C)(C)O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)(O)c1ccc(CN2CCN(C[C@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1 |r|
CC(C)(O)c1ccc(CN2CCN(C[C@@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1 |r|
CC(C)(O)c1cc(CN2CCN(C[C@@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)ccc1C(F)(F)F |r|
CC(C)(O)c1cc(CN2CCN(C[C@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)ccc1C(F)(F)F |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(N)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(Cl)c(c1)S(C)(=O)=O |r|
COC(C)[C@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
COC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1cc(F)c(CO)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cc(ccc1F)N1CCN([C@@H](C1)c1ccc(F)cc1)c1ncc(CO)c(n1)C(F)(F)F |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nc(C)co2)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nnc(C)o2)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nc(C)no2)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nsc(C)n2)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nc(cs2)C#N)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nc(co2)C(N)=O)c(c1)S(C)(=O)=O |r|
Cc1nc(ncc1CO)N1CCN(CC1)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)[C@@H]1CN(CCN1c1nccc(CO)n1)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(CO)o1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(CO)s1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(C)O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc([C@@H](C)O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc([C@H](C)O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc([C@@H](C)O)c(n1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc([C@H](C)O)c(n1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CC[C@H](O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC[C@@H](O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CNS(=O)(=O)c1cc(ccc1F)N1CCN([C@@H](C1)C(C)C)c1ncc(C(C)O)c(n1)C(F)(F)F |r|
C[C@H](O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1c1ccc(F)cc1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CNS(=O)(=O)c1cc(ccc1F)N1CCN([C@@H](C1)c1ccc(F)cc1)c1ncc(C(C)=O)c(n1)C(F)(F)F |r|
CC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1c1ccc(F)cc1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(C)=C)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN2CC(F)C2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN2CC(O)C2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN2CCOCC2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN(C)C(C)(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CNS(C)(=O)=O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CSCc1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CN(C)CCCO)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
COCCN(C)Cc1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1ccc(CN)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(O)=O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(N)=O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CNC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N2CC(N)C2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N2CC(O)C2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
COCCNC(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
COCCN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N2CCOCC2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC1CN(C1)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCCCN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N(C)CCCO)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
COCCCN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCN(CCOC)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCN(CCCO)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)CN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N(C)CCC(C)(C)O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CCOC(=O)CCN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(=O)NCCCN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)NC2CN(C2)C(=O)OC(C)(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N2CC(C2)NC(=O)OC(C)(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N(C)C2CN(C2)C(=O)OC(C)(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N(C)CCCNC(=O)OC(C)(C)C)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(N)=O)c(C)n1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(N)=O)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
COCCN(C)C(=O)c1cnc(nc1C)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(=O)N(C)CCCO)c(C)n1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(N)=O)c(n1)C(F)(F)F)c1cc(F)c(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(C(N)=O)c(n1)C(F)(F)F)c1cc(c(CO)cc1F)S(C)(=O)=O |r|
CCN(CCOC)C(=O)c1cnc(nc1C)N1CCN(C[C@H]1C(C)C)c1cc(F)c(CO)c(c1)S(C)(=O)=O |r|
COCCCN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1C(C)C)c1cc(F)c(CO)c(c1)S(C)(=O)=O |r|
CON(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1c1ccc(F)cc1)c1cc(F)c(CO)c(c1)S(C)(=O)=O |r|
CN(C)C(=O)c1cnc(nc1C(F)(F)F)N1CCN(C[C@H]1c1ccc(F)cc1)c1cc(F)c(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(s1)C(=O)N(C)C)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(s1)C(N)=O)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(C[C@H]2CC[C@@H](CC2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r,wU:21.25,28.32,wD:18.18,(6,5.88,;4.67,5.11,;3.33,5.88,;3.9,6.44,;4.67,3.57,;3.33,2.8,;3.33,1.26,;4.67,.49,;6,1.26,;6,2.8,;7.34,3.57,;8.67,2.8,;7.34,5.11,;2,.49,;.67,1.26,;-.67,.49,;-.67,-1.05,;-2,-1.82,;-3.33,-1.05,;-3.33,.49,;-4.67,1.26,;-6,.49,;-6,-1.05,;-4.67,-1.82,;-7.34,1.26,;-8.67,.49,;-7.34,2.8,;-8.67,2.03,;.67,-1.82,;2,-1.05,;.67,-3.36,;-.67,-4.13,;-.67,-5.67,;.67,-6.44,;2,-5.67,;2,-4.13,)|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(C[C@H]2CC[C@@H](CC2)C(F)(F)F)[C@H](C1)c1ccccc1 |r,wU:21.25,wD:18.18,28.32,(6,5.88,;4.67,5.11,;3.33,5.88,;3.9,6.44,;4.67,3.57,;3.33,2.8,;3.33,1.26,;4.67,.49,;6,1.26,;6,2.8,;7.34,3.57,;8.67,2.8,;7.34,5.11,;2,.49,;.67,1.26,;-.67,.49,;-.67,-1.05,;-2,-1.82,;-3.33,-1.05,;-3.33,.49,;-4.67,1.26,;-6,.49,;-6,-1.05,;-4.67,-1.82,;-7.34,1.26,;-8.67,.49,;-7.34,2.8,;-8.67,2.03,;.67,-1.82,;2,-1.05,;.67,-3.36,;-.67,-4.13,;-.67,-5.67,;.67,-6.44,;2,-5.67,;2,-4.13,)|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r,wU:21.25,18.18,28.32,(6,5.88,;4.67,5.11,;3.33,5.88,;3.9,6.44,;4.67,3.57,;3.33,2.8,;3.33,1.26,;4.67,.49,;6,1.26,;6,2.8,;7.34,3.57,;8.67,2.8,;7.34,5.11,;2,.49,;.67,1.26,;-.67,.49,;-.67,-1.05,;-2,-1.82,;-3.33,-1.05,;-4.67,-1.82,;-6,-1.05,;-6,.49,;-4.67,1.26,;-3.33,.49,;-7.34,1.26,;-8.67,.49,;-7.34,2.8,;-8.67,2.03,;.67,-1.82,;2,-1.05,;.67,-3.36,;-.67,-4.13,;-.67,-5.67,;.67,-6.44,;2,-5.67,;2,-4.13,)|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@H](C1)c1ccccc1 |r,wU:21.25,18.18,wD:28.32,(6,5.88,;4.67,5.11,;3.33,5.88,;3.9,6.44,;4.67,3.57,;3.33,2.8,;3.33,1.26,;4.67,.49,;6,1.26,;6,2.8,;7.34,3.57,;8.67,2.8,;7.34,5.11,;2,.49,;.67,1.26,;-.67,.49,;-.67,-1.05,;-2,-1.82,;-3.33,-1.05,;-4.67,-1.82,;-6,-1.05,;-6,.49,;-4.67,1.26,;-3.33,.49,;-7.34,1.26,;-8.67,.49,;-7.34,2.8,;-8.67,2.03,;.67,-1.82,;2,-1.05,;.67,-3.36,;-.67,-4.13,;-.67,-5.67,;.67,-6.44,;2,-5.67,;2,-4.13,)|
CC(C)[C@@H]1CN(CCN1c2ncc(c(n2)C(F)(F)F)CO)c3ccc(c(c3)S(=O)(=O)C)CO
CC(C)[C@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1cncc(c1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(cn1)C(C)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(cn1)C(C)(O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(nc1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(cc1N)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Cl)c(n1)C1CC1)c1ccc(F)c(c1Cl)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Cl)c(n1)C(C)(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)Cc1cc(nc(n1)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O)C(F)(F)F |r|
CC(C)Oc1cc(nc(n1)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O)C(F)(F)F |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C(F)(F)F)C(C)(C)C#N)c1ccc(CCO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(s1)C(C)(C)O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(c(o1)C(C)(C)O)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(-c2nc(C)cs2)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(B2OC(C)(C)C(C)(C)O2)c(n1)C(F)(F)F)C(=O)OCc1ccccc1 |r|
CC(C)[C@@H]1CN(CCN1c1ncc(O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Cc2ccc(cc2)C(C)(C)O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Cc2ccc(OC=O)cc2)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
COc1cc(ccn1)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)(O)CC1CN(CCN1c1ccc(cn1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)(F)CC1CN(CCN1c1ccc(cn1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O
CC(C)[C@@H]1CN(CCN1c1ncc(c(Cl)n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(C)n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(c(C)n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C#N)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(c(n1)C(C)(C)O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(Br)c(n1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(C)c(n1)C1CC1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nc(ccc1C)C1CC1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ccc(c(n1)C1CC1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(cn1)C(O)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
COC(c1cnc(nc1)N1CCN(C[C@H]1C(C)C)c1ccc(F)c(c1)S(C)(=O)=O)C(F)(F)F |r|
CC(C)[C@@H]1CN(CCN1c1ccnc(OC(F)F)c1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(OC(F)F)n1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1nccc(OCC(F)(F)F)n1)c1ccc(F)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(Cl)c2)C(F)(F)F)[C@@H](Cc2ccccc2)C1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(Cl)c2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(Cl)c2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(Cl)c2)C(F)(F)F)[C@H](C1)c1ccccc1 |r|
Cc1ccc(CN2CCN(C[C@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1 |r|
Cc1ccc(CN2CCN(C[C@@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1 |r|
CC(C)c1ccc(CN2CCN(C[C@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1 |r|
CC(C)c1ccc(CN2CCN(C[C@@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1 |r|
CC(C)[C@H]1CN(CCN1Cc1ccc(cc1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(OC(F)F)cc2)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(OC(F)F)cc2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccccc2C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2cccc(c2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(cc2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(cc2)C(F)(F)F)[C@H](C1)c1ccccc1 |r|
CC(N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O)c1ccc(cc1)C(F)(F)F |r|
CC(N1CCN(C[C@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O)c1ccc(cc1)C(F)(F)F |r|
C[C@@]1(CN(CCN1Cc1ccc(cc1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O)c1ccccc1 |r|
C[C@]1(CN(CCN1Cc1ccc(cc1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(OC(F)(F)F)cc2)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(OC(F)(F)F)cc2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(cc2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(F)c2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(F)c2)C(F)(F)F)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(F)c2)C(F)(F)F)[C@@H](C1)C1CCCCC1 |r|
CC(O)(c1ccc(CN2CCN(C[C@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1)C(F)(F)F |r|
CC(O)(c1ccc(CN2CCN(C[C@@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cc1)C(F)(F)F |r|
C[C@@]1(CN(CCN1Cc1ccc(c(Cl)c1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O)c1ccccc1 |r|
C[C@]1(CN(CCN1Cc1ccc(c(Cl)c1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O)c1ccccc1 |r|
COC(=O)c1cc(CN2CCN(CC2c2ccccc2)c2cccc(c2)S(C)(=O)=O)ccc1C(F)(F)F
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(c(Br)c2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2cccnc2)C(C1)c1ccccc1
Cc1ccc(CN2CCN(CC2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cn1
CC(C)[C@H]1CN(CCN1Cc1ccc(nc1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)c1ccc(CN2CCN(CC2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cn1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r|
Cc1ccccc1[C@@H]1CN(CCN1Cc1ccc(nc1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
Cc1ccccc1[C@H]1CN(CCN1Cc1ccc(nc1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
Cc1nc(ccc1CN1CCN(CC1c1ccccc1)c1cccc(c1)S(C)(=O)=O)C(F)(F)F
Cc1cc(CN2CCN(CC2c2ccccc2)c2cccc(c2)S(C)(=O)=O)cnc1C(F)(F)F
Cc1cc(CN2CCN(CC2(C)c2ccccc2)c2cccc(c2)S(C)(=O)=O)cnc1C(F)(F)F
CS(=O)(=O)c1ccc(F)c(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccc(F)cc1
CS(=O)(=O)c1cc(ccc1F)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cc(F)cc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccc(Cl)cc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1cccc(Cl)c1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)[C@@H](C1)c1ccccc1Cl |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)[C@H](C1)c1ccccc1Cl |r|
CS(=O)(=O)c1cc(ccc1C(N)=O)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
COC(=O)c1ccc(cc1S(C)(=O)=O)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1Br
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccc(Br)cc1
Cc1cccc(c1)C1CN(CCN1Cc1ccc(nc1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(cn2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(cn2)C(F)(F)F)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(o2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(o2)C(F)(F)F)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cc(ccc1CO)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
CC(C)[C@H]1CN(CCN1Cc1ccc(cc1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1Cc1ccc(c(Cl)c1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cc(ccc1CO)N1CCN(Cc2ccc(c(Cl)c2)C(F)(F)F)C(C1)c1ccccc1
CC(C)[C@H]1CN(CCN1Cc1ccc(o1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C(=O)C1CCC(C)(C)CC1)c1cccc(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CCC(O)(CC1)C(F)(F)F |r,wU:14.17,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-7.04,12.22,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-9.35,13.56,)|
CC1(C)CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r|
CC1(O)CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wD:15.17,(-8.58,12.22,;-7.81,10.89,;-7.04,12.22,;-8.58,9.56,;-7.81,8.22,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC1(O)CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:15.17,(-8.58,12.22,;-7.81,10.89,;-7.04,12.22,;-8.58,9.56,;-7.81,8.22,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
C[C@@]1(O)CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:1.1,wD:15.17,1.0,(-8.58,12.22,;-7.81,10.89,;-7.04,12.22,;-8.58,9.56,;-7.81,8.22,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
C[C@@]1(O)CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:15.17,1.1,wD:1.0,(-8.58,12.22,;-7.81,10.89,;-7.04,12.22,;-8.58,9.56,;-7.81,8.22,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC(C)[C@@H]1CN(CCN1C(=O)C1CC[C@@](C)(O)CC1)c1cccc(c1)S(C)(=O)=O |r,wU:3.2,14.16,wD:14.15,(-5.5,4.22,;-3.96,4.22,;-3.19,2.89,;-3.19,5.56,;-1.65,5.56,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-8.58,12.22,;-7.04,12.22,;-6.27,10.89,;-5.5,9.56,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
C[C@@]1(O)CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:15.17,1.0,wD:1.1,(-8.58,12.22,;-7.81,10.89,;-7.04,12.22,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC(C)[C@H]1CN(CCN1C(=O)C1CC[C@@](C)(O)CC1)c1cccc(c1)S(C)(=O)=O |r,wU:14.16,wD:3.2,14.15,(-5.5,4.22,;-3.96,4.22,;-3.19,2.89,;-3.19,5.56,;-1.65,5.56,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-8.58,12.22,;-7.04,12.22,;-6.27,10.89,;-5.5,9.56,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
C[C@@]1(O)CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:1.0,wD:15.17,1.1,(-8.58,12.22,;-7.81,10.89,;-7.04,12.22,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CCC(F)(F)CC1 |r|
CC(C)[C@H]1CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:16.18,3.2,(-10.12,12.22,;-8.58,12.22,;-7.81,13.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC(C)[C@H]1CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:3.2,wD:16.18,(-10.12,12.22,;-8.58,12.22,;-7.81,13.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wU:14.17,wD:27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wD:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wU:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wU:27.33,wD:14.17,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wU:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wU:27.33,wD:14.17,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wU:14.17,wD:27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)F |r,wD:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,)|
CC(C)[C@@H]1CN(CCN1C(=O)C1CC[C@@H](CC1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r,wU:3.2,14.18,(-5.5,4.22,;-3.96,4.22,;-3.19,2.89,;-3.19,5.56,;-1.65,5.56,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;5.28,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC(C)(O)[C@H]1CCC(CC1)C(=O)N1CCN(CC1c1ccccc1)c1cccc(c1)S(F)(=O)=O |r,wU:4.3,(-7.81,13.56,;-8.58,12.22,;-7.04,12.22,;-10.12,12.22,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC1(C)CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1ccc(CCO)c(c1)S(C)(=O)=O |r|
CC1(C)CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1ccc(CCO)c(c1)S(C)(=O)=O |r|
CC(F)(F)[C@H]1CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:4.3,wD:17.19,(-7.04,12.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC(F)(F)[C@H]1CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1cccc(c1)S(C)(=O)=O |r,wU:17.19,4.3,(-7.04,12.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:27.33,wD:14.17,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:14.17,wD:27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wD:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:14.17,wD:27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wD:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:14.17,27.33,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:27.33,wD:14.17,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CC(C)[C@H]1CN(CCN1CC1CCC(O)(CC1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r,wD:3.2,(-.82,-4.94,;-1.59,-3.61,;-3.13,-3.61,;-.82,-2.28,;.72,-2.28,;1.49,-.94,;.72,.39,;-.82,.39,;-1.59,-.94,;-3.13,-.94,;-3.9,.39,;-3.13,1.72,;-3.9,3.06,;-5.44,3.06,;-5.04,4.55,;-6.21,1.72,;-5.44,.39,;-6.93,3.46,;-8.42,3.86,;-6.53,4.94,;-7.33,1.97,;3.03,-.94,;3.8,-2.28,;5.34,-2.28,;6.11,-.94,;7.65,-.94,;8.42,-2.28,;5.34,.39,;3.8,.39,;6.11,1.72,;6.88,3.06,;4.77,2.49,;7.44,.95,)|
NS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccc(F)cc1)C(=O)C1CCC[C@H](C1)C(F)(F)F |r|
NS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccc(F)cc1)C(=O)C1CCC[C@@H](C1)C(F)(F)F |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r,wU:15.15,18.22,wD:25.29,(8.67,1.93,;7.34,2.69,;8.11,4.03,;6.57,1.36,;6,3.47,;6,5,;4.67,5.78,;3.33,5,;3.33,3.47,;4.67,2.69,;2,2.69,;.67,3.47,;-.67,2.69,;-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-6,1.15,;-6,2.69,;-4.67,3.47,;-3.33,2.69,;-7.34,3.47,;-8.67,4.23,;-6.57,4.8,;-8.11,2.13,;.67,.38,;2,1.15,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;2,-1.93,)|
CS(=O)(=O)c1cc(ccc1CCO)N1CCN([C@@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:17.20,30.36,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;1.43,8.22,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;5.28,6.89,;6.05,5.56,;5.28,4.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CS(=O)(=O)c1cc(ccc1CCO)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:30.36,wD:17.20,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;1.43,8.22,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;5.28,6.89,;6.05,5.56,;5.28,4.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CS(=O)(=O)c1cccc(c1)N1CCN([C@H](C1)c1ccccc1Cl)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:28.34,wD:14.17,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-1.65,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CS(=O)(=O)c1cc(ccc1F)N1CCN([C@H](C1)c1ccc(F)cc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wD:15.18,29.35,(2.97,10.89,;3.74,9.56,;5.07,10.33,;5.07,8.79,;2.97,8.22,;1.43,8.22,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;5.28,6.89,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-6.27,.22,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
COCCc1ccc(cc1S(C)(=O)=O)N1CCN([C@H](C1)c1ccccc1)C(=O)C1CC[C@@H](CC1)C(F)(F)F |r,wU:31.37,wD:18.21,(3.74,4.22,;5.28,4.22,;6.05,5.56,;5.28,6.89,;3.74,6.89,;2.97,5.56,;1.43,5.56,;.66,6.89,;1.43,8.22,;2.97,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,;-.88,6.89,;-1.65,8.22,;-3.19,8.22,;-3.96,6.89,;-3.19,5.56,;-1.65,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;-5.5,6.89,;-6.27,5.56,;-6.27,8.22,;-5.5,9.56,;-6.27,10.89,;-7.81,10.89,;-8.58,9.56,;-7.81,8.22,;-8.58,12.22,;-10.12,12.22,;-7.81,13.56,;-7.04,12.22,)|
CC(C)[C@H]1CN(CCN1CC1CCN(CC(F)(F)F)CC1)c1ccc(CCO)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCN(CC(F)(F)F)CC2)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCN(CC(F)(F)F)CC2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2(F)CCN(CC(F)(F)F)CC2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2(F)CCN(CC(F)(F)F)CC2)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCN(CC(F)(F)F)CC2)[C@H](C1)c1ccccc1Cl |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCN(CC(F)(F)F)CC2)[C@@H](C1)c1ccccc1Cl |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2(F)CCN(CC(F)(F)F)CC2)[C@H](C1)c1ccc(F)cc1 |r|
CC(C)[C@H]1CN(CCN1C[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(CCO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@H]1CCN(CC(F)(F)F)C1)c1ccc(CCO)c(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@@H]2CCN(CC(F)(F)F)C2)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@@H]2CCN(CC(F)(F)F)C2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CCN(CC(F)(F)F)C2)[C@@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CCN(CC(F)(F)F)C2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@@H]2C[C@H]3[C@@H](C2)C3(F)F)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2C[C@H]3[C@@H](C2)C3(F)F)[C@H](C1)c1ccccc1 |r|
CC(C)[C@H]1CN(CCN1CC1CCC(CC1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r,wD:3.2,(.16,-28.21,;1.49,-27.44,;2.83,-28.21,;1.49,-25.9,;2.83,-25.13,;2.83,-23.59,;1.49,-22.82,;.16,-23.59,;.16,-25.13,;-1.17,-25.9,;-2.51,-25.13,;-2.51,-23.59,;-3.84,-22.82,;-5.18,-23.59,;-5.18,-25.13,;-3.84,-25.9,;-6.51,-22.82,;-7.84,-23.59,;-6.51,-21.28,;-6.51,-24.36,;4.16,-22.82,;5.49,-23.59,;6.83,-22.82,;6.83,-21.28,;5.49,-20.51,;4.16,-21.28,;5.49,-18.97,;5.49,-17.43,;7.03,-18.97,;3.95,-18.97,)|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CC[C@]3(CC3(F)F)CC2)[C@H](C1)c1ccccc1 |r,wU:18.19,wD:25.30,15.15,(5.49,-17.43,;5.49,-18.97,;7.03,-18.97,;3.95,-18.97,;5.49,-20.51,;6.83,-21.28,;6.83,-22.82,;5.49,-23.59,;4.16,-22.82,;4.16,-21.28,;2.83,-23.59,;1.49,-22.82,;.16,-23.59,;.16,-25.13,;-1.17,-25.9,;-2.51,-25.13,;-2.51,-23.59,;-3.84,-22.82,;-5.18,-23.59,;-6.72,-23.59,;-5.95,-22.25,;-4.86,-21.17,;-7.03,-21.17,;-5.18,-25.13,;-3.84,-25.9,;1.49,-25.9,;2.83,-25.13,;1.49,-27.44,;.16,-28.21,;.16,-29.75,;1.49,-30.52,;2.83,-29.75,;2.83,-28.21,)|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CC[C@]3(CC3(F)F)CC2)[C@@H](C1)c1ccccc1 |r,wU:25.30,18.19,wD:15.15,(5.49,-17.43,;5.49,-18.97,;7.03,-18.97,;3.95,-18.97,;5.49,-20.51,;6.83,-21.28,;6.83,-22.82,;5.49,-23.59,;4.16,-22.82,;4.16,-21.28,;2.83,-23.59,;1.49,-22.82,;.16,-23.59,;.16,-25.13,;-1.17,-25.9,;-2.51,-25.13,;-2.51,-23.59,;-3.84,-22.82,;-5.18,-23.59,;-6.72,-23.59,;-5.95,-22.25,;-4.86,-21.17,;-7.03,-21.17,;-5.18,-25.13,;-3.84,-25.9,;1.49,-25.9,;2.83,-25.13,;1.49,-27.44,;.16,-28.21,;.16,-29.75,;1.49,-30.52,;2.83,-29.75,;2.83,-28.21,)|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CC[C@@]3(CC3(F)F)CC2)[C@H](C1)c1ccccc1 |r,wU:15.15,18.19,wD:25.30,(5.49,-17.43,;5.49,-18.97,;7.03,-18.97,;3.95,-18.97,;5.49,-20.51,;6.83,-21.28,;6.83,-22.82,;5.49,-23.59,;4.16,-22.82,;4.16,-21.28,;2.83,-23.59,;1.49,-22.82,;.16,-23.59,;.16,-25.13,;-1.17,-25.9,;-2.51,-25.13,;-3.84,-25.9,;-5.18,-25.13,;-5.18,-23.59,;-6.72,-23.59,;-5.95,-22.25,;-4.86,-21.17,;-7.03,-21.17,;-3.84,-22.82,;-2.51,-23.59,;1.49,-25.9,;2.83,-25.13,;1.49,-27.44,;.16,-28.21,;.16,-29.75,;1.49,-30.52,;2.83,-29.75,;2.83,-28.21,)|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CC[C@@]3(CC3(F)F)CC2)[C@@H](C1)c1ccccc1 |r,wU:25.30,15.15,18.19,(5.49,-17.43,;5.49,-18.97,;7.03,-18.97,;3.95,-18.97,;5.49,-20.51,;6.83,-21.28,;6.83,-22.82,;5.49,-23.59,;4.16,-22.82,;4.16,-21.28,;2.83,-23.59,;1.49,-22.82,;.16,-23.59,;.16,-25.13,;-1.17,-25.9,;-2.51,-25.13,;-3.84,-25.9,;-5.18,-25.13,;-5.18,-23.59,;-6.72,-23.59,;-5.95,-22.25,;-4.86,-21.17,;-7.03,-21.17,;-3.84,-22.82,;-2.51,-23.59,;1.49,-25.9,;2.83,-25.13,;1.49,-27.44,;.16,-28.21,;.16,-29.75,;1.49,-30.52,;2.83,-29.75,;2.83,-28.21,)|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCC(O2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CCC(O2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@@H]2C[C@@H]3CC[C@H](C2)N3CC(F)(F)F)[C@@H](C1)c1ccccc1 |r,THB:23:22:15.16.21:18.19|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@@H]2C[C@@H]3CC[C@H](C2)N3CC(F)(F)F)[C@H](C1)c1ccccc1 |r,THB:23:22:15.16.21:18.19|
CC(C)[C@H]1CCC(CC1)C(=O)N1CCN(C[C@@H]1c1ccccc1)c1ccc(CCO)c(c1)S(C)(=O)=O |r,wU:3.2,wD:16.18,(-10.12,12.22,;-8.58,12.22,;-7.81,13.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;5.28,6.89,;6.05,5.56,;5.28,4.22,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CC(C)[C@H]1CCC(CC1)C(=O)N1CCN(C[C@H]1c1ccccc1)c1ccc(CCO)c(c1)S(C)(=O)=O |r,wU:16.18,3.2,(-10.12,12.22,;-8.58,12.22,;-7.81,13.56,;-7.81,10.89,;-6.27,10.89,;-5.5,9.56,;-6.27,8.22,;-7.81,8.22,;-8.58,9.56,;-5.5,6.89,;-6.27,5.56,;-3.96,6.89,;-3.19,8.22,;-1.65,8.22,;-.88,6.89,;-1.65,5.56,;-3.19,5.56,;-3.96,4.22,;-5.5,4.22,;-6.27,2.89,;-5.5,1.55,;-3.96,1.55,;-3.19,2.89,;.66,6.89,;1.43,5.56,;2.97,5.56,;3.74,6.89,;5.28,6.89,;6.05,5.56,;5.28,4.22,;2.97,8.22,;1.43,8.22,;3.74,9.56,;2.97,10.89,;5.07,10.33,;5.07,8.79,)|
CO[C@]1(CC[C@H](CN2CCN(C[C@@H]2C(C)C)c2ccc(CO)c(c2)S(C)(=O)=O)CC1)C(F)(F)F |r,wU:2.1,wD:5.5,12.13,2.32,(-4.86,4.25,;-5.95,3.16,;-5.55,1.67,;-4.06,2.07,;-2.98,.98,;-3.37,-.51,;-2.28,-1.59,;-.8,-1.2,;-.4,.29,;1.09,.69,;2.18,-.4,;1.78,-1.89,;.29,-2.28,;-.11,-3.77,;-1.59,-4.17,;.98,-4.86,;3.67,,;4.75,-1.09,;6.24,-.69,;6.64,.8,;8.13,1.2,;8.53,2.68,;5.55,1.89,;4.06,1.49,;5.95,3.37,;7.44,2.98,;6.35,4.86,;4.46,3.77,;-4.86,-.9,;-5.95,.18,;-7.04,2.07,;-8.53,2.47,;-6.64,3.56,;-7.44,.58,)|
CO[C@@]1(CC[C@H](CN2CCN(C[C@@H]2C(C)C)c2ccc(CO)c(c2)S(C)(=O)=O)CC1)C(F)(F)F |r,wU:2.32,wD:5.5,12.13,2.1,(-4.86,4.25,;-5.95,3.16,;-5.55,1.67,;-4.06,2.07,;-2.98,.98,;-3.37,-.51,;-2.28,-1.59,;-.8,-1.2,;-.4,.29,;1.09,.69,;2.18,-.4,;1.78,-1.89,;.29,-2.28,;-.11,-3.77,;-1.59,-4.17,;.98,-4.86,;3.67,,;4.75,-1.09,;6.24,-.69,;6.64,.8,;8.13,1.2,;8.53,2.68,;5.55,1.89,;4.06,1.49,;5.95,3.37,;7.44,2.98,;6.35,4.86,;4.46,3.77,;-4.86,-.9,;-5.95,.18,;-7.04,2.07,;-8.53,2.47,;-6.64,3.56,;-7.44,.58,)|
NS(=O)(=O)c1cccc(c1)N1CCN(CC2CCN(CC(F)(F)F)CC2)[C@H](C1)c1ccccc1 |r|
NS(=O)(=O)c1cccc(c1)N1CCN(CC2CCN(CC(F)(F)F)CC2)[C@@H](C1)c1ccccc1 |r|
CC(C)[C@H]1CN(CCN1C[C@H]1CC[C@H](OC1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@H]1CC[C@@H](OC1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@@H]1CC[C@H](OC1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@@H]1CC[C@@H](OC1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@H]1CC[C@@H](OC1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@@H]1CC[C@H](OC1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1C[C@@H]1CC[C@@H](OC1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cc(ccc1CO)N1CCN(C[C@@H]2CC[C@@H](OC2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@H]2CC[C@@H](OC2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(C[C@@H]2CC[C@@H](OC2)C(F)(F)F)[C@H](C1)c1ccc(F)cc1 |r|
CC(C)[C@H]1CN(CCN1C[C@H]1CC[C@H](CC1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r,wU:10.10,13.17,wD:3.2,(5.51,-26.58,;4.17,-25.81,;2.84,-26.58,;4.17,-24.27,;5.51,-23.5,;5.51,-21.96,;4.17,-21.19,;2.84,-21.96,;2.84,-23.5,;1.51,-24.27,;.17,-23.5,;-1.16,-24.27,;-2.5,-23.5,;-2.5,-21.96,;-1.16,-21.19,;.17,-21.96,;-3.83,-21.19,;-5.16,-21.96,;-3.83,-19.65,;-3.83,-22.73,;6.84,-21.19,;8.17,-21.96,;9.51,-21.19,;9.54,-19.62,;10.88,-18.87,;12.23,-18.11,;8.18,-18.84,;6.84,-19.65,;8.17,-17.3,;9.71,-17.28,;8.15,-15.76,;6.63,-17.32,)|
CC(C)[C@H]1CN(CCN1C[C@H]1CC[C@H](CC1)C(F)(F)F)c1ccc(C#N)c(c1)S(C)(=O)=O |r,wD:3.2,10.10,13.17,(5.51,-26.58,;4.17,-25.81,;2.84,-26.58,;4.17,-24.27,;5.51,-23.5,;5.51,-21.96,;4.17,-21.19,;2.84,-21.96,;2.84,-23.5,;1.51,-24.27,;.17,-23.5,;.17,-21.96,;-1.16,-21.19,;-2.5,-21.96,;-2.5,-23.5,;-1.16,-24.27,;-3.83,-21.19,;-5.16,-21.96,;-3.83,-19.65,;-3.83,-22.73,;6.84,-21.19,;8.17,-21.96,;9.51,-21.19,;9.54,-19.62,;10.88,-18.87,;12.23,-18.11,;8.18,-18.84,;6.84,-19.65,;8.17,-17.3,;9.71,-17.28,;8.15,-15.76,;6.63,-17.32,)|
CS(=O)(=O)c1cc(ccc1C#N)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r,wU:27.31,wD:17.17,20.24,(9.71,-17.28,;8.17,-17.3,;8.15,-15.76,;6.63,-17.32,;8.18,-18.84,;6.84,-19.65,;6.84,-21.19,;8.17,-21.96,;9.51,-21.19,;9.54,-19.62,;10.88,-18.87,;12.23,-18.11,;5.51,-21.96,;4.17,-21.19,;2.84,-21.96,;2.84,-23.5,;1.51,-24.27,;.17,-23.5,;.17,-21.96,;-1.16,-21.19,;-2.5,-21.96,;-2.5,-23.5,;-1.16,-24.27,;-3.83,-21.19,;-5.16,-21.96,;-3.83,-19.65,;-3.83,-22.73,;4.17,-24.27,;5.51,-23.5,;4.17,-25.81,;2.84,-26.58,;2.84,-28.12,;4.17,-28.89,;5.51,-28.12,;5.51,-26.58,)|
CS(=O)(=O)c1cc(ccc1C#N)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@H](C1)c1ccccc1 |r,wD:27.31,17.17,20.24,(9.71,-17.28,;8.17,-17.3,;8.15,-15.76,;6.63,-17.32,;8.18,-18.84,;6.84,-19.65,;6.84,-21.19,;8.17,-21.96,;9.51,-21.19,;9.54,-19.62,;10.88,-18.87,;12.23,-18.11,;5.51,-21.96,;4.17,-21.19,;2.84,-21.96,;2.84,-23.5,;1.51,-24.27,;.17,-23.5,;.17,-21.96,;-1.16,-21.19,;-2.5,-21.96,;-2.5,-23.5,;-1.16,-24.27,;-3.83,-21.19,;-5.16,-21.96,;-3.83,-19.65,;-3.83,-22.73,;4.17,-24.27,;5.51,-23.5,;4.17,-25.81,;2.84,-26.58,;2.84,-28.12,;4.17,-28.89,;5.51,-28.12,;5.51,-26.58,)|
CS(=O)(=O)c1cc(ccc1C#N)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@@H](C1)c1ccccc1 |r,wU:27.31,17.17,20.24,(9.71,-17.28,;8.17,-17.3,;8.15,-15.76,;6.63,-17.32,;8.18,-18.84,;6.84,-19.65,;6.84,-21.19,;8.17,-21.96,;9.51,-21.19,;9.54,-19.62,;10.88,-18.87,;12.23,-18.11,;5.51,-21.96,;4.17,-21.19,;2.84,-21.96,;2.84,-23.5,;1.51,-24.27,;.17,-23.5,;-1.16,-24.27,;-2.5,-23.5,;-2.5,-21.96,;-1.16,-21.19,;.17,-21.96,;-3.83,-21.19,;-5.16,-21.96,;-3.83,-19.65,;-3.83,-22.73,;4.17,-24.27,;5.51,-23.5,;4.17,-25.81,;2.84,-26.58,;2.84,-28.12,;4.17,-28.89,;5.51,-28.12,;5.51,-26.58,)|
CS(=O)(=O)c1cc(ccc1C#N)N1CCN(C[C@H]2CC[C@H](CC2)C(F)(F)F)[C@H](C1)c1ccccc1 |r,wU:17.17,20.24,wD:27.31,(9.71,-17.28,;8.17,-17.3,;8.15,-15.76,;6.63,-17.32,;8.18,-18.84,;6.84,-19.65,;6.84,-21.19,;8.17,-21.96,;9.51,-21.19,;9.54,-19.62,;10.88,-18.87,;12.23,-18.11,;5.51,-21.96,;4.17,-21.19,;2.84,-21.96,;2.84,-23.5,;1.51,-24.27,;.17,-23.5,;-1.16,-24.27,;-2.5,-23.5,;-2.5,-21.96,;-1.16,-21.19,;.17,-21.96,;-3.83,-21.19,;-5.16,-21.96,;-3.83,-19.65,;-3.83,-22.73,;4.17,-24.27,;5.51,-23.5,;4.17,-25.81,;2.84,-26.58,;2.84,-28.12,;4.17,-28.89,;5.51,-28.12,;5.51,-26.58,)|
CC(C)[C@H]1CN(CCN1CC1CCCOC1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1CC1CCOCC1)c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1CN(CCN1CC1CCC(C)(C)OC1)c1cccc(c1)S(C)(=O)=O |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCCOC2)[C@H](C1)c1ccccc1 |r|
CS(=O)(=O)c1cccc(c1)N1CCN(CC2CCOCC2)[C@H](C1)c1ccccc1 |r|
CO[C@@H]1CC[C@H](CN2CCN(C[C@@H]2C(C)C)c2ccc(CO)c(c2)S(C)(=O)=O)CC1 |r,wD:5.5,12.13,2.1,(-8.67,-.67,;-7.34,.1,;-6,-.67,;-4.67,.1,;-3.33,-.67,;-3.33,-2.21,;-2,-2.98,;-.67,-2.21,;-.67,-.67,;.67,.1,;2,-.67,;2,-2.21,;.67,-2.98,;.67,-4.52,;-.67,-5.29,;2,-5.29,;3.33,.1,;4.67,-.67,;6,.1,;6,1.64,;7.34,2.41,;8.67,1.64,;4.67,2.41,;3.33,1.64,;4.67,3.95,;6.16,3.55,;5.44,5.29,;3.18,4.35,;-4.67,-2.98,;-6,-2.21,)|
CO[C@@H]1CC[C@H](CN2CCN(C[C@@H]2C(C)C)c2ccc(CO)c(c2)S(C)(=O)=O)CC1 |r,wU:5.5,2.1,wD:12.13,(-8.67,-.67,;-7.34,.1,;-6,-.67,;-6,-2.21,;-4.67,-2.98,;-3.33,-2.21,;-2,-2.98,;-.67,-2.21,;-.67,-.67,;.67,.1,;2,-.67,;2,-2.21,;.67,-2.98,;.67,-4.52,;-.67,-5.29,;2,-5.29,;3.33,.1,;4.67,-.67,;6,.1,;6,1.64,;7.34,2.41,;8.67,1.64,;4.67,2.41,;3.33,1.64,;4.67,3.95,;6.16,3.55,;5.44,5.29,;3.18,4.35,;-3.33,-.67,;-4.67,.1,)|
CC(C)[C@H]1CN(CCN1CC1CCC(N(C)C1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O |r|
CC1(C)CCC(O)(CN2CCN(C[C@@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)CC1 |r|
CC1(C)CCC(O)(CN2CCN(C[C@H]2c2ccccc2)c2cccc(c2)S(C)(=O)=O)CC1 |r|
CC(C)[C@@H]1CN(CCN1c1nccc(n1)C(F)(F)F)c1ccc(CNC(C)=O)c(c1)S(C)(=O)=O |r|
CC(C)[C@@H]1CN(CCN1c1ncc(CNC(C)=O)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
CC(C)C1N(CCn2c1nc1ccc(cc21)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |w:3.2|
CC(C)Cn1nc(cc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CC(C)Cn1nc(cc1-c1ccc(cc1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(F)(F)F
CC(C)Cn1nc(cc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(=O)NCC(F)(F)F
CCOC(=O)c1cc(-c2ccc(cc2)-c2ccc(CO)c(c2)S(C)(=O)=O)n(CC(C)C)n1
CCOC(=O)c1cn(c(CC(C)C)n1)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
CC(C)Cn1nc(cc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(C)=C
CCOC(=O)c1cc(-c2ccc(cc2)-c2cccc(c2)S(C)(=O)=O)n(CC(C)C)n1
CC(C)Cn1nc(cc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(C)C
CS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1cc(nn1CC1CC1)C(F)(F)F
CCC(C)n1nc(cc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1cc(nn1C1CCCCC1)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1cc(nn1CC1CCCCC1)C(F)(F)F
CC(CCOc1cccc(CC(O)=O)c1)N(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F
Fc1ccc(cc1)-c1n(Cc2ccc(F)cc2Cl)nc2c(cccc12)C(F)(F)F
CC(C)(c1cn(c(n1)C(C)(C)c2c(cccc2Cl)Cl)c3ccc(cc3F)c4cc(c(c(c4)S(=O)(=O)C)CO)F)O
CC(C)(O)c1cn(c(n1)C(C)(C)c1ccccc1Cl)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
CON(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
C[C@H](CCC(=O)N1CCNCC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
C[C@H](CCC(=O)N1CCN(CC1)C(C)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:22|
C[C@H](CCC(=O)N1CCN(CC1)C(N)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:22|
C[C@H](CCC(=O)N1CCC(C)(C)CC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:21|
C[C@H](CCC(=O)N1CCC(C)(O)CC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:21|
C[C@H](CCC(=O)N1CCOCC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
C[C@H](CCC(=O)N1CCSCC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
C[C@H](CCC(=O)N1CCS(=O)(=O)CC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:21|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C)OCC |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(CC)OC |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(CCC)OC |r,t:9|
CC(C)ON(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:18|
CON(C(C)C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:18|
CCCCON(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
CCCCN(OC)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
C[C@H](CCC(=O)N1CCS(=O)CC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:20|
C[C@H](CC[C@](O)(C=C)C(F)(F)F)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |t:18|
C[C@H](CC[C@@](O)(C=C)C(F)(F)F)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |t:18|
COCCON(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C)OCCN
C[C@H](CCC(=O)N(C)OCCC(F)(F)F)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:21|
C[C@H](CCC(=O)N(C)OCCCO)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:19|
COCCCON(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:20|
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C[C@H](CCC(=O)N1CCN(CC1)c1cc(N)ncn1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:27|
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C[C@H](CCC(=O)N(C)c1ccncc1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:21|
C[C@H](CCC(=O)N1CCN(CC1)c1cccnc1O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:27|
C[C@H](CCC(=O)N[C@H]1CC[C@H](CC1)C(=O)N(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,wU:7.6,10.13,27.28,31.33,33.36,36.41,18.18,21.21,wD:1.0,22.23,t:25,(-.63,-25.47,;.41,-26.61,;1.92,-26.31,;2.4,-24.85,;3.9,-24.49,;4.96,-25.61,;4.39,-22.83,;5.91,-22.54,;6.41,-21.08,;7.92,-20.79,;8.93,-21.96,;8.43,-23.41,;6.91,-23.7,;10.43,-21.62,;11.44,-22.79,;10.92,-20.16,;12.43,-19.86,;9.89,-19.01,;-.04,-28.08,;.86,-29.33,;-.04,-30.58,;-1.51,-30.1,;-2.84,-30.87,;-2.84,-32.41,;-4.18,-33.18,;-5.51,-32.41,;-6.84,-33.18,;-8.18,-32.41,;-9.49,-33.22,;-8.18,-30.87,;-6.84,-30.1,;-5.51,-30.87,;-5.48,-29.33,;-4.18,-30.1,;-4.18,-28.56,;-2.84,-27.79,;-1.51,-28.56,;-1.48,-27.02,)|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C)C1CCN(CC1)C(=O)C1CC1 |r,t:9|
COC(=O)N1CCC(CC1)N(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:25|
C[C@H](CCC(=O)N(C)C1CCN(CC1)C(=O)N(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:26|
C[C@H](CCC(=O)N(C)C1CCN(CC1)C(=O)N1CCCC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:29|
COc1cc(ncn1)N1CCN(C[C@@H]1C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:29|
C[C@H](CCC(=O)N1CCN([C@@H](C)C1)c1ccnc(C)n1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
COc1cc(ncn1)N1CCN([C@@H](C)C1)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:29|
C[C@H](CCC(=O)N1CCN(C[C@@H]1C)c1ccnc(C)n1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
C[C@H](CCC(=O)N1CCN([C@@H](C)C1)C(=O)C1CC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:26|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCN(C[C@@H]1C)C(=O)C1CC1 |r,t:9|
C[C@H](CCC(=O)N1CCN([C@@H](C)C1)C(=O)C(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:26|
C[C@H](CCC(=O)N1CCN(C[C@@H]1C)C(=O)C(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:26|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCN([C@@H](C)C1)C(=O)N1CCCC1 |r,t:9|
C[C@H](CCC(=O)N1CCN(C[C@@H]1C)C(=O)N1CCCC1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
C[C@H](CCC(=O)N1CCN([C@@H](C)C1)c1cnn(C)c1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:27|
COc1ccnc(c1)N1CCN(CC1)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
C[C@H](CCC(=O)N1CCN(CC1)c1cc(C)ccn1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:27|
COc1cccc(n1)N1CCN(CC1)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
COc1cncc(c1)N1CCN(CC1)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
C[C@H](CCC(=O)N1CCN(CC1)c1cncc(C)c1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:27|
COc1cncc(n1)N1CCN(CC1)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:28|
C[C@H](CCC(=O)N1CCN(CC1)c1cc(ncn1)N(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:29|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCN(CC1)C(=O)N1CC(C)C1 |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCN(CC1)C(=O)N1CC[C@@H]1C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCN(CC1)C(=O)N1CCC[C@@H]1C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCN(CC1)C(=O)N1CC[C@@H](C)C1 |r,t:9|
CCN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)C(C)(C(=O)OC)c1ccccc1
CCN(C(C(=O)N1CCOCC1)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COc1ccc(cc1)C(O)=O)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F)C(CC)(C(=O)OC)c1ccccc1
CCN(CC(O)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
COC(=O)C1(CCCCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)c1ccccc1
CCN([C@H](CO)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)C(CC)(C(=O)OC)c1ccccc1
CCN(C(C(=O)N1CCCCC1)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN([C@@H](CO)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
OC(c1ccc(N(Cc2ccccc2)CC(F)(F)F)c(Cl)c1)(C(F)(F)F)C(F)(F)F
CCN(C(C(=O)N(C)C)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1nc(oc1C)-c1cccc(Cl)c1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COc1ccc(CC(O)=O)cc1)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(CO)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1nc(oc1C)-c1cccc(c1)C(F)(F)F)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Cc1oc(nc1CN(CC(F)(F)F)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)-c1cccc(Cl)c1
CCN(C(COc1ccc(CC(=O)OC)cc1)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(CO)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(CCc1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COCC(=O)NC)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1ccncc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1cccnc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1nc(oc1C)-c1cccc(c1)C(F)(F)F)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COCC(=O)N(C)C)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1nc(oc1C)-c1cccc(Cl)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COc1ccc(CCC(O)=O)cc1)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COc1ccc(cc1)C(=O)OC)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COCC(O)=O)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
OC(c1ccc(cc1)N(Cc1ccccc1)CC(F)(F)F)(C(F)(F)F)C(F)(F)F
CCN(C(COCC(=O)OC)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COCCO)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COc1ccc(CCC(=O)OC)cc1)c1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(C(=O)OC)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1cscn1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
Cc1oc(nc1CN(CC(F)(F)F)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)-c1cccc(c1)C(F)(F)F
CCN(Cc1ccccc1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(CCc1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1ccccn1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(Cc1cscn1)c1ccc(cc1Cl)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COCc1ccccc1)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(COC)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(C(=O)NC)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(C(C(O)=O)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)C(C)(C(=O)N(C)C)c1ccccc1
COC(=O)C1(CCCN1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)c1ccccc1
CCCCN(Cc1cc(Cl)c(O)c(OC)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cc(Cl)cc(Cl)c1O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
OC(c1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1ccncc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1ccccn1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cc(Cl)cc(Cl)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cc(Cl)c(O)c(Cl)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCC[N@](Cc1cc(c(c(c1)Cl)OC)OC)c2ccc(cc2)C(C(F)(F)F)(C(F)(F)F)O
CCCCN(Cc1cc(OC(F)(F)F)ccc1O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cccc(CCO)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cc(Cl)c(OC)c(Cl)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1ccccc1O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1ccc(O)cc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cccc(O)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cccc(F)c1O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1cc(Cl)ccc1O)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1ccc(O)c(Cl)c1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCCN(Cc1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CN(Cc1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CC(C)CN(Cc1ccc(s1)-c1cccc(c1)S(C)(=O)=O)S(=O)(=O)Cc1ccccc1
CC(C)CN(Cc1ccc(s1)-c1ccc(cc1)S(C)(=O)=O)S(=O)(=O)Cc1ccccc1
CC(C)CN(Cc1ccc(cc1)-c1ccc(cc1)S(C)(=O)=O)S(=O)(=O)Cc1ccccc1
CC(C)CN(Cc1ccc(cc1)-c1ccc(NS(C)(=O)=O)cc1)S(=O)(=O)Cc1ccccc1
CC(C)CN(Cc1ccc(cc1)-c1ccc(cc1)C(N)=O)S(=O)(=O)Cc1ccccc1
CCCCn1c2ccc(cc2c2cc(Cl)ccc2c1=O)C(O)(C(F)(F)F)C(F)(F)F
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)OCc1ccccc1
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)NCC1(CCCCC1)c1ccccc1
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NCC1(CCCCC1)c1ccccc1
C[C@@H]1[C@H]2C[C@@H](C[C@H]1NC(=O)[C@@]1(C)CCC[C@@]3(C)[C@H]1CCc1ccc(O)cc31)C2(C)C
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)CC(=O)C12CC3CC(CC(C3)C1)C2 |TLB:24:25:29:22.23.28,THB:24:23:29:30.25.26,26:25:22:29.27.28,26:27:22:30.25.24|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:27:22:29:26.28.25,27:26:29:22.21.23,23:24:28:22.21.27,THB:23:22:28:24.29.25|
CC1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21
CC(NC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C12CC3CC(CC(C3)C1)C2 |TLB:25:26:30:23.24.29,THB:25:24:30:31.26.27,27:28:23:31.26.25,27:26:23:30.28.29|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)NC(=O)C1(CCCCC1)c1ccccc1
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)NC(=O)C12CC3CC(CC(C3)C1)C2 |TLB:24:25:29:22.23.28,THB:24:23:29:30.25.26,26:25:22:29.27.28,26:27:22:30.25.24|
CC(CNC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccccc21)(c1ccccc1)c1ccccc1
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC(CC1)c1ccccc1
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NC1C2CC3CC(C2)CC1C3 |wU:1.19,7.8,5.5,wD:1.0,TLB:19:20:23.22.29:25.26.27,19:20:27:23.29.24,22:23:20.21.26:27,THB:24:23:20:25.26.27,24:25:20:23.22.29,22:21:27:23.29.24,(4.72,-6.63,;3.97,-5.3,;2.62,-4.51,;2.64,-2.96,;4,-2.2,;5.32,-2.99,;5.3,-1.45,;5.3,-4.53,;6.63,-5.3,;7.99,-4.53,;7.98,-2.99,;9.32,-2.22,;9.32,-.68,;7.98,.09,;7.96,1.63,;6.65,-.68,;6.65,-2.22,;2.88,-6.37,;1.38,-5.98,;2.97,-7.91,;1.69,-8.76,;.15,-8.73,;-.65,-10.04,;.1,-11.39,;.08,-12.93,;1.17,-11.86,;.5,-10.23,;2.67,-11.49,;2.43,-10.1,;1.64,-11.42,)|
CC1(C)C2CC1C(CC2)NC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21 |THB:9:6:1:4|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)OCCC=C
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)OCC=C
CC(=O)Oc1ccc2CC[C@H]3C(C)(CCC[C@]3(C)c2c1)C(=O)OC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(OC(C)=O)cc21
CCOC(=O)C12CC3CC(CC(C3)(C1)NC(=O)[C@@]1(C)CCC[C@@]3(C)[C@H]1CCc1ccc(O)cc31)C2 |TLB:8:9:13:6.7.12,3:5:10:7.12.8,THB:8:7:13:34.9.10,6:5:10:7.12.8,6:7:5.13.34:10|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NC1CC2CCC1C2 |TLB:19:20:26:24.23|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NCC12CC3CC(CC(C3)C1)C2 |r,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)N1C2CCCCC2C2CCCCC12
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC2(CC1)C=Cc1ccccc21 |c:28|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCCC(C1)c1ccccc1
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)OCCCC=C
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)NCCc1ccccc1
CCCc1c(OCCCn2ncc3cc(CC(O)=O)ccc23)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2cnc(CC(O)=O)cn2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCOc2ccc(CC(O)=O)cc2Cl)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ncc(CC(O)=O)cn2)ccc2c(noc12)C(F)(F)F
CCCc1c(ccc2c1onc2C(F)(F)F)OCCCSc3ccc(cc3Cl)CC(=O)O
CCCc1c(OCCCN(C)c2ccccc2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCNc2ccc(CC(O)=O)cc2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)cc2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)c(Cl)c2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)c(C)c2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ncc(CC(O)=O)s2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN2C(=O)Cc3cc(CC(O)=O)ccc23)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCn2ccc3cc(CC(O)=O)ccc23)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(cc2)C(O)=O)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)c(c2)C(F)(F)F)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)cn2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCn2cnc3cc(CC(O)=O)ccc23)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN2C(=O)Cc3cc(ccc23)C(O)=O)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)cc2C)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2cccc(CC(O)=O)c2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCn2ccc3cc(ccc23)C(O)=O)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCn2ccc3cc(CCC(O)=O)ccc23)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCCc2ccc(CC(O)=O)cc2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCn2nnc3cc(CC(O)=O)ccc23)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(C)c2ccc(CC(O)=O)cc2Cl)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCN(CC)c2ccc(CC(O)=O)cc2)ccc2c(noc12)C(F)(F)F
CCCc1c(OCCCOc2ccc(CC(O)=O)cc2)ccc2c(noc12)C(F)(F)F
CC(C)(C)c1ccc(CC(C(O)=O)c2ccc(COc3cccc(c3)-c3ccc(c4ncc(cc34)C(=O)c3ccccc3)C(F)(F)F)cc2)cc1 |w:9.8|
OC(=O)C(Cc1ccc(cc1)-c1ccccc1)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1 |w:3.3|
OC(=O)Cc1ccc(COc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)cc1
CC#CCC(C(O)=O)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1 |w:4.3|
OC(=O)C(CC=C)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1 |w:3.3|
Cc1cc(OCc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)c(C)cc1CC(O)=O
Cc1cc(NCc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)c(C)cc1CC(O)=O
Cc1c(C)c(NCc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)ccc1CC(O)=O
CCC#CCC(C(O)=O)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1 |w:5.4|
OC(=O)C(CC#C)(CC#C)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1
CCC#CCC(CC#CCC)(C(O)=O)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1
Cc1cc(CC(O)=O)c(C)cc1COc1cccc(c1)-c1c(Cc2ccccc2)cnc2c(cccc12)C(F)(F)F
OC(=O)Cc1cccc2c(NCc3cccc(c3)-c3ccnc4c(cccc34)C(F)(F)F)cccc12
OC(=O)Cc1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1
Cc1cnc2c(cccc2c1-c1cccc(CNc2cccc3c(CC(O)=O)cccc23)c1)C(F)(F)F
OC(=O)Cc1ccc(NCc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)c2ccccc12
OC(=O)Cc1cccc2c(OCc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)cccc12
OC(=O)Cc1cccc2c(NCc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)cccc12
OC(=O)C(Cc1ccccc1)c1ccc(COc2cccc(c2)-c2ccc(c3ncc(cc23)C(=O)c2ccccc2)C(F)(F)F)cc1 |w:3.3|
OC(=O)c1cccc2c(NCc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)cccc12
OC(=O)Cc1ccc(NCc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)cc1
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6@H]1-[#6][C@@]2([#6]\[#6]=[#6](\[#6])-[#6])[#6](=O)-[#6](-[#6](=O)-c3ccc(-[#8])c(-[#8])c3)-[#6](=O)[C@]([#6]\[#6]=[#6](\[#6])-[#6])([#6]2=O)[C@]1([#6])[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r,THB:40:39:31.20.18:10.41.11|
C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)[C@@H](CCC(C)C)O
C[C@@]1(CC=C2[C@@H](CC[C@@H]3[C@@](C)(CCC[C@@]23C)C(=O)NCC23CC4CC(CC(C4)C2)C3)C1)C=C |r,c:3,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20|
CC(=O)Oc1ccc2CC[C@H]3[C@](C)(CCC[C@]3(C)c2c1)C(=O)OC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(OC(C)=O)cc21 |r|
C[C@H](CC\C=C(/C)C(O)=O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@@H](O)C4(C)C)[C@]3(C)CC[C@]12C |r,c:17|
[#6]-[#6@H](-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@H]1-[#6]-[#6@H](-[#8])[C@@]2([#6])[#6]-3=[#6]-[#6]-[#6@H]4C([#6])([#6])[#6@@H](-[#8])-[#6]-[#6][C@]4([#6])[#6]-3=[#6]-[#6][C@]12[#6] |r,c:29,t:14|
C[C@@]1(CC=C2[C@@H](CC[C@@H]3[C@](C)(CO)CCC[C@@]23C)C1)C=C |r,c:3|
C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(O)=O |r|
C[C@@]1(CC=C2[C@@H](CC[C@@H]3[C@@](C)(CCC[C@@]23C)C(O)=O)C1)C=C |r,c:3|
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C(=O)O
Cc1cc(O)cc2O[C@@]3(C)Cc4cc5c(C(=O)c6c(O)cc(O)cc6C5(C)C)c(O)c4[C@H](O3)c12 |r|
COc1cc(C)c2[C@H]3O[C@](C)(Cc4cc5c(C(=O)c6c(O)c(Cl)c(O)c(Cl)c6C5(C)C)c(O)c34)Oc2c1 |r|
C[C@H](CC[C@@H]1OC1(C)C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |t:16|
CN(c1ccc(NC(=O)C(C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccc(cc1)C#N
COC(=O)c1ccc(cc1)S(=O)(=O)N(C)c1ccc(NC(=O)C(C)(O)C(F)(F)F)c(Cl)c1
CN(c1ccc(NC(=O)[C@](C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccccc1 |r|
CN(c1ccc(NC(=O)C(C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccc(cc1)C(O)=O
COC(=O)CCc1ccc(cc1)S(=O)(=O)N(C)c1ccc(NC(=O)C(C)(O)C(F)(F)F)c(Cl)c1
CN(c1ccc(NC(=O)[C@](C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccccc1Cl |r|
CN(c1ccc(NC(=O)[C@](C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccc(C)cc1 |r|
CCN(c1ccc(NC(=O)C(C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccccc1Cl
CC(O)(C(=O)Nc1ccc(cc1Cl)N(Cc1ccccc1)S(=O)(=O)c1ccccc1Cl)C(F)(F)F
CN(c1ccc(NC(=O)C(C)(O)C(F)(F)F)c(Cl)c1)S(=O)(=O)c1ccc(CCC(O)=O)cc1
CC(O)(C(=O)Nc1ccc(cc1Cl)N(CC1CC1)S(=O)(=O)c1ccccc1Cl)C(F)(F)F
CC(O)(C(=O)Nc1ccc(cc1Cl)N(CC=C)S(=O)(=O)c1ccccc1Cl)C(F)(F)F
Cn1c(CNc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)cc2ccccc12
FC(F)(F)c1cccc(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1
Fc1ccc(c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)c1)C(F)(F)F
FC(F)(F)c1cccc(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1Cl
Fc1ccc(c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1)C(F)(F)F
FC(F)(F)c1cccc2c(c(Cc3ccccc3)cnc12)-c1cccc(NCc2cccc3cc[nH]c23)c1
FC(F)(F)c1ccc(Cl)cc1COc1cccc(c1)-c1c(Cc2ccccc2)nnc2c(cccc12)C(F)(F)F
FC(F)(F)c1cccc(CNc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1Cl
Fc1c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)cccc1C(F)(F)F
Fc1ccc(c(CNc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1)C(F)(F)F
Clc1ccccc1COc1cccc(c1)-c1c(Cc2ccccc2)nnc2c(Cl)cccc12
Cn1c(CNc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)cc2ccccc12
Clc1cccc2c(c(Cc3ccccc3)nnc12)-c1cccc(OCc2ccccc2)c1
Cn1ccc2cccc(COc3cccc(c3)-c3c(Cc4ccccc4)nnc4c(cccc34)C(F)(F)F)c12
FC(F)(F)c1ccc(Cl)cc1COc1cccc(c1)-c1c(nnc2c(Cl)cccc12)-c1ccccc1
FC(F)(F)c1cccc(CNc2cccc(c2)-c2c(nnc3c(Cl)cccc23)-c2ccccc2)c1Cl
Cn1c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)cc2ccccc12
FC(F)(F)c1cccc(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(cccc23)C(F)(F)F)c1Cl
FC(F)(F)c1ccc(Cl)cc1COc1cccc(c1)-c1c(Cc2ccccc2)nnc2c(Cl)cccc12
Cn1ccc2cccc(CNc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)c12
Cn1ccc2cccc(COc3cccc(c3)-c3c(Cc4ccccc4)cnc4c(cccc34)C(F)(F)F)c12
Cn1ccc2cccc(CNc3cccc(c3)-c3c(Cc4ccccc4)nnc4c(Cl)cccc34)c12
FC(F)(F)c1ccc(Cl)c(COc2cccc(c2)-c2c(Cc3ccccc3)nnc3c(Cl)cccc23)c1
Cn1ccc2cccc(CNc3cccc(c3)-c3c(nnc4c(Cl)cccc34)-c3ccccc3)c12
COc1ccc(CCc2cccc(c2)N2C(=O)c3ccccc3C2=O)cc1OC
O=C1N(C(=O)c2ccccc12)c1cccc(CCc2ccccc2)c1
Oc1cccc(CCc2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)c1
COc1cccc(CCc2ccc(cc2)N2C(=O)c3ccccc3C2=O)c1
Oc1ccc(CCc2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1O
Oc1ccc(\C=C\c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1O
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccc(\C=C\c2ccccc2)cc1
Oc1ccc(CCc2cccc(c2)N2C(=O)c3ccccc3C2=O)cc1O
Oc1ccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1
Oc1ccc(CCc2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1O
COc1ccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1OC
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1cccc(CCc2ccccc2)c1
COc1ccc(\C=C\c2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1OC
COc1cccc(CCc2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)c1
Oc1ccc(CCc2ccccc2N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1O
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1CCc1ccccc1
COc1ccc(\C=C\c2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1OC
Oc1ccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1O
Oc1ccc(CCc2ccccc2N2C(=O)c3ccccc3C2=O)cc1O
Oc1ccc(\C=C\c2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1O
COc1ccc(CCc2ccccc2N2C(=O)c3ccccc3C2=O)cc1OC
COc1ccc(\C=C\c2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1OC
COc1ccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1
COc1ccc(CCc2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1cccc(\C=C\c2ccccc2)c1
Oc1cccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)c1
Oc1ccc(CCc2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
COc1ccc(CCc2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1OC
Oc1ccc(CCc2ccc(cc2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1
COc1cccc(CCc2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)c1
O=C1N(C(=O)c2ccccc12)c1ccc(CCc2ccccc2)cc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccc(CCc2ccccc2)cc1
Oc1cccc(CCc2ccc(cc2)N2C(=O)c3ccccc3C2=O)c1
Oc1ccc(\C=C\c2cccc(c2)N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1O
COc1ccc(CCc2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1
COc1ccc(CCc2ccccc2N2C(=O)c3c(C2=O)c(Cl)c(Cl)c(Cl)c3Cl)cc1OC
O=C1N(C(=O)c2ccccc12)c1ccc(\C=C\c2ccccc2)cc1
COc1ccc(CCc2ccc(cc2)N2C(=O)c3ccccc3C2=O)cc1OC
C[C@H](CCOc1cccc(CC(O)=O)c1)N(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F |r|
C[C@@H](CCOc1cccc(CC(O)=O)c1)N(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F |r|
OC(=O)Cc1ccc2oc(CCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)cc2c1
CC(C)(C(O)=O)c1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
OC(=O)Cc1ccc2cc(CCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)oc2c1
CCC(CC)(C(O)=O)c1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
CC(C(O)=O)c1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
OC(=O)C1CCCc2c(OCCCN(CC(c3ccccc3)c3ccccc3)Cc3cccc(c3Cl)C(F)(F)F)cccc12
C[C@@H](COc1cccc(CC(O)=O)c1)CN(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F |r|
C[C@H](CCOc1cccc(c1)C(C)(C)C(O)=O)N(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F |r|
C[C@H](CCN(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F)Oc1cccc(CC(O)=O)c1 |r|
C[C@@H](CCN(CC(c1ccccc1)c1ccccc1)Cc1cccc(c1Cl)C(F)(F)F)Oc1cccc(CC(O)=O)c1 |r|
Cc1cnc2c(cccc2c1-c1cccc(Oc2cccc(CO)c2)c1)C(F)(F)F
Cc1cnc2c(Cl)cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1
Cc1cnc2c(cccc2c1-c1cccc(Oc2cc(Cl)cc(c2)S(C)(=O)=O)c1)C(F)(F)F
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(cccc23)C(F)(F)F)c1
Cc1cnc2c(cccc2c1-c1cccc(Oc2cc(F)cc(c2)S(C)(=O)=O)c1)C(F)(F)F
Cc1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
Cc1cnc2c(cccc2c1-c1cccc(Oc2ccc(cc2)S(C)(=O)=O)c1)C(F)(F)F
CC(C)CCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)c1
COc1ccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)cc1S(C)(=O)=O
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(Cc3ccccc3)cnc3c(Cl)cccc23)c1
CC(C)CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)c1
CNC(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(Cl)cccc23)c1
COCCCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)c1
Cc1cnc2c(cccc2c1-c1cccc(Oc2ccccc2S(C)(=O)=O)c1)C(F)(F)F
CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-c2ccnc3c(cccc23)C(F)(F)F)c1
Cc1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCC(C)(C)O)c1)C(F)(F)F
CCCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)c1
CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)c1
CCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)cnc3c(cccc23)C(F)(F)F)c1
Cc1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCCO)c1)C(F)(F)F
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2ccnc3c(Cl)cccc23)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2ccnc3c(cccc23)C(F)(F)F)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=O)c1
CCNC(=O)c1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CNC(=O)c1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CCOC(=O)c1cnc2c(cccc2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CS(=O)(=O)c1cc(Cl)cc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=O)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(CN)cnc3c(cccc23)C(F)(F)F)c1
CS(=O)(=O)c1cc(F)cc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=O)c1
CCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=O)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3ccccc23)C(N)=O)c1
CCCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=O)c1
Cc1cccc2c(-c3cccc(Oc4cccc(c4)S(C)(=O)=O)c3)c(cnc12)C(N)=O
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(Cl)cccc23)C(N)=O)c1
CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=O)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(F)cccc23)C(N)=O)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(O)=O)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)-n2cnnn2)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C#N)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(cnc3c(cccc23)C(F)(F)F)C(N)=N)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2cnc3c(cccc23)C(F)(F)F)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)C(F)(F)F)c1
CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2c(C)nc3c(Cl)cccc23)c1 |(17.87,-44.13,;16.53,-44.9,;16.53,-46.44,;15.21,-44.13,;16.29,-43.03,;14.11,-43.03,;13.89,-44.92,;13.91,-46.46,;12.58,-47.24,;11.24,-46.49,;11.23,-44.95,;9.89,-44.19,;8.57,-44.97,;7.22,-44.21,;5.88,-45.01,;5.9,-46.55,;4.58,-47.33,;7.24,-47.3,;8.58,-46.52,;7.26,-48.85,;8.17,-50.09,;9.7,-50.09,;7.26,-51.34,;5.79,-50.86,;4.46,-51.64,;4.47,-53.18,;3.13,-50.87,;3.13,-49.33,;4.46,-48.56,;5.79,-49.32,;12.55,-44.16,)|
CC(C)Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CCS(=O)(=O)c1cc(F)cc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1
CC(C)c1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
Cc1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)C2CC2)c1
Cc1nc2c(cccc2n1-c1cccc(Oc2cc(F)cc(c2)S(C)(=O)=O)c1)C(F)(F)F
CCc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(C)(=O)=O)ccc1Cl |(26.98,-36.72,;25.44,-36.72,;24.53,-37.97,;23.07,-37.49,;21.74,-38.27,;21.74,-39.81,;20.4,-37.5,;20.41,-35.96,;21.73,-35.19,;23.07,-35.95,;24.53,-35.48,;24.52,-33.93,;25.85,-33.15,;25.84,-31.61,;27.16,-30.83,;28.5,-31.59,;28.51,-33.12,;29.85,-33.88,;31.17,-33.1,;31.16,-31.55,;29.82,-30.8,;32.48,-30.76,;33.8,-31.53,;33.56,-29.67,;31.38,-29.67,;24.49,-30.85,;23.16,-31.64,;23.18,-33.18,;21.86,-33.97,)|
CCS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2c(C)nc3c(Cl)cccc23)c1 |(3.48,-43.65,;2.14,-44.41,;.82,-43.64,;1.9,-42.55,;-.28,-42.55,;-.5,-44.43,;-.48,-45.97,;-1.81,-46.75,;-3.15,-46,;-3.15,-44.46,;-4.49,-43.71,;-5.82,-44.49,;-7.16,-43.73,;-8.5,-44.52,;-8.48,-46.06,;-9.8,-46.84,;-7.14,-46.81,;-5.8,-46.03,;-7.12,-48.35,;-6.22,-49.6,;-4.68,-49.6,;-7.12,-50.85,;-8.59,-50.37,;-9.92,-51.15,;-9.91,-52.69,;-11.26,-50.38,;-11.26,-48.84,;-9.92,-48.07,;-8.59,-48.83,;-1.84,-43.68,)|
CCS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1
CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1
CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1
Cc1nc2c(cccc2n1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCCO)c1)C(F)(F)F
Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cc(F)cc(c2)S(C)(=O)=O)ccc1Cl |(24.36,-49.54,;22.82,-49.54,;21.92,-50.79,;20.45,-50.31,;19.12,-51.09,;19.12,-52.63,;17.79,-50.32,;17.79,-48.78,;19.12,-48.01,;20.45,-48.77,;21.92,-48.29,;21.9,-46.75,;23.24,-45.97,;23.22,-44.42,;24.55,-43.64,;25.89,-44.4,;25.9,-45.93,;27.23,-46.69,;27.25,-48.23,;28.56,-45.91,;28.54,-44.36,;27.2,-43.61,;29.86,-43.58,;31.19,-44.35,;30.95,-42.48,;28.76,-42.48,;21.88,-43.66,;20.54,-44.46,;20.56,-46,;19.24,-46.78,)|
CCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(Cl)cccc23)c1
Cc1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)c1
Cc1nc2c(Cl)cccc2n1-c1cc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)ccc1Cl |(40.06,-46.33,;38.52,-46.33,;37.61,-47.58,;36.15,-47.1,;34.82,-47.88,;34.82,-49.42,;33.48,-47.11,;33.49,-45.57,;34.81,-44.8,;36.15,-45.56,;37.61,-45.09,;37.6,-43.54,;38.93,-42.76,;38.92,-41.22,;40.25,-40.44,;41.58,-41.2,;41.59,-42.73,;42.93,-43.49,;44.26,-42.71,;44.24,-41.16,;42.9,-40.41,;45.56,-40.37,;46.64,-39.28,;44.46,-39.28,;46.88,-41.14,;48.22,-40.38,;46.88,-42.68,;48.37,-41.54,;37.57,-40.46,;36.24,-41.25,;36.26,-42.79,;34.94,-43.58,)|
CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(Cl)cccc23)c1
Cc1nc2ccccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1
CC(C)c1nc2c(Cl)cccc2n1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1
CCCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1
CCS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(C)nc3c(cccc23)C(F)(F)F)c1
CS(=O)(=O)c1cccc(Oc2ccc(Cl)c(c2)-n2cnc3c(cccc23)C(F)(F)F)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(nc3c(cccc23)C(F)(F)F)-c2ccccc2)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-n2c(Cc3ccc(F)cc3)nc3c(cccc23)C(F)(F)F)c1
CCc1nc2c(cccc2nc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CNC(=O)c1cccc(c1)-c1ccc(cc1)-c1nc2cccc(c2nc1C)C(F)(F)F
CNS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1nc2cccc(c2nc1C)C(F)(F)F
COc1cccc2nc(c(C)nc12)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
Cc1nc2c(Cl)cccc2nc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
Cc1nc2c(cccc2nc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C#N
CS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1cnc2c(cccc2n1)C(F)(F)F
CCS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1nc2cccc(c2nc1C)C(F)(F)F
Cc1nc2c(cccc2nc1-c1cccc(c1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F
Cc1nc2c(cccc2nc1-c1ccc(cc1)-c1ccccc1S(C)(=O)=O)C(F)(F)F
Cc1nc2c(cccc2nc1-c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
Cc1nc2c(cccc2nc1-c1ccc(cc1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F
Cc1nc2c(cccc2nc1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1cccc(c1)-c1c(Cc2ccccc2)cnc2c(cccc12)C(F)(F)F
CS(=O)(=O)c1ccc(cc1)-c1cccc(c1)-c1c(Cc2ccccc2)cnc2c(cccc12)C(F)(F)F
CS(=O)(=O)c1cc(c(F)cc1F)-c1cccc(c1)-c1ccnc2c(cccc12)C(F)(F)F
CS(=O)(=O)c1cc(ccc1F)-c1cccc(c1)-c1ccnc2c(cccc12)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1cccc(c1)-c1ccnc2c(cccc12)C(F)(F)F
CCCc1cnc2c(cccc2c1-c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CCS(=O)(=O)c1cccc(c1)-c1cccc(c1)-c1ccnc2c(cccc12)C(F)(F)F
CCc1cnc2c(cccc2c1-c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CC(C)c1cnc2c(cccc2c1-c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CS(=O)(=O)c1ccc(cc1)-c1cccc(c1)-c1ccnc2c(cccc12)C(F)(F)F
Cc1cnc2c(cccc2c1-c1cccc(c1)-c1ccc(F)c(c1)S(C)(=O)=O)C(F)(F)F
Cc1cnc2c(cccc2c1-c1cccc(c1)-c1cc(c(F)cc1F)S(C)(=O)=O)C(F)(F)F
Cc1ccc(cc1S(C)(=O)=O)-c1cccc(c1)-c1c(C)cnc2c(cccc12)C(F)(F)F
COc1ccc(cc1S(C)(=O)=O)-c1cccc(c1)-c1c(C)cnc2c(cccc12)C(F)(F)F
Cc1cnc2c(cccc2c1-c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
Cc1cnc2c(cccc2c1-c1cccc(c1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F
CCS(=O)(=O)c1cccc(c1)-c1cccc(c1)-c1c(C)cnc2c(cccc12)C(F)(F)F
CN(Cc1ccc(cc1)C(O)=O)c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)nc1C(F)(F)F |(-1.96,-48.67,;-1.97,-47.13,;-3.3,-46.37,;-4.63,-47.14,;-4.63,-48.69,;-5.97,-49.46,;-7.3,-48.69,;-7.3,-47.15,;-5.97,-46.38,;-8.63,-49.46,;-9.97,-48.69,;-8.64,-51,;-.64,-46.36,;-.65,-44.83,;.68,-44.05,;2.02,-44.81,;3.36,-44.04,;4.7,-44.81,;6.02,-44.04,;6.49,-42.57,;8.04,-42.56,;8.53,-44.03,;7.28,-44.94,;7.28,-46.48,;8.62,-47.24,;9.94,-46.46,;8.63,-48.77,;7.29,-49.55,;5.96,-48.79,;5.95,-47.25,;4.61,-46.48,;5.58,-41.33,;5.41,-39.8,;4.17,-40.71,;2.03,-46.35,;.7,-47.13,;.7,-48.67,;-.63,-49.44,;2.03,-49.44,;.68,-50.21,)|
CN(Cc1cccc(c1)C(O)=O)c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)nc1C(F)(F)F |(21.34,-24.3,;21.34,-22.76,;20,-21.99,;18.67,-22.77,;17.33,-22,;16,-22.77,;16,-24.32,;17.34,-25.09,;18.67,-24.32,;17.34,-26.63,;16,-27.4,;18.67,-27.4,;22.67,-21.98,;22.65,-20.45,;23.98,-19.67,;25.32,-20.44,;26.66,-19.66,;28,-20.43,;29.32,-19.66,;29.79,-18.19,;31.35,-18.19,;31.83,-19.65,;30.58,-20.57,;30.59,-22.1,;31.92,-22.86,;33.25,-22.08,;31.93,-24.4,;30.6,-25.18,;29.26,-24.41,;29.25,-22.87,;27.92,-22.11,;28.88,-16.95,;28.71,-15.42,;27.47,-16.33,;25.33,-21.98,;24,-22.75,;24,-24.29,;22.67,-25.06,;25.34,-25.06,;23.99,-25.83,)|
CC(C)c1onc(c1COc1ccc(N(C)Cc2ccc(cc2)C(O)=O)c(n1)C(F)(F)F)-c1c(Cl)cccc1Cl |(29.01,-37.57,;28.39,-38.98,;26.86,-39.15,;29.3,-40.22,;30.85,-40.22,;31.33,-41.69,;30.08,-42.6,;28.83,-41.7,;27.5,-42.46,;26.16,-41.7,;24.83,-42.47,;23.48,-41.71,;22.16,-42.49,;22.17,-44.02,;20.84,-44.79,;20.84,-46.33,;19.5,-44.03,;18.17,-44.8,;18.18,-46.35,;16.84,-47.12,;15.5,-46.35,;15.51,-44.81,;16.84,-44.04,;14.17,-47.12,;12.84,-46.35,;14.17,-48.66,;23.5,-44.79,;24.83,-44.01,;23.5,-46.33,;22.17,-47.1,;24.84,-47.1,;23.49,-47.86,;30.09,-44.13,;31.42,-44.89,;32.75,-44.11,;31.43,-46.43,;30.1,-47.21,;28.76,-46.45,;28.75,-44.91,;27.42,-44.14,)|
CC1(CCCC2(C)C1CCc1ccc(O)cc21)C(=O)OC(=O)C1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21
CC1(CCC[C@@]2(C)[C@H]1CCc1ccc(OC(=O)[C@@]3(C)CCC[C@@]4(C)[C@H]3CCc3ccc(O)cc43)cc21)C(O)=O
CC1(CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21)C(=O)CC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21
CC1(COC(=O)[C@@]2(C)CCC[C@@]3(C)[C@H]2CCc2ccc(O)cc32)CCC[C@@]2(C)[C@H]1CCc1ccc(O)cc21
CN(C)Cc1nc2c(cccn2c1-c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
CCc1nc2c(cccn2c1-c1cccc(Cc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(nc3c(cccn23)C(F)(F)F)-n2ccnc2)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(CN3CCSC3)nc3c(cccn23)C(F)(F)F)c1
CC(C)c1nc2c(cccn2c1-c1cccc(OCc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(CN3CCCCC3)nc3c(cccn23)C(F)(F)F)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(Cc3ccccc3)nc3c(cccn23)C(F)(F)F)c1
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(nc3c(cccn23)C(F)(F)F)-c2ccccc2)c1
CC(C)(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CCc1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CC(C)S(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)nc3c(cccn23)C(F)(F)F)c1
Cc1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(=O)(=O)CCCO)c1)C(F)(F)F
COc1ccc(CN(C)S(=O)(=O)c2cccc(Oc3cccc(c3)-c3c(nc4c(Cl)cccn34)C(C)C)c2)cc1
CNS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(nc3c(Cl)cccn23)C(C)C)c1
CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(CS(C)(=O)=O)c2)c1)C(F)(F)F
CC(C)c1nc2c(Cl)cccn2c1-c1cccc(Oc2cccc(c2)S(N)(=O)=O)c1
CCS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(C)nc3c(cccn23)C(F)(F)F)c1
Cc1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1)C#N
CC(C)c1nc2c(cccn2c1-c1cccc(Oc2cccc(c2)S(=O)(=O)C(F)(F)F)c1)C(F)(F)F
CC(C)c1nc2c(Cl)cccn2c1-c1cccc(Oc2cccc(c2)S(C)(=O)=O)c1
CCc1nc2c(cccn2c1-c1cccc(COc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
CS(=O)(=O)c1cccc(Oc2cccc(c2)-c2c(CN3CCCC3)nc3c(cccn23)C(F)(F)F)c1
CC(C)c1nc2c(cccn2c1-c1cccc(OCc2ccc(cc2)S(C)(=O)=O)c1)C(F)(F)F
CC(C)c1nc2c(cccn2c1-c1ccc(cc1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F
CC(C)c1nc2c(cccn2c1-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
COc1cc(C=C2SC(O)=NC2=O)ccc1Oc1ccc(cc1C(F)(F)F)C#N |w:5.4,c:9|
CCOCCn1cccc1C(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
CN(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)S(=O)(=O)c2ccccc2
CCOCCn1cccc1C(O)(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
COC(c1cccn1Cc1ccccc1)(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
CN(c1ccc(cc1)C(O)(c1cccn1Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
COCCn1cccc1C(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
COCCn1cccc1C(OC)(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
COCCn1cccc1C(O)(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#CC(C)(C)C)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C#N)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#CCc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1C)[N+]([O-])=O)C(F)(F)F)S(=O)(=O)c1ccccc1
OC(C#Cc1ccc(F)cc1)(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C#N)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
COc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#CC1=CCCCC1)C(F)(F)F)S(=O)(=O)c1ccccc1 |t:16|
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccn1)C(F)(F)F)S(=O)(=O)c1ccccc1
CCOc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C(O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(=O)(=O)c1ccccc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CN(c1ccc(cc1)C(O)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(=O)(=O)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CN(c1ccc(cc1)C(O)(C#CC(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CN(c1ccc(cc1)C(O)(Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
CN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)C(F)(F)F)S(=O)(=O)c1ccccc1
CN(c1ccc(cc1)C(O)(c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1
CN(c1ccc(cc1)C(O)(c1cccs1)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccc(c1)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CCC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1cc(Cl)ccc1Cl
CN(c1ccc(cc1)C(C)(O)C(F)(F)F)S(=O)(=O)c1ccccc1
CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CC1)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(Cl)cc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
COC(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
CC(C)(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)S(C)(=O)=O)C(F)(F)F)S(=O)(=O)c1ccccc1
CN(c1ccc(cc1)C(O)(c1ncc[nH]1)C(F)(F)F)S(=O)(=O)c1ccccc1
CN(c1ccc(cc1)C(O)(c1nccs1)C(F)(F)F)S(=O)(=O)c1ccccc1
COc1cccc(c1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(cc1)C(O)=O)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CN(c1ccc(cc1)C(O)(c1nnc[nH]1)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(C)cc1)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cccnc1)C(F)(F)F)S(=O)(=O)c1ccccc1
CCCCc1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CCCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
CCn1cc(cn1)C#CC(O)(c1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccccc1)C(F)(F)F
CS(=O)(=O)c1ccc(cc1)C#CC(O)(c1ccc(cc1)N(CC1CCC1)S(=O)(=O)c1ccccc1)C(F)(F)F
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccccc1)C(F)(F)F)S(=O)(=O)c1cccc(c1)C#N
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1cncn1C)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1ccc(F)cc1F)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CN(c1ccc(cc1)C(O)(C#Cc1c(C)noc1C)C(F)(F)F)S(=O)(=O)c1ccccc1
CC(C)CC#CC(O)(c1ccc(cc1)N(C)S(=O)(=O)c1ccccc1)C(F)(F)F
CN(c1ccc(cc1)C(O)(c1nnn[nH]1)C(F)(F)F)S(=O)(=O)c1ccccc1
CN1c2ccc(cc2CCc2ccccc2C1=O)C(O)(C(F)(F)F)C(F)(F)F
CN1c2ccc(cc2Oc2ccccc2C1=O)C(O)(C(F)(F)F)C(F)(F)F
CN1c2ccc(cc2C(=C)c2ccccc2C1=O)C(O)(C(F)(F)F)C(F)(F)F
CN1c2ccc(N)cc2C(=C)c2ccccc2C1=O
CCc1ccc2N(C)C(=O)c3ccccc3C(=C)c2c1
C[n+]1c2ccc(cc2c([CH2-])c2ccccc2c1=O)[N+]([O-])=O
CN1c2ccc(C)cc2C(=C)c2ccccc2C1=O
CN1c2ccc(cc2C(=C)c2ccccc2C1=O)C(C)(C)C
CCc1ccc2N(C)C(=O)c3cc(ccc3C(=C)c2c1)-c1ccc(CC(O)=O)cc1
CN1c2ccc(cc2C(=C)c2ccccc2C1=O)C(C)=O
CC(C)c1ccc2N(C)C(=O)c3ccccc3C(=C)c2c1
CN1c2ccc(cc2C(=C)c2ccccc2C1=O)C(O)=O
CCc1ccc2N(C)C(=O)c3cc(ccc3C(=C)c2c1)-c1cccc(CC(O)=O)c1
CCCCCCCCCCCCc1ccc2N(C)C(=O)c3ccccc3C(=C)c2c1
CN1c2ccc(CO)cc2C(=C)c2ccccc2C1=O
CCc1ccc2N(C)C(=O)c3cc(ccc3C(=C)c2c1)-c1ccc(cc1)C(O)=O
CCCCCCc1ccc2N(C)C(=O)c3ccccc3C(=C)c2c1
CN(C(=O)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CN1c2ccc(O)cc2C(=C)c2ccccc2C1=O
CCc1ccc2N(C)C(=O)c3cc(ccc3C(=C)c2c1)-c1cccc(c1)C(O)=O
CN1c2ccccc2C(=C)c2ccccc2C1=O
CCOC(=O)c1c(O)cc(O)cc1O
Cn1cnc(c1)S(=O)(=O)N(Cc1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)Cc1c(F)cccc1Cl
Fc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)-c1cccc(CN2CCNCC2)c1
Fc1ccc(CN(Cc2ccc(cc2)-c2ccccc2)S(=O)(=O)c2ccccc2)c(Cl)c1
Fc1ccc(CN(Cc2ccccc2)Cc2ccc(cc2)-c2ccccc2)c(Cl)c1
Cc1cc(C)c(c(C)c1)S(=O)(=O)N(Cc1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)Cc1c(F)cccc1Cl
Fc1ccc(CN(Cc2ccc(cc2)-c2ccccc2)C(=O)c2ccccc2)c(Cl)c1
Cc1cc(C)c(c(C)c1)S(=O)(=O)N(Cc1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)Cc1ccc(F)cc1Cl
Cc1cc(C)c(c(C)c1)S(=O)(=O)N(Cc1ccc(o1)C(F)(F)F)Cc1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
Cc1ccccc1S(=O)(=O)N(Cc1ccc(cc1)-c1cccc(c1)S(C)(=O)=O)Cc1c(F)cccc1Cl
CS(=O)(=O)c1cccc(c1)-c1ccc(CN(Cc2ccc(F)cc2Cl)S(=O)(=O)c2ccccc2)cc1
CS(=O)(=O)c1cccc(c1)-c1ccc(CN(Cc2c(F)cccc2Cl)S(=O)(=O)c2ccccc2)cc1
CS(=O)(=O)c1cccc(c1)-c1ccc(CN(Cc2c(F)cccc2Cl)S(=O)(=O)C2CC2)cc1
CCN(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1
Cc1nc(c(Cl)n1-c1ccc(cc1-n1nncc1-c1ccc(OC(F)(F)F)cc1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O)C(F)(F)F |(-.92,-28.2,;-.6,-26.69,;-1.64,-25.55,;-.87,-24.21,;.65,-24.53,;1.04,-23.04,;.81,-26.06,;2.14,-26.84,;2.14,-28.39,;3.48,-29.16,;4.81,-28.38,;4.81,-26.83,;3.47,-26.07,;3.46,-24.52,;2.22,-23.62,;2.69,-22.16,;4.23,-22.15,;4.71,-23.61,;6.17,-24.08,;6.49,-25.59,;7.96,-26.06,;9.1,-25.03,;10.57,-25.49,;11.71,-24.46,;13.17,-24.93,;11.38,-22.95,;12.79,-23.36,;8.77,-23.51,;7.31,-23.05,;6.14,-29.15,;6.14,-30.69,;7.47,-31.46,;7.48,-33,;8.81,-30.69,;10.15,-31.45,;10.15,-32.99,;8.8,-29.14,;7.47,-28.38,;10.13,-28.36,;11.47,-29.13,;9.35,-27.02,;10.9,-27.01,;-1.49,-22.81,;-.59,-21.56,;-3.02,-22.65,;-2.26,-21.47,)|
Cc1nc(cn1-c1ccc(cc1-n1nncc1Cc1cccc(Cl)c1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F
Cc1nc(cn1-c1c(F)cc(cc1-n1nncc1-c1ccc(Cl)cc1)-c1cccc(c1)S(C)(=O)=O)C(F)(F)F |(4.74,-44.51,;5.06,-43.01,;4.03,-41.86,;4.8,-40.53,;6.3,-40.85,;6.46,-42.38,;7.8,-43.16,;7.8,-44.7,;6.46,-45.47,;9.13,-45.47,;10.47,-44.7,;10.46,-43.15,;9.13,-42.39,;9.12,-40.84,;7.87,-39.94,;8.34,-38.47,;9.88,-38.47,;10.36,-39.93,;11.83,-40.4,;12.15,-41.91,;13.61,-42.38,;14.76,-41.34,;16.22,-41.81,;14.42,-39.83,;12.96,-39.37,;11.8,-45.47,;11.8,-47.01,;13.13,-47.78,;14.46,-47.01,;14.46,-45.46,;13.12,-44.7,;15.78,-44.67,;17.12,-45.44,;15,-43.34,;16.55,-43.33,;4.17,-39.12,;5.07,-37.88,;2.64,-38.96,;3.39,-37.78,)|
CC(C)c1nc(c(o1)-c1ccc(OC(F)(F)F)cc1)-c1cc(ccc1-n1cc(nc1C)C(F)(F)F)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(Cc2ccccc2Cl)n1)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(Cc2ccccc2C(F)(F)F)n1)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)-c1c(Cl)cccc1Cl)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O |(.07,-55.05,;1.6,-55.21,;2.22,-56.62,;.5,-56.3,;2.5,-53.97,;4.04,-53.97,;4.53,-52.5,;3.27,-51.6,;2.03,-52.51,;3.27,-50.06,;1.94,-49.3,;.61,-50.08,;1.93,-47.77,;3.27,-46.98,;4.61,-47.75,;4.61,-49.29,;6.09,-48.88,;5.84,-51.71,;7.18,-52.45,;8.5,-51.66,;8.47,-50.12,;7.12,-49.38,;5.8,-50.17,;9.79,-49.32,;11.14,-50.07,;12.45,-49.27,;12.42,-47.73,;11.06,-46.99,;9.75,-47.79,;11.02,-45.45,;12.34,-44.64,;9.53,-45.04,;10.62,-43.95,)|
CC(C)(O)c1cn(c(n1)-c1ccccc1Cl)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
CS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-n1cc(nc1-c1ccccc1Cl)C(F)(F)F
CC(C)(O)c1cc(-c2ccc(s2)-c2cccc(c2)S(C)(=O)=O)n(n1)-c1ccccc1Cl
COC(=O)c1cc(-c2ccc(s2)-c2cccc(c2)S(C)(=O)=O)n(n1)-c1ccccc1Cl
CS(=O)(=O)c1cccc(c1)-c1cccc(c1)-c1cc(nn1-c1ccccc1Cl)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1cc(nn1-c1ccccc1Cl)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1ccc(s1)-c1cc(nn1-c1ccccc1C(F)(F)F)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1ccc(s1)-c1cc(nn1-c1ccccc1Cl)C(F)(F)F
CS(=O)(=O)c1cccc(c1)-c1ccc(s1)-c1cc(nn1Cc1ccc(F)cc1F)C(F)(F)F
Cc1cc(CC(O)=O)ccc1-c1ccc(s1)-c1cc(c(C#N)c(=O)n1Cc1ccc(F)cc1F)C(F)(F)F
Fc1ccc(Cn2c(cc(c(C#N)c2=O)C(F)(F)F)-c2ccc(Oc3ccccc3)cc2)c(F)c1
CS(=O)(=O)c1cccc(c1)-c1ccc(s1)-c1cc(c(C#N)c(=O)n1Cc1ccc(F)cc1F)C(F)(F)F
CC(C)CN(Cc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(NC2CCN(CC2)S(C)(=O)=O)cc1
CC(C)CN(c1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(NC2CCN(CC2)S(C)(=O)=O)cc1
CC(C)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(OC2CCN(CC2)S(C)(=O)=O)cc1
CC(C)CN(c1ccc(cc1)C#N)S(=O)(=O)c1ccc(OC2CCN(CC2)S(C)(=O)=O)cc1
CC(C)CN(Cc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(OC2CCN(CC2)S(C)(=O)=O)cn1
OC(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
CC(C)CN(Cc1ccc(cc1)N2CCN(CC2)C(=O)C)S(=O)(=O)Cc3ccccc3
CC(=O)N1CCN(CC1)c1ccc(CN(C2CCC2)S(=O)(=O)Cc2ccccc2)cc1
CC(C)N(Cc1ccc(cc1)N1CCN(CC1)C(C)=O)S(=O)(=O)Cc1ccccc1
CC(=O)N1CCN(CC1)c1ccc(CN(CC(F)(F)F)S(=O)(=O)Cc2ccccc2)cc1
CCCc1c(OCCCCN2C(=O)NC(C)(C2=O)c2ccc(OC)cc2)ccc2c(cc(=O)oc12)C(F)(F)F
CCCc1c(OCCCCN2C(=O)NC(C)(C2=O)c2ccc(OC)c(OC)c2)ccc2c(cc(=O)oc12)C(F)(F)F
CCCc1c(OCCCCN2C(=O)NC(C)(C2=O)c2ccc3OCOc3c2)ccc2c(cc(=O)oc12)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)CSC1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)CN(C)C1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)CCC1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1CCOC1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)C(C)N(C)C1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)N(C)C(C)(C)C1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)C1=O)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccccc1)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(C)cc1)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC)cc1)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc2OCOc2c1)C(F)(F)F
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)[N+]([O-])=O)C(F)(F)F
CCCc1c(OCCCCN2C(=O)CN(C)C2=O)ccc2c(cc(=O)oc12)C(F)(F)F
CCCc1c(OCCCCN2C(=O)N(C)C(C)(C)C2=O)ccc2c(cc(=O)oc12)C(F)(F)F
CCCc1c(OCCCCN2C(=O)NC(C)(C2=O)c2ccccc2)ccc2c(cc(=O)oc12)C(F)(F)F
CCCc1c(OCCCN2C(=O)CSC2=O)ccc2c(noc12)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1cccc(OC)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)C(C)C)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccccc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)N(C)C(C)(C)C1=O)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)N(C)C(C)(C)C1=O)C(O)(C(F)(F)F)C(F)(F)F
CCCc1c2COC(c2ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC)cc1)(C(F)(F)F)C(F)(F)F
CCCc1c2COC(c2ccc1OCCCCN1C(=O)N(C)C(C)(C)C1=O)(C(F)(F)F)C(F)(F)F
CCCc1c(OCCCCN2C(=O)N(C)C(C)(C)C2=O)ccc2C(CCOc12)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(CC)(C1=O)c1ccc2OCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(CC)(C1=O)c1ccc(OC)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)-c1ccccc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)C(C)C)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc2OCCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc2OCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC(F)(F)F)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC(C)C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OCC)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(CC)(C1=O)c1ccc2OCCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(CCC)(C1=O)c1ccc2OCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(CC)(C1=O)c1ccc2OCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(CC)(C1=O)c1ccc(OC)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)[N+]([O-])=O)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)C(F)(F)F)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)-c1ccccc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(Cl)c(Cl)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(Cl)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)N(C)C)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc2OCCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc2OCOc2c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC(F)(F)F)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC(C)C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OCC)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(OC)c(OC)c1)C(O)(C(F)(F)F)C(F)(F)F
OC(=O)c1ccc(cc1)-c1nc(C(=O)c2c(Cl)cccc2C(F)(F)F)n2ccccc12
OC(=O)c1ccc(cc1O)-c1nc(C(=O)c2c(Cl)cccc2C(F)(F)F)n2ccccc12
OC(=O)c1ccc(-c2nc(C(=O)c3c(Cl)cccc3C(F)(F)F)n3ccccc23)c(F)c1
OC(=O)c1ccc(-c2nc(C(=O)c3c(Cl)cccc3C(F)(F)F)n3CCCCc23)c(F)c1
OC(=O)c1ccc(-c2nc(C(=O)c3c(Cl)cccc3C3CC3)n3CCCCc23)c(F)c1
OC(=O)c1ccc(cc1O)-c1nc(C(=O)c2c(Cl)cccc2C2CC2)n2cccnc12
CC(C)(C)OC(=O)c1c(O)c(ccc1COc1ccc(cc1)-c1ccc(CC(O)=O)cc1)C(F)(F)F
CC(C)(C)OC(=O)c1c(O)c(ccc1COc1ccc(cc1)-c1cccc(CC(O)=O)c1)C(F)(F)F
CN(C(C)=O)c1ccc(OCc2ccc(c(O)c2C(=O)OC(C)(C)C)C(F)(F)F)cc1
CC(=O)N(C)c1ccc(cc1)OCc2ccc(cc2C(=O)OC(C)(C)C)C(F)(F)F
OC(=O)c1cccc(OCCCN(CC(c2ccccc2)c2ccccc2)Cc2cccc(c2Cl)C(F)(F)F)c1
Fc1ccc(cc1)S(=O)(=O)N1CCCc2ccc(NC(=O)c3c(F)cccc3F)cc12
Fc1ccc(cc1)S(=O)(=O)N1CCc2ccc(NC(=O)c3c(F)cccc3F)cc12
Fc1ccc(cc1)S(=O)(=O)N1CCCc2ccc(NC(=O)c3ccccc3Cl)cc12
Fc1ccc(cc1)S(=O)(=O)N1CCCc2ccc(NC(=O)c3c(F)cccc3Cl)cc12
O=C1N(C(=O)c2ccccc12)c1ccccc1\C=C\c1ccccc1
COc1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
Fc1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
Brc1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
O=C1N(C(=O)c2ccccc12)c1ccccc1\C=C\c1ccc(cc1)C#N
Cc1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
FC(F)(F)c1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
CCCCc1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
CC(C)(C)c1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1
COc1ccccc1\C=C\c1ccccc1N1C(=O)c2ccccc2C1=O
COc1cccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)c1
COc1ccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc1OC
COc1cc(OC)cc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)c1
COc1cc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)cc(OC)c1OC
COc1ccc(\C=C/c2ccccc2N2C(=O)c3ccccc3C2=O)cc1OC
Cc1ccccc1\C=C\c1ccccc1N1C(=O)c2ccccc2C1=O
Cc1cccc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)c1
Cc1cc(C)cc(\C=C\c2ccccc2N2C(=O)c3ccccc3C2=O)c1
CN(C)C(=O)c1ccc(cc1Cl)-c1cnc(N2CCN(CC2)C(=O)[C@](O)(c2ccccc2)C(F)(F)F)c(c1)C#N |r|
CC(C)[C@](O)(C(=O)N1CCC(CC1)C1CCN(CC1)c1ccc(C(=O)N(C)C)c(Cl)c1)C(F)(F)F |r|
CN(C)C(=O)c1ccc(cc1Cl)N1CCC(CC1)C1CCN(CC1)C(=O)[C@](O)(c1ccccc1)C(F)(F)F |r|
CN(C)C(=O)c1ccc(cc1Cl)-c1cnc(N2CCN(CC2)C(=O)OC(C)(C)C)c(c1)C#N
CC(C)[C@@](C(=O)N1CCC(CC1)C2CCN(CC2)c3ccc(c(c3)Cl)C(=O)N(C)C)(C(F)(F)F)O
CS(=O)(=O)c1cc(ccc1CO)-c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2C(F)(F)F)s1
CS(=O)(=O)c1cccc(c1)N1CCN(Cc2ccc(nc2)C(F)(F)F)C(C1)c1ccccc1
CS(=O)(=O)c1cccc(c1)N1CCN(C(C1)c1ccccc1)c1nccc(n1)C(F)(F)F
CC(C)[C@@H]1CN(CCN1c1ncc(Cl)c(n1)C(F)(F)F)c1ccc(F)c(c1)S(C)(=O)=O |r|
FC(F)(F)c1ccc(CN2CCN(CC2c2ccccc2)c2ccccc2)cn1
CCCc1cc(cc(CCC)c1OC\C=C\CN1C(=O)NC(C)(C1=O)c1ccc(OC(C)C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(cc(CCC)c1OCC#CCN1C(=O)NC(C)(C1=O)c1ccc(OC(C)C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1cccc(CN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(CN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1cccc(CCN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(CCN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(CCN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c(C)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(CCN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c(OC)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(CCN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c(O)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(cc1)C(O)CN1C(=O)NC(C)(C1=O)c1ccc(OC(C)C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(cc1)C(=O)CN1C(=O)NC(C)(C1=O)c1ccc(OC(C)C)cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(C(=O)CN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c(C)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(C(=O)CN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c(OC)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(C(=O)CN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cc2)c(O)c1)C(O)(C(F)(F)F)C(F)(F)F
CCCc1cc(ccc1Oc1ccc(C(=O)CN2C(=O)NC(C)(C2=O)c2ccc(OC(C)C)cn2)c(O)c1)C(O)(C(F)(F)F)C(F)(F)F
CC(C)C1N(Cc2cn(nc12)-c1ccc(CO)c(c1)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F
COc1ncnc(N2Cc3cn(nc3[C@H]2C(C)C)-c2cccc(c2)S(C)(=O)=O)c1F |r|
CC(C)[C@H]1N(Cc2cn(nc12)-c1cccc(c1)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |r|
COc1cc(nc(C)n1)N1Cc2cn(nc2[C@H]1C(C)C)-c1cccc(c1)S(C)(=O)=O |r|
COc1cc(cc(C)n1)N1Cc2cn(nc2[C@H]1C(C)C)-c1cccc(c1)S(C)(=O)=O |r|
COc1ncc(F)c(n1)N1Cc2cn(nc2[C@H]1C(C)C)-c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1N(Cc2cn(nc12)-c1ccc(CO)c(c1)S(C)(=O)=O)c1ncc(CO)c(n1)C(F)(F)F |r|
CC(C)[C@H]1N(Cc2cn(nc12)-c1cccc(c1)S(C)(=O)=O)c1cc(nc(C)n1)C(F)(F)F |r|
COc1cc(ccn1)N1Cc2cn(nc2[C@H]1C(C)(C)C)-c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1N(Cc2cn(nc12)-c1cccc(c1)S(C)(=O)=O)c1nccc(n1)C(F)(F)F |r|
CC(C)[C@H]1N(Cc2cn(nc12)-c1cccc(c1)S(C)(=O)=O)c1ccnc(n1)C(F)(F)F |r|
COc1nc(C)cc(n1)N1Cc2cn(nc2[C@H]1C(C)C)-c1cccc(c1)S(C)(=O)=O |r|
COc1cc(ccn1)N1Cc2cn(nc2[C@H]1C(C)C)-c1cccc(c1)S(C)(=O)=O |r|
CC(C)[C@H]1N(Cc2cn(nc12)-c1cccc(c1)S(C)(=O)=O)c1cc(ncn1)C(F)(F)F |r|
CN(C)C(=O)c1ccc2n(nc(Oc3c(Cl)cccc3C(F)(F)F)c2c1)-c1ccc(cc1)C(O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1cccc(F)c1Cl)-c1ccc(cc1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1c(F)cccc1Cl)-c1ccc(cc1F)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(Cc2c(Cl)cccc2Cl)n1)-c1ccc(cc1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1c(Cl)cccc1Cl)-c1ccc(cc1)-c1cccc(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1ccccc1Cl)-c1ccc(cc1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1ccccc1Cl)-c1ccc(cc1F)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1ccccc1Cl)-c1ccc(cc1)-c1ccc(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1c(Cl)cccc1Cl)-c1ccc(cc1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(c1nc(cn1-c1ccc(cc1F)-c1cc(F)c(CO)c(c1)S(C)(=O)=O)C(C)(C)O)c1c(Cl)cccc1Cl
CC(O)c1ccc(cc1S(C)(=O)=O)-c1ccc(cc1)-n1cc(nc1C(C)(C)c1ccccc1Cl)C(C)(C)O
CC(C)(O)c1cn(c(Cc2ccccc2Cl)n1)-c1ccc(cc1)-c1ccc(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1ccccc1F)-c1ccc(cc1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
CC(C)(O)c1cn(c(n1)C(C)(C)c1c(Cl)cccc1Cl)-c1ccc(cc1Cl)-c1cc(F)c(CO)c(c1)S(C)(=O)=O
[H][C@]1(O[C@@]1([H])[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@@H](CC)C(C)C |r,t:17|
[H][C@@]1(O[C@]1([H])[C@@H](C)[C@@]1([H])CC[C@@]2([H])C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C(C)C |r,t:14,16|
[H][C@]1(O[C@@]1([H])[C@@H](C)[C@@]1([H])CC[C@@]2([H])C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C(C)C |r,t:14,16|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)[C@H](O)C[C@@H](CC)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)[C@@H](O)C[C@H](C)C(C)C |r,t:6,8|
[H][C@@]1(O[C@]1([H])[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@@H](CC)C(C)C |r,t:17|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C[C@@H](O)[C@@H](CC)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC(=O)[C@@H](CC)C(C)C |r,t:9|
CC1=C(C(CCC1)(C)C)/C=C/C(=C\C=C\C(=C\C(=O)O)\C)/C
Cc1cc2c(cc1C(=C)c3ccc(cc3)C(=O)O)C(CCC2(C)C)(C)C
CN1CC[C@H]([C@H](F)C1)N1C(=O)S\C(=C/c2ccc3n(Cc4ccc(Cl)cc4C(F)(F)F)ncc3c2)C1=O |r|
Oc1cc2oc(c(O)cc2c(=[OH+])c1)-c1ccc(O)c(O)c1
OC(c1ccc(cc1)N(CC(F)(F)F)S(=O)(=O)c1ccc(cc1)C#N)(C(F)(F)F)C(F)(F)F
Cc1cc(cc2c1n(C)c(=O)c1cc(F)ccc21)C(O)(C(F)(F)F)C(F)(F)F
Cc1cc(cc2c1[nH]c(=O)c1ccccc21)C(O)(C(F)(F)F)C(F)(F)F
OC(c1ccc2N(CCCc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
CC(C)(O)[C@H](F)CNC(=O)C[C@@H]1CCc2cc(ccc2N1S(=O)(=O)c1ccc(F)cc1)C(O)(C(F)(F)F)C(F)(F)F |r|
OC(c1ccc2N(CCSc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
OC(c1ccc2N(CCNc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
CN1CCN(c2ccc(cc12)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CC1CCN(c2ccc(cc12)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
NC(=O)CC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CNC(=O)CC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
OC1CN(C1)C(=O)CC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CC(C)(O)CNC(=O)CC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CC(C)(O)CNC(=O)C[C@@H]1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
CC(C)(O)CNC(=O)CC1CSc2cc(ccc2N1S(=O)(=O)c1ccc(F)cc1)C(O)(C(F)(F)F)C(F)(F)F
CC(C)(O)CNC(=O)C[C@H]1CCc2cc(ccc2N1S(=O)(=O)c1ccc(F)cc1)C(O)(C(F)(F)F)C(F)(F)F |r|
OC(c1ccc2N(CC(CC(=O)Nc3nncs3)Sc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
OC(c1ccc2N(CC(CC(=O)Nc3ccncc3)Sc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
OC(c1ccc2N(CCOc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
OC(=O)CC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CC1(C)CCN(c2ccc(cc12)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
COC(=O)CC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CC(C)(O)CNC(=O)CC1CCc2cc(ccc2N1S(=O)(=O)c1ccc(F)cc1)C(O)(C(F)(F)F)C(F)(F)F
CC(C)(CNC(=O)C[C@H]1CN(c2ccc(cc2S1)C(C(F)(F)F)(C(F)(F)F)O)S(=O)(=O)c3ccc(cc3)F)O
OC(c1ccc2N(CC(CC(=O)N3CCOCC3)Sc2c1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
CC(C)(O)CC(=O)NCC1CN(c2ccc(cc2S1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
CC(C)(O)CNC(=O)C[C@@H]1CCc2cc(ccc2N1S(=O)(=O)c1ccc(F)cc1)C(O)(C(F)(F)F)C(F)(F)F |r|
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1Oc1ccccc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1-c1ccccc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1Cc1ccccc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1cccnc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1ccncc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1cccs1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1ccccc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1ccsc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C/c1ccccc1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1nccs1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1ccccn1
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C\c1ccco1
CCc1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccc(OCC2CCOCC2)c(c1)[S@@](C)(=N)=O |r|
CC(OC(=O)c1oc2cc(F)ccc2c1C)C(=O)N1CCNC1=O
CN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)c1ccc2OCCOc2c1
CCOC(=O)c1ccc(CN(Cc2ccc(cc2)-c2cccc(c2)S(C)(=O)=O)S(=O)(=O)c2c(C)cc(C)cc2C)o1
CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(c(F)c2)C(C)(C)C(=O)Nc2ccc(F)cc2F)cc1
CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(cc2)C(C)(C)C(=O)Nc2ccc(F)cc2)cc1
CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(c(F)c2)C(C)(C)C(=O)Nc2ccc(F)cc2)cc1
CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(c(F)c2)C(C)(C)C(=O)Nc2cc(ccn2)C#N)cc1
[H][C@@]12COc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(38.73,-26.8,;37.4,-27.58,;37.4,-26.03,;36.05,-25.25,;34.71,-26.03,;33.38,-25.26,;32.05,-26.03,;32.05,-27.58,;33.38,-28.35,;34.71,-27.58,;36.05,-28.35,;36.36,-29.88,;37.91,-30.05,;38.55,-28.63,;40.06,-28.32,;40.54,-26.86,;41.08,-29.47,;42.57,-29.15,;43.6,-30.3,;43.12,-31.77,;41.61,-32.08,;40.58,-30.93,;44.14,-32.92,;43.66,-34.38,;45.65,-32.6,;34.95,-29.44,;33.85,-30.53,;33.45,-29.03,;35.33,-30.93,;34.23,-32.01,;34.62,-33.49,;36.11,-33.91,;36.49,-35.4,;37.21,-32.82,;36.81,-31.33,;30.72,-25.26,;29.38,-24.49,;29.38,-26.03,;28.05,-25.26,;29.38,-27.57,;28.04,-26.79,;30.72,-23.72,;32.05,-22.95,;29.38,-22.95,;30.71,-22.18,)|
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(C)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(64.23,-6.6,;62.9,-7.39,;62.9,-5.83,;61.56,-5.05,;60.21,-5.83,;58.88,-5.06,;57.55,-5.83,;57.55,-7.38,;58.88,-8.15,;60.21,-7.38,;61.55,-8.15,;61.86,-9.68,;63.41,-9.85,;64.05,-8.43,;65.56,-8.12,;66.04,-6.66,;66.58,-9.27,;68.07,-8.96,;69.1,-10.1,;68.62,-11.57,;67.11,-11.88,;66.09,-10.73,;69.64,-12.72,;69.16,-14.18,;71.15,-12.41,;60.45,-9.24,;59.35,-10.33,;58.96,-8.83,;60.83,-10.73,;59.74,-11.81,;60.12,-13.3,;61.61,-13.71,;62,-15.2,;62.71,-12.62,;62.32,-11.13,;56.22,-5.06,;54.88,-4.29,;54.88,-5.83,;53.55,-5.06,;54.88,-7.37,;53.54,-6.6,;56.22,-3.52,;57.55,-2.75,;54.88,-2.75,;56.21,-1.98,)|
OC(=O)[C@H]1CC[C@@](F)(CC1)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:16.17,3.2,6.6,wD:6.10,15.38,(-6.98,10.68,;-7.74,9.34,;-9.28,9.33,;-6.97,8.01,;-5.43,8.01,;-4.65,6.68,;-5.42,5.35,;-5.68,3.83,;-6.96,5.34,;-7.73,6.67,;-3.97,4.83,;-3.7,3.31,;-2.79,5.82,;-2.91,7.36,;-1.48,7.94,;-.49,6.76,;-1.3,5.45,;-.57,4.1,;.97,4.05,;1.78,5.36,;3.32,5.31,;4.13,6.62,;3.4,7.97,;1.86,8.02,;1.05,6.71,;5.67,6.57,;5.72,8.11,;7.21,6.52,;8.75,6.47,;7.16,4.98,;7.26,8.06,;5.62,5.03,;4.27,4.3,;6.93,4.22,;5.58,3.49,;.18,8.15,;1.65,8.62,;.66,9.61,;-.68,9.42,;-2.22,9.31,;-3.08,10.58,;-2.41,11.97,;-3.28,13.24,;-.88,12.08,;-.01,10.81,)|
c1cc(ccc1F)S(=O)(=O)[C@@]23CCN([C@@H]2CCc4c3ccc(c4)C(C(F)(F)F)(C(F)(F)F)F)C(=O)C5CCC(CC5)C(=O)O
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1cccc(Cl)c1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(39.24,-25.54,;37.91,-26.32,;37.91,-24.77,;36.57,-23.98,;35.23,-24.76,;33.89,-24,;32.56,-24.77,;32.56,-26.32,;33.89,-27.09,;35.22,-26.32,;36.56,-27.09,;36.87,-28.61,;38.42,-28.79,;39.06,-27.37,;40.57,-27.06,;41.05,-25.6,;41.59,-28.21,;43.09,-27.89,;44.11,-29.04,;43.63,-30.51,;42.12,-30.82,;41.1,-29.67,;44.65,-31.66,;44.17,-33.12,;46.16,-31.34,;35.46,-28.18,;34.36,-29.27,;33.97,-27.77,;35.84,-29.67,;34.75,-30.74,;35.13,-32.23,;36.62,-32.65,;37.72,-31.56,;39.2,-31.96,;37.33,-30.07,;31.23,-24,;29.89,-23.23,;29.89,-24.77,;28.56,-24,;29.89,-26.31,;28.55,-25.53,;31.23,-22.46,;32.56,-21.69,;29.89,-21.69,;31.22,-20.92,)|
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1cccc(C)c1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(65.64,-25.66,;64.32,-26.44,;64.32,-24.89,;62.97,-24.1,;61.63,-24.88,;60.3,-24.12,;58.97,-24.89,;58.97,-26.43,;60.3,-27.2,;61.63,-26.44,;62.97,-27.21,;63.28,-28.73,;64.83,-28.9,;65.47,-27.49,;66.97,-27.18,;67.46,-25.71,;68,-28.33,;69.49,-28.01,;70.52,-29.15,;70.04,-30.63,;68.53,-30.94,;67.5,-29.79,;71.06,-31.77,;70.58,-33.24,;72.57,-31.46,;61.86,-28.3,;60.77,-29.38,;60.37,-27.89,;62.25,-29.79,;61.15,-30.86,;61.54,-32.35,;63.02,-32.76,;64.12,-31.67,;65.61,-32.08,;63.73,-30.19,;57.63,-24.12,;56.29,-23.35,;56.3,-24.89,;54.97,-24.12,;56.3,-26.43,;54.96,-25.65,;57.63,-22.58,;58.97,-21.81,;56.3,-21.81,;57.62,-21.04,)|
OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1 |r,wU:15.16,3.2,wD:6.9,14.37,(-10.97,-1.49,;-9.8,-.49,;-10.07,1.02,;-8.35,-1.01,;-7.17,-.02,;-5.72,-.54,;-5.45,-2.06,;-6.63,-3.05,;-8.07,-2.53,;-4,-2.58,;-3.73,-4.09,;-2.82,-1.58,;-2.94,-.05,;-1.51,.53,;-.52,-.64,;-1.33,-1.95,;-.6,-3.31,;.94,-3.36,;1.75,-2.05,;3.29,-2.09,;4.1,-.79,;3.37,.57,;1.83,.62,;1.02,-.69,;5.64,-.83,;5.69,.71,;7.18,-.88,;8.72,-.93,;7.13,-2.42,;7.23,.66,;5.59,-2.37,;4.23,-3.1,;6.9,-3.18,;5.54,-3.91,;.15,.74,;1.66,1.07,;.31,2.28,;-.71,2.02,;-2.25,1.91,;-3.11,3.18,;-2.44,4.57,;-.91,4.68,;-.04,3.41,)|
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,19.25,wD:1.0,10.28,(65.23,-46.28,;63.9,-47.07,;63.9,-45.51,;62.56,-44.73,;61.22,-45.51,;59.88,-44.74,;58.55,-45.51,;58.55,-47.06,;59.89,-47.83,;61.22,-47.06,;62.55,-47.83,;62.87,-49.36,;64.41,-49.53,;65.05,-48.11,;66.56,-47.8,;67.04,-46.34,;67.58,-48.95,;67.09,-50.41,;68.11,-51.56,;69.62,-51.25,;70.1,-49.78,;69.08,-48.64,;70.65,-52.4,;70.16,-53.86,;72.15,-52.09,;61.45,-48.92,;60.35,-50.01,;59.96,-48.51,;61.84,-50.41,;60.74,-51.49,;61.12,-52.98,;62.61,-53.39,;63,-54.88,;63.71,-52.3,;63.32,-50.81,;57.22,-44.74,;55.88,-43.97,;55.89,-45.51,;54.55,-44.74,;55.89,-47.05,;54.54,-46.28,;57.22,-43.2,;58.55,-42.43,;55.89,-42.43,;57.21,-41.66,)|
OC(=O)C12CC(C1)(C2)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
C[C@@]1(CC[C@@H](CC1)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1)C(O)=O |r,wU:13.14,1.46,wD:4.7,1.0,12.35,(-8.9,.46,;-7.87,-.68,;-6.69,.32,;-5.24,-.2,;-4.97,-1.72,;-6.14,-2.71,;-7.59,-2.19,;-3.52,-2.24,;-3.25,-3.76,;-2.34,-1.25,;-2.46,.29,;-1.03,.87,;-.04,-.31,;-.85,-1.61,;-.12,-2.97,;1.42,-3.02,;2.23,-1.71,;3.77,-1.76,;4.58,-.45,;3.85,.91,;2.32,.96,;1.5,-.35,;6.12,-.5,;6.17,1.04,;7.66,-.55,;9.2,-.59,;7.61,-2.09,;7.71,.99,;6.07,-2.04,;4.72,-2.76,;7.38,-2.85,;6.03,-3.58,;.63,1.08,;2.1,1.56,;1.26,2.49,;-.23,2.35,;-1.77,2.24,;-2.63,3.52,;-1.96,4.9,;-2.83,6.18,;-.43,5.01,;.44,3.74,;-9.39,-.9,;-9.96,-2.33,;-10.34,.31,)|
CC(=O)N1CCC(CC1)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
Fc1ccc(cc1)S(=O)(=O)[C@@]12CCN([C@@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)C(=O)C1CCS(=O)(=O)CC1 |r|
[H][C@@]12CN(C)c3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:17.19,wD:20.26,1.0,11.29,(37.5,-6.4,;36.17,-7.18,;36.17,-5.63,;34.82,-4.84,;34.82,-3.3,;33.48,-5.62,;32.15,-4.86,;30.82,-5.63,;30.82,-7.18,;32.15,-7.95,;33.48,-7.18,;34.82,-7.95,;35.13,-9.47,;36.68,-9.65,;37.32,-8.23,;38.83,-7.92,;39.31,-6.46,;39.85,-9.07,;41.34,-8.75,;42.37,-9.9,;41.89,-11.37,;40.38,-11.68,;39.35,-10.53,;42.91,-12.52,;42.43,-13.98,;44.42,-12.2,;33.72,-9.04,;32.62,-10.13,;32.22,-8.63,;34.1,-10.53,;33,-11.6,;33.39,-13.09,;34.88,-13.5,;35.26,-14.99,;35.98,-12.42,;35.58,-10.93,;29.49,-4.86,;28.15,-4.09,;28.15,-5.63,;26.82,-4.86,;28.15,-7.17,;26.81,-6.39,;29.49,-3.32,;30.82,-2.55,;28.15,-2.55,;29.48,-1.78,)|
[H][C@@]12CN(CC)c3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:18.20,wD:21.27,1.0,12.30,(63.95,-6.23,;62.62,-7.01,;62.62,-5.46,;61.28,-4.67,;61.28,-3.13,;62.61,-2.36,;59.93,-5.45,;58.6,-4.69,;57.27,-5.46,;57.27,-7,;58.6,-7.77,;59.93,-7.01,;61.27,-7.78,;61.58,-9.3,;63.13,-9.47,;63.77,-8.06,;65.28,-7.75,;65.76,-6.29,;66.3,-8.9,;67.79,-8.58,;68.82,-9.73,;68.34,-11.2,;66.83,-11.51,;65.81,-10.36,;69.36,-12.35,;68.88,-13.81,;70.87,-12.03,;60.17,-8.87,;59.07,-9.96,;58.68,-8.46,;60.55,-10.36,;59.46,-11.43,;59.84,-12.92,;61.33,-13.33,;61.72,-14.82,;62.43,-12.24,;62.04,-10.76,;55.94,-4.69,;54.6,-3.92,;54.6,-5.46,;53.27,-4.69,;54.6,-7,;53.26,-6.22,;55.94,-3.15,;57.27,-2.38,;54.6,-2.38,;55.93,-1.61,)|
[H][C@@]12CN(CCC)c3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:19.21,wD:22.28,1.0,13.31,(13.85,-27.45,;12.52,-28.23,;12.53,-26.67,;11.18,-25.89,;11.18,-24.35,;12.51,-23.58,;12.51,-22.04,;9.84,-26.67,;8.5,-25.91,;7.18,-26.68,;7.17,-28.22,;8.51,-28.99,;9.84,-28.22,;11.17,-29,;11.49,-30.52,;13.03,-30.69,;13.67,-29.28,;15.18,-28.96,;15.67,-27.5,;16.21,-30.11,;17.7,-29.8,;18.73,-30.94,;18.24,-32.41,;16.73,-32.72,;15.71,-31.57,;19.27,-33.56,;18.79,-35.02,;20.78,-33.25,;10.07,-30.08,;8.98,-31.17,;8.58,-29.68,;10.46,-31.57,;9.36,-32.65,;9.75,-34.14,;11.23,-34.55,;11.62,-36.04,;12.33,-33.46,;11.94,-31.98,;5.84,-25.91,;4.5,-25.14,;4.51,-26.68,;3.17,-25.91,;4.51,-28.22,;3.17,-27.44,;5.84,-24.37,;7.18,-23.6,;4.51,-23.6,;5.83,-22.83,)|
[H][C@@]12CN(C)c3cc(ccc3[C@@]1(CCN2C(=O)C1(O)CCS(=O)(=O)CC1)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r|
OC1(CCS(=O)(=O)CC1)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(Cl)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(39.12,-6.49,;37.79,-7.27,;37.79,-5.71,;36.45,-4.93,;35.11,-5.71,;33.77,-4.95,;32.44,-5.72,;32.44,-7.26,;33.78,-8.03,;35.11,-7.26,;36.44,-8.04,;36.76,-9.56,;38.3,-9.73,;38.94,-8.31,;40.45,-8,;40.93,-6.54,;41.47,-9.15,;42.97,-8.84,;43.99,-9.98,;43.51,-11.45,;42,-11.76,;40.98,-10.61,;44.54,-12.6,;44.05,-14.06,;46.04,-12.29,;35.34,-9.12,;34.24,-10.21,;33.85,-8.72,;35.73,-10.61,;34.63,-11.69,;35.01,-13.18,;36.5,-13.59,;36.89,-15.08,;37.6,-12.5,;37.21,-11.02,;31.11,-4.95,;29.77,-4.18,;29.78,-5.72,;28.44,-4.95,;29.78,-7.26,;28.43,-6.48,;31.11,-3.41,;32.44,-2.64,;29.78,-2.64,;31.1,-1.87,)|
[H][C@@]12CNc3cc(ccc3[C@@]1(CCN2C(=O)C1(O)CCS(=O)(=O)CC1)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r|
C[C@@]1(CC[C@@H](CC1)C(O)=O)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:16.17,4.7,1.0,wD:1.10,15.38,(-5.67,-3.47,;-5.41,-1.95,;-4.64,-.61,;-5.42,.72,;-6.96,.71,;-7.72,-.62,;-6.95,-1.95,;-7.73,2.04,;-9.27,2.04,;-6.97,3.38,;-3.96,-2.47,;-3.69,-3.98,;-2.78,-1.47,;-2.9,.06,;-1.47,.64,;-.48,-.53,;-1.29,-1.84,;-.56,-3.2,;.98,-3.25,;1.79,-1.94,;3.33,-1.99,;4.14,-.68,;3.41,.68,;1.87,.73,;1.06,-.58,;5.68,-.73,;5.73,.81,;7.22,-.77,;8.76,-.82,;7.17,-2.31,;7.27,.77,;5.63,-2.26,;4.28,-2.99,;6.94,-3.08,;5.58,-3.8,;.19,.85,;1.6,1.48,;.51,2.36,;-.67,2.13,;-2.21,2.01,;-3.07,3.29,;-2.4,4.67,;-3.27,5.95,;-.87,4.79,;-0,3.51,)|
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1cccc(F)c1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(15.64,-25.66,;14.31,-26.44,;14.32,-24.88,;12.97,-24.1,;11.63,-24.88,;10.29,-24.12,;8.96,-24.89,;8.96,-26.43,;10.3,-27.2,;11.63,-26.44,;12.96,-27.21,;13.28,-28.73,;14.82,-28.9,;15.46,-27.49,;16.97,-27.17,;17.45,-25.71,;17.99,-28.33,;19.49,-28.01,;20.51,-29.15,;20.03,-30.62,;18.52,-30.94,;17.5,-29.79,;21.06,-31.77,;20.57,-33.24,;22.56,-31.46,;11.86,-28.29,;10.76,-29.38,;10.37,-27.89,;12.25,-29.78,;11.15,-30.86,;11.54,-32.35,;13.02,-32.76,;14.12,-31.67,;15.61,-32.08,;13.73,-30.19,;7.63,-24.12,;6.29,-23.35,;6.3,-24.89,;4.96,-24.12,;6.3,-26.43,;4.95,-25.65,;7.63,-22.58,;8.96,-21.81,;6.3,-21.81,;7.62,-21.04,)|
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)Cc1ccccc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(38.9,-47.28,;37.57,-48.06,;37.57,-46.51,;36.22,-45.72,;34.88,-46.5,;33.55,-45.74,;32.22,-46.51,;32.22,-48.05,;33.55,-48.82,;34.88,-48.06,;36.22,-48.83,;36.53,-50.35,;38.08,-50.52,;38.72,-49.11,;40.23,-48.8,;40.71,-47.34,;41.25,-49.95,;42.74,-49.63,;43.77,-50.78,;43.29,-52.25,;41.78,-52.56,;40.75,-51.41,;44.31,-53.4,;43.83,-54.86,;45.82,-53.08,;35.12,-49.92,;34.02,-51.01,;33.62,-49.51,;35.5,-51.41,;34.4,-52.49,;32.93,-52.07,;31.83,-53.15,;32.21,-54.64,;33.71,-55.05,;34.8,-53.97,;30.89,-45.74,;29.55,-44.97,;29.55,-46.51,;28.22,-45.74,;29.55,-48.05,;28.21,-47.27,;30.89,-44.2,;32.22,-43.43,;29.55,-43.43,;30.88,-42.66,)|
OC(=O)[C@H]1CC[C@@](O)(CC1)C(=O)N1CC[C@@]2([C@H]1CCc1cc(ccc21)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:16.17,3.2,6.6,wD:6.10,15.38,(-6.97,3.38,;-7.73,2.04,;-9.27,2.04,;-6.96,.71,;-5.42,.72,;-4.64,-.61,;-5.41,-1.95,;-5.67,-3.47,;-6.95,-1.95,;-7.72,-.62,;-3.96,-2.47,;-3.69,-3.98,;-2.78,-1.47,;-2.9,.06,;-1.47,.64,;-.48,-.53,;-1.29,-1.84,;-.56,-3.2,;.98,-3.25,;1.79,-1.94,;3.33,-1.99,;4.14,-.68,;3.41,.68,;1.87,.73,;1.06,-.58,;5.68,-.73,;5.73,.81,;7.22,-.77,;8.76,-.82,;7.17,-2.31,;7.27,.77,;5.63,-2.26,;4.28,-2.99,;6.94,-3.08,;5.58,-3.8,;.19,.85,;1.66,1.33,;.51,2.36,;-.67,2.13,;-2.21,2.01,;-3.07,3.29,;-2.4,4.67,;-3.27,5.95,;-.87,4.79,;-0,3.51,)|
[H][C@@]12CNc3cc(ccc3[C@@]1(CCN2C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:16.18,wD:19.25,1.0,10.28,(14.49,-6.66,;13.16,-7.44,;13.16,-5.88,;11.82,-5.1,;10.48,-5.88,;9.14,-5.12,;7.81,-5.89,;7.81,-7.43,;9.15,-8.2,;10.48,-7.44,;11.81,-8.21,;12.13,-9.73,;13.67,-9.9,;14.31,-8.49,;15.82,-8.17,;16.3,-6.71,;16.84,-9.32,;18.34,-9.01,;19.36,-10.15,;18.88,-11.62,;17.37,-11.93,;16.35,-10.79,;19.91,-12.77,;19.42,-14.24,;21.41,-12.46,;10.71,-9.29,;9.61,-10.38,;9.22,-8.89,;11.1,-10.78,;10,-11.86,;10.38,-13.35,;11.87,-13.76,;12.26,-15.25,;12.97,-12.67,;12.58,-11.19,;6.48,-5.12,;5.14,-4.35,;5.15,-5.89,;3.81,-5.12,;5.15,-7.43,;3.8,-6.65,;6.48,-3.58,;7.81,-2.81,;5.15,-2.81,;6.47,-2.04,)|
[H][C@@]12COc3cc(ccc3[C@@]1(CCN2C(=O)C1(O)CCS(=O)(=O)CC1)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r|
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COC(=O)N1CCC(C1)(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
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OC(c1ccc(cc1)[C@@]1(CCNC1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F |r|
CCNC(=O)N1CCC(C1)(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
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CS(=O)(=O)N1CCC(CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
CC(=O)N1CCN(CC1)C(=O)N2CC[C@](C2)(c3ccc(cc3)C(C(F)(F)F)(C(F)(F)F)O)S(=O)(=O)c4ccc(cc4)F
CC(=O)N1CCN(CC1)C(=O)N1CC[C@@](C1)(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
CS(=O)(=O)N1CCC(CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
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OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccccc1 |r,wU:6.9,wD:14.17,3.2,(67.73,-20.71,;66.4,-21.49,;66.4,-23.03,;65.06,-20.73,;65.05,-19.18,;63.71,-18.42,;62.39,-19.2,;62.39,-20.75,;63.73,-21.5,;61.05,-18.44,;61.03,-16.9,;59.72,-19.22,;58.47,-18.32,;57.23,-19.22,;57.7,-20.69,;59.24,-20.69,;56.16,-20.68,;55.37,-22.01,;53.84,-22,;53.08,-20.65,;53.85,-19.33,;55.39,-19.34,;51.54,-20.64,;50.76,-21.97,;51.55,-19.1,;52.89,-18.34,;50.22,-18.32,;51.55,-17.55,;50.21,-19.86,;49.44,-18.52,;49.1,-20.94,;48.67,-19.84,;57.69,-22.23,;56.92,-23.56,;56.15,-22.22,;59.02,-23.01,;59.01,-24.54,;60.34,-25.32,;61.68,-24.55,;61.68,-23.01,;60.35,-22.24,)|
Cc1ccc(cc1)S(=O)(=O)[C@]1(CCN(C1)C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:10.28,20.25,wD:17.18,(3.72,5.97,;2.96,4.63,;1.42,4.61,;.67,3.27,;1.45,1.95,;2.99,1.96,;3.75,3.31,;.69,.61,;.52,2.14,;2.04,-.15,;-.06,-.74,;-1.31,-1.64,;-.83,-3.11,;.71,-3.11,;1.18,-1.64,;1.61,-4.35,;3.15,-4.19,;.99,-5.76,;-.54,-5.92,;-1.17,-7.33,;-.27,-8.57,;1.27,-8.41,;1.89,-7,;-.89,-9.98,;-2.42,-10.14,;.01,-11.22,;-.82,.61,;-2.36,.62,;-3.11,1.96,;-2.33,3.29,;-.79,3.27,;-.03,1.93,;-3.09,4.63,;-3.84,5.97,;-4.43,3.88,;-5.77,3.12,;-5.18,5.22,;-3.67,2.53,;-1.74,5.39,;-.4,6.14,;-.99,4.05,;-2.5,6.73,)|
OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(Cl)cc1 |r,wU:14.17,3.2,wD:6.9,(-2.42,-10.14,;-.89,-9.98,;.01,-11.22,;-.27,-8.57,;-1.17,-7.33,;-.54,-5.92,;.99,-5.76,;1.89,-7,;1.27,-8.41,;1.61,-4.35,;3.15,-4.19,;.71,-3.11,;-.83,-3.11,;-1.31,-1.64,;-.06,-.74,;1.18,-1.64,;-.82,.61,;-2.36,.62,;-3.11,1.96,;-2.33,3.29,;-.79,3.27,;-.03,1.93,;-3.09,4.63,;-3.84,5.97,;-4.43,3.88,;-5.77,3.12,;-5.18,5.22,;-3.67,2.53,;-1.74,5.39,;-.4,6.14,;-.99,4.05,;-2.5,6.73,;.69,.61,;.52,2.14,;2.04,-.15,;1.45,1.95,;.67,3.27,;1.42,4.61,;2.96,4.63,;3.72,5.97,;3.75,3.31,;2.99,1.96,)|
Cc1cc(ccc1F)S(=O)(=O)[C@]1(CCN(C1)C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:11.29,21.26,wD:18.19,(2.32,6.24,;2.8,4.77,;1.77,3.63,;2.25,2.16,;3.75,1.84,;4.78,2.99,;4.31,4.45,;5.34,5.6,;1.22,1.02,;2.36,-.01,;.07,2.05,;.18,-.12,;-1.06,-1.03,;-.59,-2.49,;.95,-2.49,;1.43,-1.03,;1.86,-3.74,;3.39,-3.58,;1.23,-5.15,;-.3,-5.31,;-.92,-6.71,;-.02,-7.96,;1.51,-7.8,;2.14,-6.39,;-.65,-9.37,;.26,-10.61,;-2.18,-9.53,;-.85,1.02,;-.37,2.48,;-1.4,3.63,;-2.91,3.31,;-3.38,1.84,;-2.35,.7,;-3.94,4.45,;-4.97,5.6,;-5.08,3.42,;-6.23,2.39,;-6.11,4.57,;-4.05,2.28,;-2.79,5.48,;-1.65,6.51,;-1.76,4.34,;-3.82,6.63,)|
CC(=O)N1CCC(C1)(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:14.17,3.2,wD:6.9,(-2.42,-10.14,;-.89,-9.98,;.01,-11.22,;-.27,-8.57,;-1.17,-7.33,;-.54,-5.92,;.99,-5.76,;1.89,-7,;1.27,-8.41,;1.61,-4.35,;3.15,-4.19,;.71,-3.11,;-.83,-3.11,;-1.31,-1.64,;-.06,-.74,;1.18,-1.64,;-.82,.61,;-2.36,.62,;-3.11,1.96,;-2.33,3.29,;-.79,3.27,;-.03,1.93,;-3.09,4.63,;-3.84,5.97,;-4.43,3.88,;-5.77,3.12,;-5.18,5.22,;-3.67,2.53,;-1.74,5.39,;-.4,6.14,;-.99,4.05,;-2.5,6.73,;.69,.61,;.52,2.14,;2.04,-.15,;1.45,1.95,;.67,3.27,;1.42,4.61,;2.96,4.63,;3.72,5.97,;3.75,3.31,;2.99,1.96,)|
OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)c(c1)C1CC1 |r,wU:14.17,3.2,wD:6.9,(2.94,11.52,;3.42,10.06,;4.92,9.74,;2.39,8.91,;2.86,7.45,;1.83,6.3,;.32,6.62,;-.15,8.09,;.88,9.23,;-.71,5.48,;-2.21,5.8,;-.23,4.01,;1.23,3.54,;1.23,2,;-.23,1.52,;-1.14,2.77,;.4,.12,;-.51,-1.13,;.12,-2.54,;1.65,-2.7,;2.55,-1.45,;1.93,-.05,;2.28,-4.11,;2.9,-5.51,;3.68,-3.48,;5.09,-2.85,;4.31,-4.89,;3.06,-2.07,;.87,-4.73,;-.54,-5.36,;.24,-3.32,;1.5,-6.14,;-1.56,.75,;-2.33,2.09,;-.79,-.58,;-2.9,-.02,;-4.23,.75,;-5.56,-.02,;-5.56,-1.56,;-6.9,-2.33,;-4.23,-2.33,;-2.9,-1.56,;-4.23,-3.87,;-3.46,-5.2,;-5,-5.2,)|
CC(=O)N1CCN(CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
OC(c1ccc(cc1)C1(CCN(C1)C(=O)C1CCCC1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F
OC(c1ccc(cc1)[C@]1(CCNC1)S(=O)(=O)c1ccc(F)cc1)(C(F)(F)F)C(F)(F)F |r|
c1cc(ccc1[C@@]2(CCN(C2)C(=O)C3CCC(CC3)C(=O)O)S(=O)(=O)c4ccc(cc4)F)C(C(F)(F)F)(C(F)(F)F)F
CCc1ccc(cc1)S(=O)(=O)[C@]1(CCN(C1)C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:11.29,21.26,wD:18.19,(1.07,7.43,;.18,6.18,;.82,4.78,;-.07,3.52,;.57,2.12,;2.1,1.98,;3,3.23,;2.35,4.63,;2.74,.58,;4.15,1.22,;3.39,-.82,;1.34,-.06,;.1,-.97,;.57,-2.43,;2.11,-2.43,;2.59,-.97,;3.02,-3.68,;4.55,-3.52,;2.39,-5.09,;.86,-5.25,;.24,-6.65,;1.14,-7.9,;2.67,-7.74,;3.3,-6.33,;.51,-9.31,;-1.02,-9.47,;1.42,-10.55,;-.06,.58,;-1.31,-.31,;-2.71,.33,;-2.86,1.86,;-1.6,2.75,;-.2,2.11,;-4.26,2.5,;-4.9,1.1,;-3.62,3.9,;-2.97,5.3,;-2.21,3.26,;-5.02,4.54,;-5.66,3.14,;-5.96,4.65,;-6.3,1.74,;-7.06,3.78,)|
CCc1cc(ccc1F)S(=O)(=O)[C@]1(CCN(C1)C(=O)[C@H]1CC[C@@H](CC1)C(O)=O)c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F |r,wU:12.30,22.27,wD:19.20,(3.42,7.12,;2.39,5.97,;2.86,4.51,;1.83,3.36,;2.31,1.9,;3.82,1.58,;4.85,2.72,;4.37,4.19,;5.4,5.33,;1.28,.75,;2.42,-.28,;.14,1.78,;.25,-.39,;-1,-1.3,;-.52,-2.76,;1.02,-2.76,;1.5,-1.3,;1.92,-4.01,;3.46,-3.85,;1.3,-5.41,;-.23,-5.57,;-.86,-6.98,;.05,-8.23,;1.58,-8.07,;2.2,-6.66,;-.58,-9.63,;.32,-10.88,;-2.11,-9.79,;-.78,.75,;-.31,2.22,;-1.34,3.36,;-2.84,3.04,;-3.32,1.58,;-2.29,.43,;-3.87,4.19,;-4.9,5.33,;-5.02,3.16,;-6.16,2.13,;-6.05,4.3,;-3.99,2.01,;-2.73,5.22,;-1.58,6.25,;-1.7,4.07,;-3.76,6.36,)|
OC(=O)C1CCN(CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C(C)C)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@]([H])(O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C)CCC |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCCCC1 |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC(C)C(=O)N(C)CC |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C[C@H]1CCN(C)C1=O |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C[C@@H]1CCCCN(C)C1=O |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(C)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C[C@H]1CCCN(C)C1=O |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)NC(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N1CCCC1 |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C[C@@H]1CCCN(CC)C1=O |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)N(CC)CC |r,t:9|
CN1CCN(Cc2ccc(N)cc2C(F)(F)F)CC1
COc1ccc(OC)c(Cl)c1
CC(=O)c1c(C)ccc2ccccc12
[H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@H](O)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)NCCCCCCNC(=S)Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12 |r|
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1
CC(C)(C)OC(=O)N1CCc2ccc(cc2C1)N
Brc1ccc2NC(=O)OCc2c1
COC(=O)c1ccc2CN(CCn12)C(=O)OC(C)(C)C
CCOC(=O)c1cn2nc[nH]c(=O)c2c1C(C)C
c1cc(ccc1O)Cl
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C(C)(C)C1
c1ccc(cc1)Oc2ccc(cc2)O
COC(=O)CC1CC2CC(F)(F)C(C1)N2Cc1ccccc1 |TLB:15:14:9.8:6.5.13|
CCCCOC(=O)c1ccc(cc1)O
c1cc(cc(c1)Cl)O
c1cc(ccc1O)Sc2ccc(cc2)O
Brc1nn(C2CCCCO2)c2ncccc12
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
CC(C)(C)OC(=O)N1CC2CC(CO)CC2C1
CC(C)[C@@H]1CN(CCN1c1ncc(COC(=O)CCCCCNC(=S)Nc2ccc3c(c2)C(=O)OC32c3ccc(O)cc3Oc3cc(O)ccc23)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|
COC(=O)c1ccc2cc[nH]c2c1
Clc1ccccc1-c1n[nH]c(Cc2ccccc2)n1
CC(=O)n1nc(nc1-c1ccccc1)-c1ccccc1
c1ccc(cc1)-c1n[nH]c(n1)-c1ccccc1
Brc1ccccc1-c1n[nH]c(n1)-c1ccccc1
Clc1ccc(cc1)-c1n[nH]c(n1)-c1ccccc1
Brc1ccc(cc1)-c1n[nH]c(n1)-c1ccccc1
COc1cccc(c1)-c1n[nH]c(n1)-c1ccccc1
C(c1nc(n[nH]1)-c1ccccc1)c1ccccc1
COc1cccc(c1)-c1nc(-c2ccccc2)n(Cc2ccccc2)n1
Cn1nc(nc1-c1ccccc1)-c1ccc(Cl)cc1
Clc1ccc(cc1)-c1nc(-c2ccccc2)n(Cc2ccccc2)n1
Brc1ccc(cc1)-c1nc(-c2ccccc2)n(Cc2ccccc2)n1
CC(=O)n1nc(nc1-c1ccccc1)-c1ccc(Br)cc1
CC(=O)n1nc(nc1-c1ccccc1)-c1ccc(C)cc1
CC(=O)n1nc(Cc2ccccc2)nc1-c1ccccc1
Cc1ccc(cc1)S(=O)(=O)n1nc(nc1-c1ccccc1)-c1ccccc1
Cn1nc(nc1-c1ccccc1)-c1ccccc1
Clc1ccccc1-c1n[nH]c(n1)-c1ccccc1
Cc1ccc(cc1)-c1n[nH]c(n1)-c1ccccc1
Clc1ccc(cc1)-c1n[nH]c(Cc2ccccc2)n1
CCn1nc(nc1-c1ccccc1)-c1ccc(Br)cc1
COc1cccc(c1)-c1nc(-c2ccccc2)n(n1)C(C)=O
OC(=O)C1CCC(O)(CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
OC(=O)C12CCC(CC1)(CC2)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
CS(=O)(=O)C1CCC(CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wD:15.18,(8.43,1.01,;7.66,2.34,;8.43,3.68,;7.66,3.88,;6.12,2.34,;5.35,1.01,;3.81,1.01,;3.04,2.34,;3.81,3.68,;5.35,3.68,;1.5,2.34,;.73,3.68,;.73,1.01,;-.73,1.48,;-1.64,.24,;-.73,-1.01,;.73,-.53,;-2.27,-1.01,;-3.04,.33,;-4.58,.33,;-5.35,-1.01,;-4.58,-2.34,;-3.04,-2.34,;-6.89,-1.01,;-8.43,-1.01,;-6.89,.53,;-8.23,1.3,;-5.56,1.3,;-7.66,1.87,;-6.89,-2.55,;-8.23,-3.32,;-5.56,-3.32,;-6.12,-3.88,;.04,-2.34,;.04,-3.88,;-.73,-3.68,;1.58,-2.34,;2.35,-3.68,;3.89,-3.68,;4.66,-2.34,;6.2,-2.34,;3.89,-1.01,;2.35,-1.01,)|
C[C@@]1(CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1)C(O)=O |r,wU:12.15,1.43,wD:4.7,1.0,(.2,-7.36,;1.42,-6.41,;.51,-5.16,;1.14,-3.76,;2.67,-3.6,;3.57,-4.84,;2.95,-6.25,;3.3,-2.19,;4.83,-2.03,;2.39,-.94,;.85,-.94,;.37,.52,;1.62,1.43,;2.87,.52,;.09,1.27,;-.54,-.14,;-2.07,-.3,;-2.97,.94,;-2.35,2.35,;-.82,2.51,;-4.51,.78,;-4.34,-.75,;-4.67,2.31,;-4.83,3.85,;-3.14,2.48,;-6.2,2.15,;-6.04,.62,;-7.57,.46,;-7.07,1.77,;-5.88,-.91,;2.65,2.57,;3.8,1.54,;3.68,3.72,;1.51,3.6,;.04,3.13,;-1.1,4.16,;-.78,5.66,;-1.93,6.69,;.68,6.14,;1.83,5.11,;1.52,-7.95,;2.91,-8.62,;.25,-8.81,)|
OC1(CCS(=O)(=O)CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
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OC(=O)[C@H]1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
OC(=O)C12CCC(CC1)(CO2)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:16.20,(-1.15,.45,;-2.05,2.08,;-3.48,1.02,;-1.75,4.01,;-1.49,5.95,;-1.94,7.08,;-2.01,5.41,;-.63,4.79,;-.35,3.37,;-3.51,4.75,;-3.31,3.34,;-2.48,3.55,;-3.94,2.45,;-.85,2.94,;.54,3.61,;1.61,2.5,;.88,1.14,;-.64,1.41,;.45,-.34,;1.52,-1.45,;1.09,-2.93,;-.41,-3.29,;-1.47,-2.18,;-1.04,-.7,;-.84,-4.77,;-1.27,-6.25,;.64,-5.2,;2.12,-5.63,;.21,-6.68,;1.07,-3.72,;-2.32,-4.34,;-3.79,-3.92,;-1.89,-2.87,;-2.74,-5.82,;2.61,1.03,;4.04,1.93,;2,-.46,;3.73,-.02,;5.21,.43,;6.33,-.63,;5.98,-2.13,;7.1,-3.18,;4.5,-2.57,;3.38,-1.52,)|
COC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:4.3,wD:15.18,7.10,(-10.36,-5.17,;-8.82,-5.33,;-7.92,-4.08,;-8.54,-2.67,;-6.39,-4.24,;-5.48,-3,;-3.95,-3.16,;-3.32,-4.56,;-4.23,-5.81,;-5.76,-5.65,;-1.79,-4.72,;-1.17,-6.13,;-.89,-3.48,;.65,-3.48,;1.13,-2.01,;-.12,-1.11,;-1.36,-2.01,;.91,.04,;.44,1.5,;1.47,2.64,;2.97,2.32,;3.45,.86,;2.42,-.28,;4,3.47,;5.04,4.61,;2.86,4.5,;1.72,5.53,;3.89,5.64,;1.83,3.36,;5.15,2.44,;6.29,1.41,;4.12,1.29,;6.18,3.58,;-1.15,.04,;-0,1.07,;-2.29,-.99,;-2.18,1.18,;-3.68,.86,;-4.71,2,;-4.24,3.47,;-5.27,4.61,;-2.73,3.79,;-1.7,2.64,)|
O[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:12.15,1.0,wD:4.7,(-1.21,-4.9,;-.58,-3.49,;-1.49,-2.25,;-.86,-.84,;.67,-.68,;1.58,-1.92,;.95,-3.33,;1.3,.73,;2.83,.89,;.39,1.97,;-1.15,1.97,;-1.62,3.44,;-.38,4.34,;.87,3.44,;-1.13,5.69,;-2.67,5.7,;-3.43,7.04,;-2.65,8.37,;-1.11,8.35,;-.35,7.01,;-3.4,9.71,;-4.16,11.05,;-4.74,8.96,;-6.09,8.2,;-5.5,10.3,;-3.99,7.61,;-2.06,10.47,;-.72,11.22,;-1.3,9.13,;-2.82,11.81,;.38,5.69,;.2,7.22,;1.13,7.03,;1.72,4.93,;3.05,5.71,;4.39,4.96,;4.4,3.42,;5.74,2.66,;3.08,2.63,;1.74,3.39,)|
CC1(CCS(=O)(=O)CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
C[C@]1(CC[C@@H](CC1)C(O)=O)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:1.10,4.7,wD:15.18,(41.31,-8.68,;39.98,-7.91,;41.31,-7.13,;41.31,-5.59,;39.97,-4.82,;38.63,-5.6,;38.64,-7.15,;39.97,-3.28,;38.63,-2.52,;41.3,-2.51,;39.99,-9.45,;41.36,-10.15,;38.7,-10.3,;37.26,-9.75,;36.3,-10.95,;37.14,-12.24,;38.63,-11.84,;35.59,-12.24,;34.83,-13.57,;33.29,-13.57,;32.52,-12.25,;33.28,-10.92,;34.83,-10.91,;30.98,-12.25,;29.44,-12.23,;30.21,-10.92,;28.67,-10.92,;30.97,-9.58,;29.42,-9.57,;30.22,-13.59,;28.68,-13.59,;30.99,-14.92,;29.43,-14.91,;37.9,-13.57,;37.89,-15.11,;36.56,-14.34,;39.44,-13.58,;40.21,-14.91,;41.74,-14.91,;42.52,-13.58,;44.06,-13.58,;41.74,-12.24,;40.2,-12.25,)|
OCC1(CCS(=O)(=O)CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r|
NC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CC[C@](C1)(c1ccc(cc1)C(F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |r,wU:14.17,3.2,wD:6.9,(.2,-10.82,;-.7,-9.58,;-2.23,-9.74,;-.07,-8.17,;-.98,-6.92,;-.35,-5.52,;1.18,-5.36,;2.08,-6.6,;1.46,-8.01,;1.8,-3.95,;3.34,-3.79,;.9,-2.7,;-.64,-2.7,;-1.12,-1.24,;.13,-.33,;1.38,-1.24,;-.9,.81,;-.43,2.28,;-1.46,3.42,;-2.96,3.1,;-3.44,1.64,;-2.41,.49,;-3.99,4.24,;-5.02,5.39,;-5.14,3.21,;-6.28,2.18,;-6.17,4.36,;-4.11,2.07,;-2.85,5.28,;-1.7,6.31,;-1.82,4.13,;-3.88,6.42,;1.16,.81,;2.3,-.22,;.02,1.84,;2.19,1.96,;1.71,3.42,;2.74,4.56,;4.25,4.24,;5.28,5.39,;4.73,2.78,;3.7,1.64,)|
C[C@H]1C[C@@H](CC[C@H]1C(=O)N2CC[C@@]3([C@H]2CCc4c3ccc(c4)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c5ccc(cc5)F)C(=O)O
CC(C)(CN1[C@@H](C[C@H](C1=O)F)C(=O)N2CC[C@@]3([C@H]2CCc4c3ccc(c4)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c5ccc(cc5)F)O
[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)[C@H](CC)[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])[C@@H](O)C[C@]12C)[C@H](C)CCC(O)=O |r|
CC(C)(C)OC(=O)N1CC[C@@]2([C@H]1c1cccc(c1)-c1ccccc1)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@]2([C@@H]1c1cccc(c1)-c1ccccc1)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@@]2([C@H]1c1cccc(c1)-c1ccc(CO)cc1)C(=O)Nc1ccccc21 |r|
CN(C)C(=O)c1ccc(cc1Cl)-c1cccc(c1)[C@H]1N(CC[C@]11C(=O)Nc2ccccc12)C(=O)OC(C)(C)C |r|
CC(C)(C)OC(=O)N1CC[C@@]2([C@H]1c1cccc(c1)-c1cccc(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@@]2([C@H]1c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@]2([C@@H]1c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
COC(=O)c1ccc(cc1S(C)(=O)=O)-c1cccc(c1)[C@H]1N(CC[C@]11C(=O)Nc2ccccc12)C(=O)OC(C)(C)C |r|
COC(=O)c1ccc(cc1S(C)(=O)=O)-c1cccc(c1)[C@@H]1N(CC[C@@]11C(=O)Nc2ccccc12)C(=O)OC(C)(C)C |r|
CC(C)(C)OC(=O)N1CC[C@@]2([C@H]1c1cccc(c1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@]2([C@@H]1c1cccc(c1)-c1cc(F)c(CO)c(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@@]2([C@H]1c1cccc(Nc3ccc(CO)c(c3)S(C)(=O)=O)c1)C(=O)Nc1ccccc21 |r|
CC(C)(C)OC(=O)N1CC[C@]2([C@@H]1c1cccc(Nc3ccc(CO)c(c3)S(C)(=O)=O)c1)C(=O)Nc1ccccc21 |r|
CC(C)(C)CC(=O)N1CC[C@@]2([C@H]1c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
CC(C)(C)CC(=O)N1CC[C@]2([C@@H]1c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)Nc1ccccc21 |r|
[H][C@@]12CCc3cc(c(F)cc3[C@@]1(CCN2C(=O)[C@@H]1CC[C@H](C[C@@H]1C)C(O)=O)S(=O)(=O)c1ccccc1)C(F)(C(F)(F)F)C(F)(F)F |r|
C[C@@](CS(=O)(=O)C)(C(=O)N[C@@H]1CC[C@@]2([C@H]1CCc3c2ccc(n3)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c4ccc(cc4)F)O
C[C@@]1(CN(C[C@H]1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)C(=O)C1CCN(CC1)C(=O)CC#N)c1ccc(F)cc1 |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)OC(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)CC(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)C(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)C(F)(F)F |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(C(O)=O)c(c1)S(C)(=O)=O)C(=O)OC(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)c(Cl)c1)C(=O)OC(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)cc1)C(=O)OC(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(C(=O)N(C)C)c(Cl)c1)C(=S)NC(C)(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(C(=O)N(C)C)c(Cl)c1)S(=O)(=O)C(C)C |r|
CC(C)[C@@H]1N(CC[C@@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc2ccn(C)c2c1)C(=O)OC(C)(C)C |r|
CC(C)[C@H]1N(CC[C@]11C(=O)N(c2ccccc12)c1cccc(c1)-c1ccc(CO)c(c1)S(C)(=O)=O)C(=O)OC(C)(C)C |r|
CC(C)(C(=O)N[C@@H]1CC[C@@]2([C@H]1CCc3c2ccc(c3)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c4ccc(cc4)F)O
[H][C@@]12CCc3cc(ccc3[C@@]1(CCN2N[C@@H]1CC[C@H](C[C@@H]1C)C(O)=O)S(=O)(=O)c1ccc(F)cc1)C(F)(C(F)(F)F)C(F)(F)F |r|
OC(=O)c1cc(c2cc(ccc2n1)N1CCC2(CC(=C2)c2c(onc2-c2c(Cl)cncc2Cl)C2CC2)CC1)C(F)(F)F |c:20,(46.96,-23.25,;46.47,-24.71,;47.49,-25.87,;44.96,-25.01,;44.46,-26.48,;42.95,-26.78,;41.94,-25.62,;40.43,-25.91,;39.43,-24.74,;39.93,-23.29,;41.43,-22.99,;42.44,-24.16,;43.95,-23.86,;37.92,-25.03,;37.41,-26.48,;35.91,-26.76,;34.9,-25.6,;33.89,-24.44,;32.72,-25.45,;33.74,-26.62,;31.19,-25.35,;30.71,-23.88,;29.16,-23.89,;28.69,-25.36,;29.95,-26.26,;29.96,-27.8,;28.63,-28.57,;27.29,-27.8,;28.63,-30.11,;29.96,-30.88,;31.3,-30.11,;31.29,-28.56,;32.62,-27.79,;31.6,-22.64,;33.01,-22.01,;31.76,-21.1,;35.4,-24.15,;36.91,-23.86,;42.45,-28.23,;43.47,-29.39,;40.97,-27.83,;41.68,-29.57,)|
Clc1c2C(=O)N(C(=O)c2c(Cl)c(Cl)c1Cl)c1ccccc1\C=C/c1cccs1
C[Si](C)(C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CC[Si](CC)(CC)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCC[Si](CCC)(CCC)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
OC(c1ccc(cc1)[Si](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1)(C(F)(F)F)C(F)(F)F
C[Si](C)(C=C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(CC=C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CCCC[Si](C)(C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CC(C)(C)[Si](C)(C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(C1CCCCC1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(Cc1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(C)[Si](C)(C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CC[Si](C)(CC)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(CCO)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
CC(O)[Si](C)(C)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](C)(CCCO)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
C[Si](O)(c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
OC(c1ccc(cc1)N(C(F)(F)F)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
COC(=O)c1ccc(cc1S(C)(=O)=O)-c1cc(F)cc(c1)[C@H]1N(CC[C@]11C(=O)Nc2ccccc12)C(=O)OC(C)(C)C |r|
OC(=O)Cc1ccc(cc1)-c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)cc1 |(-8.72,6.29,;-7.62,5.2,;-8.01,3.71,;-6.14,5.59,;-5.04,4.5,;-3.56,4.89,;-2.46,3.79,;-2.85,2.31,;-4.34,1.92,;-5.43,3.01,;-1.76,1.21,;-.27,1.6,;.82,.51,;.43,-.98,;1.52,-2.07,;3.01,-1.6,;4.18,-2.62,;4.03,-4.18,;5.43,-4.81,;6.45,-3.64,;5.67,-2.31,;6.29,-.9,;5.36,.35,;3.87,.2,;5.98,1.76,;7.54,1.92,;8.48,.66,;7.86,-.74,;8.72,-1.99,;2.62,-4.96,;1.92,-6.29,;1.13,-4.96,;-1.06,-1.37,;-2.15,-.27,)|
CCc1c(c(nn1-c1ccccc1-c1cccc(OCC(O)=O)c1)-c1ccccc1)-c1ccccc1
C[C@H]1CCCCN1c1cc(nnc1N)-c1ccccc1O |r|
Nc1nnc(cc1N1CCCCC1)-c1ccccc1O
Nc1nnc(cc1-c1ccccc1)-c1ccccc1O
C[C@@H]1CCCCN1c1cc(nnc1N)-c1ccccc1O |r|
Nc1nnc(cc1N1CCCC1)-c1ccccc1O
C[C@H]1CCCN1c1cc(nnc1N)-c1ccccc1O |r|
C[C@@H]1CCCN1c1cc(nnc1N)-c1ccccc1O |r|
CC[C@H]1CCCN1c1cc(nnc1N)-c1ccccc1O |r|
Nc1nnc(cc1N1CCC[C@@H]1C1CC1)-c1ccccc1O |r|
C[C@H]1CCCCN1c1cc(nnc1N)-c1ccco1 |r|
c1ccc(c(c1)C(=O)/C=C/N2C[C@H]3C[C@@H]2CN3c4ccccn4)O
C[C@@H]1CN(CCN1C(C)=O)c1cc(nnc1N)-c1ccccc1O |r|
CC(C)[C@H]1CCCN1c1cc(nnc1N)-c1ccccc1O |r|
C[C@H]1CCCN1c1cc(nnc1N)-c1ccco1 |r|
C[C@@H]1CCCN1c1cc(nnc1N)-c1ccco1 |r|
CC[C@H]1CCCN1c1cc(nnc1N)-c1ccco1 |r|
CC(C)[C@H]1CCCN1c1cc(nnc1N)-c1ccco1 |r|
[H][C@]1([#6]-[#6@H](-[#8]-[#6@H]1-[#8])\[#6]=[#6](\[#6])-[#6])[C@]1([H])[#6]-[#6][C@]2([#6])[#6]3=[#6]-[#6][C@@]4([H])C([#6])([#6])[#6](=O)-[#6]-[#6][C@]4([#6])[C@@]3([H])[#6]-[#6][C@@]12[#6] |r,t:18|
CCOC(=O)c1cccc(NC(=O)c2sccc2S(=O)(=O)N(C)c2ccc(OCC)cc2)c1
CCOc1ccc(N(C)S(=O)(=O)c2ccsc2C(=O)Nc2cccc(C(=O)OC)c2)cc1
CCOc1cccc(N(C)S(=O)(=O)c2ccsc2C(=O)Nc2cccc(C(=O)OC)c2)c1
CCCOc1ccc(N(C)S(=O)(=O)c2ccsc2C(=O)Nc2cccc(C(=O)OCC)c2)cc1
CCOC(=O)c1cccc(NC(=O)c2sccc2S(=O)(=O)N(C)c2ccc(OCC)c(OCC)c2)c1
CCCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cccc(C(=O)OCC)c2)cc1OCCC
CCOC(=O)c1cccc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)cc2)c1
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cccc(S(C)(=O)=O)c2)cc1OCC
CCOC(=O)c1cccc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)c(OC)c2)c1
CCOC(=O)c1cccc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)cc2F)c1
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cccc(C(=O)OCCOC)c2)cc1OCC
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cccc(C(=O)OCCOCCOC)c2)cc1OCC
CCOC(=O)c1cccc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(N(C)C)cc2)c1
CCOC(=O)c1cc(Cl)cc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)c(OCC)c2)c1
CCOC(=O)c1cc(N)cc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)c(OCC)c2)c1
CCOC(=O)c1cc(Cl)cc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)c(OC)c2)c1
CCOC(=O)c1cc(Cl)cc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OC)c(OC)c2)c1
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cc(Cl)cc(C(=O)OC)c2)cc1OC
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cc(Cl)cc(C(=O)OCCOC)c2)cc1OC
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cc(Cl)cc(C(=O)OCCOCCOC)c2)cc1OC
CCOC(=O)c1cc(F)cc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)c(OC)c2)c1
CCOC(=O)c1cc(Br)cc(NC(=O)c2sc(Cl)cc2S(=O)(=O)N(C)c2ccc(OCC)c(OC)c2)c1
CCOc1ccc(N(C)S(=O)(=O)c2cc(Cl)sc2C(=O)Nc2cc(Cl)cc(C3OCCO3)c2)cc1OC
CCOC(=O)c1cccc(-c2nnc(-c3sc(Cl)cc3S(=O)(=O)N(C)c3ccc(OCC)c(OC)c3)o2)c1
CC(C)CN(c1ccc(-c2ccc(OCC(=O)O)c(F)c2)cc1)S(=O)(=O)c1c(Cl)cccc1Cl
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12