251 SMILES Strings for Chymotrypsin-C

Compound Name
SMILES String
CCOc1cc2c(cc1OC)nc(oc2=O)-c1ccccc1SC
CCOc1cc2c(cc1OC)nc(oc2=O)-c1ccccc1Cl
CCOc1cc2c(cc1OC)nc(oc2=O)-c1ccc(OC)cc1OC
CCOc1cc2c(cc1OC)nc(oc2=O)-c1ccccc1S(C)(=O)=O
CCOc1cc2c(cc1OC)nc(oc2=O)-c1ccccc1OC
COc1ccccc1-c1nc2cc3OCCCOc3cc2c(=O)o1
Clc1ccccc1-c1nc2cc3OCCCOc3cc2c(=O)o1
COc1ccc(c(OC)c1)-c1nc2cc3OCCCOc3cc2c(=O)o1
CSc1ccccc1-c1nc2cc3OCCCOc3cc2c(=O)o1
CS(=O)(=O)c1ccccc1-c1nc2cc3OCCCOc3cc2c(=O)o1
CC(C)c1ccc(-c2nc3cc4OCCCOc4cc3c(=O)o2)c(c1)C(C)C
COc1cc2nc(oc(=O)c2cc1OC)-c1ccccc1SC
COc1ccccc1-c1nc2cc3OCCOc3cc2c(=O)o1
CS(=O)(=O)c1ccccc1-c1nc2cc3OCCOc3cc2c(=O)o1
COC1CC(OC)=CC=C1c1nc2cc3OCCOc3cc2c(=O)o1 |c:6,8|
Clc1ccccc1-c1nc2cc3OCCOc3cc2c(=O)o1
COc1ccc(c(OC)c1)-c1nc2cc(OC)c(OC)cc2c(=O)o1
COc1cc2nc(oc(=O)c2cc1OC)-c1ccccc1I
NC(=N)c1ccc2nc(Cc3nc4ccc(cc4[nH]3)C(N)=N)[nH]c2c1
Fc1ccc(cc1)C(=O)n1cc(Cl)cn1
COC(=O)c1ccnn1C(=O)c1ccc(Cl)cc1
[O-][N+](=O)c1cccc(c1)C(=O)n1cc(Cl)cn1
Cc1ccc(C(=O)c2ccn(n2)C(=O)c2ccc(F)cc2)c(C)c1
[O-][N+](=O)c1cnn(c1)C(=O)c1ccccc1
O=C(Nc1ccccc1)c1ccn(n1)C(=O)c1ccccc1
Cc1ccc(cc1)C(=O)n1cc(Br)cn1
Clc1ccc(cc1Cl)C(=O)n1cccn1
Cc1cc(nn1C(=O)c1ccccc1F)[N+]([O-])=O
Fc1cccc(F)c1C(=O)n1cc(Br)cn1
COc1cc(cc(OC)c1OC)C(=O)n1ccc(C)n1
Cc1ccc(cc1)C(=O)n1ccc(n1)[N+]([O-])=O
[O-][N+](=O)c1ccn(n1)C(=O)c1ccccc1
Cc1ccccc1C(=O)n1cc(cn1)[N+]([O-])=O
Cc1ccccc1C(=O)n1cc(Cl)cn1
Cc1cccc(c1)C(=O)n1cc(Br)cn1
Cc1ccccc1C(=O)n1cc(Br)cn1
CC(=O)Nc1ccc(cc1)C(=O)n1ccc(C)n1
Clc1cnn(c1)C(=O)c1ccccc1Cl
Cc1ccccc1C(=O)n1cccn1
Fc1cc(Cl)c(cc1F)C(=O)n1cc(Br)cn1
CC(C)(C)c1ccc(cc1)C(=O)n1cc(Cl)cn1
Cc1nn(C(=O)c2ccccc2F)c(C)c1Cl
Cc1nn(C(=O)c2ccc(Cl)cc2)c(C)c1Cl
COc1ccc(cc1)C(=O)n1nc(C)c(Br)c1C
Brc1ccccc1C(=O)n1cccn1
COc1cc(cc(OC)c1OC)C(=O)n1nc(C)c(C)c1C
CC(C)(C)NC(=O)CN(C(=O)CCN1CCCc2ccccc12)C(C)(C)C
CC1CCC(CC1)NC(=O)c1cccc(c1)S(=O)(=O)N1CCN(C)CC1 |(3.08,-7.7,;4.41,-6.93,;5.75,-7.7,;7.08,-6.93,;7.08,-5.39,;5.75,-4.62,;4.41,-5.39,;8.41,-4.62,;8.41,-3.08,;7.08,-2.31,;9.75,-2.31,;11.08,-3.08,;12.42,-2.31,;12.42,-.77,;11.08,,;9.75,-.77,;11.08,1.54,;12.62,1.54,;9.54,1.54,;11.08,3.08,;12.42,3.85,;12.42,5.39,;11.08,6.16,;11.08,7.7,;9.75,5.39,;9.75,3.85,)|
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)N[C@@H](Cc1ccccc1)C(O)=O)C1CCNC(N)=N1)C(=O)N[C@@H](Cc1ccccc1)C=O |c:30|
CCn1c2ccccc2c2cc(\C=C\c3ccc4ccccc4[n+]3CCCCCC(=O)NCCN)ccc12
CCn1c2ccccc2c2cc(\C=C\c3ccc4ccccc4[n+]3C)ccc12
CCn1c2ccccc2c2cc(\C=C\c3ccc4ccccc4[n+]3CCCCS([O-])(=O)=O)ccc12
NCCNC(=O)CCCCC[n+]1c(\C=C\c2c([nH]c3ccccc23)-c2ccccc2)ccc2ccccc12
C[n+]1c(\C=C\c2c([nH]c3ccccc23)-c2ccccc2)ccc2ccccc12
[O-]S(=O)(=O)CCCC[n+]1c(\C=C\c2c([nH]c3ccccc23)-c2ccccc2)ccc2ccccc12
C(=C/c1ccc2ccccc2n1)\c1c([nH]c2ccccc12)-c1ccccc1
C[C@H](NC(C)=O)C(=O)NN=CC(Cc1ccccc1)NC(=O)c1ccccc1 |w:9.8|
O=C(NN=CC(Cc1ccccc1)NC(=O)c1ccccc1)c1cccnc1 |w:3.2|
C[C@H](NC(C)=O)C(=O)NN=CCNC(=O)c1ccccc1 |w:10.10|
I\C=C1\OC(=O)CC1c1ccccc1
Oc1ccc(Cc2cc(coc2=O)C(F)(F)F)cc1
FC(F)(F)c1coc(=O)c(Cc2ccccc2)c1
ClCc1coc(=O)c(Cc2ccccc2)c1
Brc1coc(=O)c(Cc2ccccc2)c1
COc1ccc(Cc2cc(coc2=O)C(F)(F)F)cc1
O=c1occcc1Cc1ccccc1
Clc1cc(cc(=O)o1)-c1ccccc1
O=c1cc(cco1)-c1ccccc1
O=c1ccc(co1)-c1ccccc1
CCCCc1ccc(=O)oc1Cl
Clc1ccc(-c2ccccc2)c(=O)o1
Clc1oc(=O)ccc1Cc1ccc2ccccc2c1
O=c1occcc1Cc1ccc2ccccc2c1
CCc1ccc(=O)oc1Cl
CCc1ccc(Cl)oc1=O
O=c1ccc(Cc2ccccc2)co1
FC(F)(F)c1ccc(Cc2ccccc2)c(=O)o1
Brc1oc(=O)ccc1Cc1ccccc1
O=c1occcc1Cc1cccc2ccccc12
Clc1oc(=O)ccc1-c1ccccc1
Clc1ccc(Cc2ccc3ccccc3c2)c(=O)o1
Clc1oc(=O)ccc1Cc1ccccc1
Clc1ccc(Cc2cccc3ccccc23)c(=O)o1
Brc1ccc(Cc2ccccc2)c(=O)o1
Clc1ccc(Cc2ccccc2)c(=O)o1
CCCCc1ccc(Cl)oc1=O
CC(C)C(NC(=O)Cn1c(\C=C\c2ccccc2)ccc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F
CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccccc2)c1=O)-c1ccc(Cl)cc1)C(=O)C(F)(F)F
CC(C)C(NC(=O)Cn1c(CCc2ccccc2)ccc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F
CC(C)C(NC(=O)Cn1cccc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F
CC(C)C(NC(=O)Cn1cc(Cc2ccccc2)cc(NC(=O)OCc2ccccc2)c1=O)C(=O)C(F)(F)F
CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccccc2)c1=O)-c1ccccc1)C(=O)C(F)(F)F
CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccccc2)c1=O)-c1ccc(C)cc1)C(=O)C(F)(F)F
COc1ccc(cc1)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)C(F)(F)F
COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)C(F)(F)F
CC(C)(C)OC(=O)NC(CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cc(C(O)=O)c2ccccc2c1
CC(C)(C)OC(=O)NC(CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(N)=O
CCCCNS(=O)(=O)c1cccc(NC(=O)C(F)(F)C(=O)C(Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)C(CCC(O)=O)NC(=O)OC(C)(C)C)c1
CC(C)C(NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(O)=O
CC(C)(C)OC(=O)NC(CC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(O)=O
CC(C)(C)OC(=O)NC(CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(CC(O)=O)c1
CC(C)(C)OC(=O)NC(CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cc(cs1)C(O)=O
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC
CC(C)(C)OC(=O)NC(CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(O)=O
CC(C)(C)OC(=O)NC(CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)S(N)(=O)=O
Cc1cc(OCCCNC(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1
Cc1cc(OCC2CCN(CC2)C(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1
Cc1cc(OCC2CCCN(C2)C(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1
CN(CCOc1cc(C)cc(OS(=O)(=O)c2ccccc2Cl)c1)c1ccncc1
Cc1cc(OCCCCCNC(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1
Cc1cc(OCCCCNC(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1
O=C1O[C@H]2CCC[C@@H]2[C@@H]1Cc1ccccc1
O=C1O[C@H]2CCC[C@@H]2[C@H]1Cc1ccccc1
NC(=N)c1cccc(C[C@@H]2[C@H]3CCC[C@@H]3OC2=O)c1
[H][C@@]12[#6]-[#6][C@]3([#6])[C@@]4([H])[#6]-[#6][C@@]5([#6])[C@]6([H])[#6@@H](-[#6]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6](=O)-[#8][C@@]6([H])[#6][C@]5([#6])[#6]4=[#6]-[#6][C@@]3([H])[C@]1([#6])[#6](=O)-[#8]2 |r,c:33|
[#6]\[#6](-[#6])=[#6]\[#6](=O)-[#6]-[#6@H]-1-[#6@H]-2-[#6]-[#6]-[#6]-[#6@@H]-2-[#8]-[#6]-1=O
C=CC[C@@H]1[C@H]2CCC[C@@H]2OC1=O
O=C1O[C@H]2CCC[C@@H]2[C@@H]1Sc1ccccc1
NC(=N)c1ccc(C[C@@H]2[C@H]3CCC[C@@H]3OC2=O)cc1
O=C1O[C@H]2CCC[C@@H]2[C@H]1Sc1ccccc1
NC(=N)CCCC[C@@H]1[C@H]2CCC[C@@H]2OC1=O
C=CC[C@H]1[C@H]2CCC[C@@H]2OC1=O
Cc1cc(OCCC=NNC(N)=N)cc(OS(=O)(=O)c2ccccc2OC(F)(F)F)c1 |w:8.8|
COc1cc(CCCC=NNC(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1 |w:9.9|
Cc1cc(OCCCCCC(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1
Cc1cc(OC[C@H]2CC[C@@H](CC2)C(N)=N)cc(OS(=O)(=O)c2ccccc2Cl)c1 |wU:9.12,wD:6.5,(5.39,4.62,;5.39,3.08,;6.72,2.31,;6.72,.77,;8.05,,;9.41,.77,;10.74,,;10.72,-1.55,;12.05,-2.32,;13.38,-1.57,;13.41,-.02,;12.07,.76,;14.71,-2.34,;16.07,-1.57,;14.71,-3.88,;5.39,.02,;4.08,.79,;2.72,,;1.39,.77,;2.16,2.1,;.05,1.54,;.05,-.01,;.05,-1.57,;-1.28,-2.34,;-2.61,-1.57,;-2.61,-.01,;-1.28,.76,;-1.3,2.31,;4.08,2.31,)|
CC1(C)CNc2c(C1)cc(CCC(=O)N1CCN(CC(=O)N3CCOCC3)CC1)cc2S(=O)(=O)N[C@@H](Cc1nc2ccccc2s1)C(=O)N1CCC(CCF)CC1
COc1ccccc1C(=O)N[C@@]1(OC)[C@H]2OCC(CSc3nncn3CC(O)=O)=C(N2C1=O)C(=O)OCc1cccc(C)c1 |c:30|
CCOC(=O)Cn1c(O)c(sc1=S)C(=C)c1cccc(NS(=O)(=O)c2ccc(cc2)-c2ccc(cc2)S(=O)(=O)NCCNC(=O)OC(C)(C)C)c1
OC(=O)Cn1c([O-])c([CH+]c2cc(ccc2F)[N+]([O-])=O)sc1=S
[O-]c1c([CH+]c2cc3OCOc3cc2[N+]([O-])=O)sc(=S)n1CC=C
COC(=O)Cn1c([O-])c([CH+]c2cc3OCOc3cc2[N+]([O-])=O)sc1=S
OC(=O)Cn1c(O)c(sc1=S)C(=C)c1ccc(cc1)-c1ccccc1
CCOC(=O)Cn1c(O)c(sc1=S)C(=C)c1cccc(OC(=O)N[C@@H](CC(C)C)C(=O)N(CCN(Cc2ccc(cc2)C(=O)OC)Cc2ccc(cc2)C(=O)OC)Cc2ccc(Cl)cc2)c1
CCCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)CCC(O)=O)C(C)(C)C)C(=O)C(N)=O
CSc1sc(cc1-c1nc(cs1)-c1cccc(O)c1)C(N)=N
COc1cccc(c1)-c1csc(n1)-c1cc(sc1SC)C(N)=N
Cc1ccc(cc1)N1C(=O)N(C1=O)c1ccc(C)cc1
CCN1C(=O)N(CC)C1=O
O=C1N(Cc2ccccc2)C(=O)N1Cc1ccccc1
CCCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCc1ccccc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(cc1)C(F)(F)F)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(C)cc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(cc1)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(cc1)C1CCCCC1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(Oc2ccccc2)cc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccccc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CCCCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(F)cc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)CCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)CC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(cc1)-c1ccccc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(cc1)C(C)(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
CC(C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCc1ccc(Cl)cc1)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1
COc1ccc(CC[C@H](NC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)B2O[C@@H]3C[C@@H]4C[C@@H](C4(C)C)[C@]3(C)O2)cc1
CC(=O)c1ccc(NS(=O)(=O)c2sc3ccc(F)cc3c2C)c(c1)S(C)(=O)=O
COC(=O)c1ccc(NS(=O)(=O)c2sc3ccc(Cl)cc3c2C)c(c1)S(C)(=O)=O
Cc1c2cc(ccc2sc1S(=O)(=O)Nc3ccc(cc3S(=O)(=O)C)C(=O)OC)F
Ic1ccc2N(Cc3cc4ccccc4s3)C(=O)C(=O)c2c1
Brc1cccc2C(=O)C(=O)N(Cc3cc4ccccc4s3)c12
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C=O
CC1(C)CNc2c(C1)cccc2S(=O)(=O)N[C@@H](CSCCCN)C(=O)N1CCC(CCO)CC1 |r|
CC1CNc2c(C1)cccc2S(=O)(=O)N[C@@H](Cc1nc2ccccc2s1)C(=O)N1CCC(CCO)CC1
CC1(C)CNc2c(C1)cccc2S(=O)(=O)N[C@@H](CSCCCN)C(=O)N1CCC(CCF)CC1 |r|
CCC1CCN(CC1)C(=O)C(Cc1nc2ccccc2s1)NS(=O)(=O)c1cccc2CC(C)(C)CNc12
CC1(C)CNc2c(C1)cccc2S(=O)(=O)NC(Cc1nc2ccccc2s1)C(=O)N1CCC(CCF)CC1
CC(C)OC(=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](CC(=O)N1CCOCC1)Cc1cccc2ccccc12
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r|
Nc1cnc(-c2ccc(F)cc2)n(CC(=O)NC(Cc2ccccc2)C(=O)c2nc3cc(ccc3o2)-c2ccccc2)c1=O
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(O)=O
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCC(=O)N1CCCCCC1
CCOC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCC(O)=O
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCC(N)=O
CCN(CC)C(=O)CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
COc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCc1ccccc1
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1cccc(c1)C(O)=O
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)Nc1ccc(cc1)C(O)=O
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCc1cccnc1
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(N)=O
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCCC(O)=O
CCN(CC)C(=O)CCNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Nc1cnc(-c2ccncc2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O
Nc1cnc(-c2ccccc2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O
CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(O)=O
CCCCCNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Nc1cnc(-c2ccc(F)cc2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O
CN(C)C(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)F
COC(=O)CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Nc1cnc(-c2cccnc2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCc1ccccc1
Nc1cnc(-c2cccc(F)c2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O
CCNC(=O)CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(ncc(N)c1=O)-c1cccc(C)c1
Cc1cccc(c1)-c1ncc(N)c(=O)n1CC(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCC(=O)N1CCCCC1
Nc1cnc(-c2cccc(Cl)c2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O
OC(=O)c1cc(nc(c1)-c1ccc(Sc2ccc(Cl)cc2)cc1)-c1ccc(Cl)cc1
OC(=O)c1cc(nc(c1)-c1ccc(cc1)-c1ccccc1)-c1ccc(Cl)cc1
CCCCc1ccc(cc1)-c1cc(cc(n1)-c1ccc(Cl)cc1)C(O)=O
Oc1ccc(cc1)N=Nc1cccc(Br)c1 |w:7.7|
[O-][N+](=O)c1ccc(NN2C(=O)C3C(C2=O)[C@@]2(Cl)C(Cl)=C(Cl)[C@]3(Cl)C2(Cl)Cl)c(c1)[N+]([O-])=O |t:19,TLB:9:11:23:19.17,20:19:23:11.12,THB:13:12:23:19.17,18:17:23:11.12|
COC1CC[C@@]2(C)[C@@H](CCC3C4CC[C@H](NCCN)[C@@]4(C)C[C@H](O)C23)C1
Oc1ccc2ccccc2c1N=Nc1c(O)cc(c2ccccc12)S(O)(=O)=O |w:11.12|
CN(C)c1ccc(\C=C2\C(=O)Nc3ccccc23)cc1
Oc1oc(\C=N\c2ccc(Oc3ccccc3)cc2)c2ccccc12
COc1ccc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2c1)NCCCc1ccccc1
Oc1ccc(cc1O)-c1csc(Nc2ccc(F)cc2F)n1
O=C1Nc2ccccc2\C1=C\c1ccc(s1)-c1cccs1
[O-]c1c(I)cc2c(Oc3c(I)c([O-])c(I)cc3C22OC(=O)c3c2c(Cl)c(Cl)c(Cl)c3Cl)c1I
Cc1ccc(cc1)-c1cc(cc(n1)-c1ccc2ccccc2c1)C(O)=O
[#8-]-[#6](=O)-c1ccccc1\[#6](=[#6]-1\[#6]=[#6](I)-[#6](=O)-[#6](I)=[#6]-1)-c1cc(I)c(-[#8-])c(I)c1 |c:18,t:12|
CC(C)c1ccc(\C=C2\C(=O)Nc3ccccc23)cc1
Oc1c2c(cc(Cl)cc2=C)s\c1=c1/sc2cc(Cl)cc(=C)c2c1O
Oc1cc(c2ccccc2c1N=Nc1ccc2ccccc2c1O)S(O)(=O)=O |w:12.14|
Clc1ccc2sc(Sc3nnc(NC(=O)c4cccs4)s3)nc2c1
Oc1c2CCCCc2ccc1\C=C1\C(=O)Nc2ccccc12
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O
[#6]-1-[#6]-[#7]-[#6]-[#6](-[#6]-1)\[#6]=[#6]-1\c2ccccc2-c2ccccc-12
OC(=O)COc1ccc(cc1)N=Nc1ccc2cc(Br)ccc2c1O |w:11.11|
Oc1c2c(cc(Cl)cc2=C)s\c1=c1\sc2cc(Cl)cc(=C)c2c1O
Oc1c(N=Nc2ccc(Br)cc2S([O-])(=O)=O)c(cc2cc(c(N=Nc3ccc(Br)cc3S([O-])(=O)=O)c(O)c12)S([O-])(=O)=O)S([O-])(=O)=O |w:4.4,23.24|
CC(C)(C)c1cc(\C=C2\C(=O)Nc3ncccc23)cc(c1O)C(C)(C)C
Oc1ccccc1\C=N\NC(=O)C(=O)N\N=C\c1ccccc1O
CC(C)CC(Oc1ccc(OC(=O)c2cc(nc(c2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1)C(O)=O
Nc1c(cc(c2ccccc12)S([O-])(=O)=O)\N=N\c1ccc(cc1)-c1ccc(cc1)\N=N\c1cc(c2ccccc2c1N)S([O-])(=O)=O
COc1ccc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2c1)NCCNc1ccc(cn1)[N+]([O-])=O
Clc1ccc2sc(Sc3nnc(NC(=O)c4ccc(Cl)c(Cl)c4)s3)nc2c1
OC(=O)C1(C(O)=O)C23c4c5-c6c7c8c9c%10c%11c%12c%13c%14-c(c5C75C(C(O)=O)(C(O)=O)C%10%135)c5c4-c4c2c2c7c%10c%13c(c6C13%10)c8c1c9c3c%11c6c8c%12c9c%14C55C(C(O)=O)(C(O)=O)C55c4c4c%10c5c9c8c5c%10c8c(c24)c7c2c%13c1c1c2c8c5c6c31
Oc1ccc(cc1)N=Nc1ccc(Br)cc1 |w:8.9|
CCCCCCC(Oc1ccc(cc1)S(=O)(=O)c1ccc(OCc2ccccc2)cc1)C(O)=O
Cc1c(CC(=O)c2ccccc2)oc(=O)c(C)c1O
CCCCCC(=O)C(CCCC)c1oc(=O)c(CCCC)c(OC(C)=O)c1CCCC
CCCCc1c(CC(C)O)oc(=O)c(CCCC)c1OC(C)=O
CC1=CC(=CC(=O)O1)O
CCCCc1c(O)c(CCCC)c(=O)oc1\C(=C\C)c1ccccc1
Cc1c(O)cc(CC(=O)c2ccccc2)oc1=O
CCCCCCC(CCCC)(C=O)c1oc(=O)c(CCCC)c(O)c1CCCC
Oc1cc(CC(=O)c2ccccc2)oc(=O)c1
CCCCc1c(O)c(CCCC)c(=O)oc1CC(C)=O
CCCCc1c(C)oc(=O)c(CCCC)c1O
Cc1oc(=O)c(C)c(O)c1C
Cc1cc(O)c(C)c(=O)o1
CCCCC(C(=O)c1ccccc1)c1oc(=O)c(CCCC)c(O)c1CCCC
CCCCc1c(oc(=O)c(CCCC)c1OC(C)=O)C1OC1C
CCCCCC(=O)C(CCCC)c1oc(=O)c(CCCC)c(O)c1CCCC
CCCCc1c(CC(C)=O)oc(=O)c(CCCC)c1OC(C)=O