354 SMILES Strings for Tumor necrosis factor receptor superfamily member 10B

Compound Name
SMILES String
Cn1c2ccccc2s\c1=N/C(=O)c1cnccn1
O=C(Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1)c1cc2ccccc2o1
COc1ccc(NC(=O)c2ccc(OC)cc2)cc1
Cc1cc(nc(N=NCc2ccccc2)n1)-c1ccccc1 |w:6.5|
COC(=O)[C@@]12C[C@@H](CC(=O)NCc3ccc(OC)c(OC)c3)C(=O)N(Cc3cccc4ccccc34)C1=CCCCC2 |c:40|
Cc1ccc(cc1)-c1nnc(o1)-c1cccc2ccccc12
CCOC(=O)c1cnc(nc1N(C)C)-n1nc(C)cc1C
C\N=c1/scc(C)n1\N=C\c1ccc2OCOc2c1
Clc1ccc(cc1Cl)C1OC(CCc2ccccc2)Cc2[nH]c(=S)[nH]c(=O)c12
Cc1ccc(cc1)-n1cc(cn1)C(=O)c1ccccc1O
CCCn1c(C)cc(C(=O)COC(=O)c2ccc[nH]c2=O)c1C
CN1\C(Sc2ccccc12)=C\C(=O)c1cccs1
COCCn1c(C)cc(C(=O)COC(=O)c2ccc(Cl)c(c2)S(N)(=O)=O)c1C
CC(C)C(=O)Nc1ccc2nn(nc2c1)-c1ccccc1
Cc1c(sc(=O)n1Cc1ccc(C=C)cc1)C(=O)NCc1cccc(c1)C(F)(F)F
O=C(CCS(=O)(=O)c1ccccc1)Nc1ccc(cc1)-c1nc2ccccc2s1
C(=C/c1nc2ccccc2[nH]1)\c1ccco1
c1ccc(cc1)-c1cnc(nn1)-c1ccccn1
COc1ccccc1C=CC=Nn1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccccc1 |w:11.12,8.8|
COc1ccc(cc1[N+]([O-])=O)-c1cn2ccccc2n1
C(N=Nc1ccc2ccccc2n1)c1ccc2OCOc2c1 |w:2.2|
COc1ccc(\C=N/n2nnc3ccccc23)cc1
CCOC(=O)c1sc(NC(=O)c2ccccc2)cc1C
Brc1ccc(cc1)-c1ccc(CN=Nc2nc3ccccc3[nH]2)o1 |w:13.14|
O=C1CCCc2nc(ncc12)N1CCc2ccccc12
CC(=O)c1ccc(NC(=O)Nc2cccnc2)cc1
COn1c(SCc2cccc(Cl)c2)nc2ccccc2c1=O
Fc1cccc(c1)C(=O)N\N=C\c1ccc(o1)-c1cccc(c1)C(F)(F)F
Cc1nnc2c3ccccc3c(nn12)-c1ccc(C)c(c1)S(=O)(=O)NCc1ccccc1
CC(C)c1ccc(CC(=O)N2CCC2(C)C(=O)Nc2ccc(cc2)C#C)cc1
Cc1ccc(cc1)-n1c(n[nH]c1=S)C1CC1c1ccc(Cl)cc1
CCc1ccc(CN=Nc2ncnc3nc[nH]c23)cc1 |w:8.8|
CCOc1ccc(NC(=O)c2ccco2)cc1
Oc1ccc(cc1)-c1nc2ccccc2s1
CCOC(=O)c1sc(NC(=O)c2cccc(c2)S(=O)(=O)N2CCc3ccccc23)c(C#N)c1C
CCOC(=O)c1cccc(c1)-[n+]1c(cc(cc1-c1ccccc1)-c1ccccc1)-c1ccccc1
CC1CC(C)CN(C1)S(=O)(=O)c1ccc(cc1)C(=O)NNc1nc2c(C)cccc2s1
COC(=O)c1nc(NC(=S)NC(=O)c2cccs2)sc1C
CN(NC(=O)c1cccc(Cl)c1)c1nc(nnc1C(F)(F)F)-c1ccccc1
COC(=O)c1sc(NC(=O)c2cc(nc3ccccc23)-c2ccccc2)c(C#N)c1C
COc1ccc(cc1)-c1nnc(SCC(=O)c2[nH]c(C)c(C(C)=O)c2C)o1
COc1ccc2o\c(=N/c3ccccc3)c(cc2c1)-c1nc2ccccc2[nH]1
CCN(CC)c1ccc(NC(=O)c2ccco2)cc1
CCOC(=O)c1sc(NC(=O)c2cc(nc3ccccc23)-c2ccccc2C)c(C#N)c1C
Cc1ccc(cc1)N=CC(C(=O)c1cccs1)C(=O)C(F)(F)F |w:7.7|
CN(C1CCCCC1)C(=O)COC(=O)c1cnc(Cl)c(Cl)c1
O=C1CCCCC1Sc1nnc(o1)-c1ccc2OCOc2c1
Cc1ccc(-c2nc3cc(N)ccc3o2)c(C)c1
C1Oc2cc3nn-4c(OCc5ccccc-45)c3cc2O1
Cc1ccc2oc(nc2c1)-c1cccc(N)c1
COc1cc(NC(=O)c2[nH]cnc2C(N)=O)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1cc(C)n(n1)-c1ccc(cc1)C(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCOCC1
OC[C@H](Cc1ccccc1)NC(=O)C[C@H]1C\C=C/C[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(=O)O[C@H](CNC1=O)c1ccccc1 |c:17|
COc1ccc(cc1OC)-c1nc(no1)-c1ccc(NC(=O)c2ccncc2)cc1
O=c1n2c(nc3ccccc23)s\c1=C/c1ccccn1
Cc1nc2sc(cc2c(=O)n1N)-c1ccccc1
COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)N\N=C\c2c(F)c(F)c(F)c(F)c2F)cc1
COc1ccc2sc(c(C#Cc3cncn3C)c2c1)-c1ccc(cc1)S(C)(=O)=O
O=C(Nc1ccc(cc1)-c1nc2ccccc2o1)C1CCCO1
Cc1ccc(CNc2nc3ccccc3n2C)cc1
COc1ccc(cc1)C1=NNC(S1)c1ccc(C)cc1 |t:9|
COc1ccc(OCC(=O)N\N=C\C=C\c2ccccc2)cc1
O=c1c2ccccc2nc2c3ccccc3cnn12
COn1c(SCc2ccc(Cl)cc2)nc2ccccc2c1=O
CCOC(=O)c1cn(-c2ccc(F)c(F)c2F)c2c(F)c(F)c(F)cc2c1=O
CC(C)(C)c1ccc(\C=C\C(=O)NC2=NCCS2)cc1 |t:13|
CCN(CC)c1ccc(NC(=O)Nc2ccccc2)cc1
C(=Cc1ccc2ccccc2n1)c1c[nH]c2ccccc12
COc1ccc(CN=Nc2cc(OC)ncn2)cc1 |w:8.8|
COc1ccc2nc([nH]c2c1)-c1cccc(N)c1
Cc1nc(SCCC(O)=O)c2cc(sc2n1)-c1ccccc1
CCSc1ccc(nn1)-c1ccc(C)cc1
CC(C)(C)n1cc(cn1)C(=O)c1ccc2ccccc2c1O
O=C(NCC1CCCO1)c1ccc2c3OCc4ccccc4-n3nc2c1
Cl\C(\C=N\NC(=O)c1ccccn1)=C/c1ccccc1
COc1cc(cc(OC)c1OC)C(=O)Oc1ccccc1\C=N\NC(=O)c1ccc(C)cc1
CC(=O)Nc1cccc(c1)-c1csc(Nc2ccc(C)cn2)n1
COCCNC(=O)c1cc(nc2ccccc12)-c1ccc(cc1)-c1ccccc1
CSc1ccc(\C=C\c2ccc3cccc(O)c3n2)cc1
COc1ccccc1CNc1nc(Nc2cccc(c2)C#C)c2sccc2n1
Cc1ccc2cc(NC(=O)c3ccccc3)ccc2n1
CCOC(=O)C(c1nc2ccccc2[nH]1)n1c(nc2ccccc12)-c1cccnc1
COc1ccc2oc(nc2c1)-c1ccc(NC(=O)c2ccc(N3CCOCC3)c(c2)[N+]([O-])=O)cc1
Oc1cccc(NC(=O)\C=C\c2ccccc2Cl)c1
O=C(Nc1ccc2OCOc2c1)c1ccc2OCOc2c1
Cc1ccc(cc1)N=C1Nc2ccccc2CS1 |w:7.7|
Cc1ccc(cc1)C1CC1c1n[nH]c(=S)n1-c1ccc(Cl)cc1
O=c1[nH]c(N=NCc2ccc3OCOc3c2)nc2ccccc12 |w:4.3|
Cc1cc(C(=O)COC(=O)c2cccn2C)c(C)n1Cc1ccco1
COc1ccc(cc1)-c1cc2cc3OCOc3cc2cn1
CCOc1ccc(cc1)-c1nc(no1)-c1cccnc1
Nc1ccccc1C(=O)N\N=C\c1cccc(c1)[N+]([O-])=O
CSc1cc(-c2ccc(Cl)cc2)n(Cc2ccccc2)c(=O)c1C#N
C1CN(CCO1)c1ccc(cc1)-c1nnc(o1)-c1cccs1
Nc1ccccc1C=C1Cc2ccccc2C1=O
C1Oc2cc3nc(sc3cc2O1)N1CCCCC1
Cc1ccc(cn1)C(=O)N\N=C/c1ccccc1[N+]([O-])=O
COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)Nc1ccc2OCOc2c1
FC(F)(F)c1cccc(c1)-c1nc2nc(Cl)c(Cl)nc2[nH]1
COc1cc(NC(=O)c2cncc(c2)-c2ccc(cc2)C#N)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F
Clc1ccc(C(=O)Nc2cnc3ccccn3c2=O)c(Cl)c1
Oc1ccccc1C(=O)Nc1ccc2ccccc2c1
CN(C)c1ccc(cc1)C(=O)Nc1nc2CCCCc2s1
CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1nc[nH]c1C(=O)NC(c1ccccc1)c1ccccc1)C(=O)OC(C)(C)C
Cc1nnc(SCC(=O)Nc2ccc(cc2)-c2nc3ccccc3s2)s1
CN(C)c1cccc(c1)C(=O)N\N=C\c1ccsc1
CCc1nc2-c3ccccc3CC3(CCCC3)c2c(=S)[nH]1
CN(C)c1ccc(cc1)-c1nc2ccccn2c1\N=C\c1ccc(Br)cc1
COCC(C)n1c(C)cc(C(=O)COC(=O)c2n[nH]c3ccccc23)c1C
CC(=NNC(=O)c1[nH]nc2CCCc12)c1ccco1 |w:2.2|
O=C(Nc1nc2ccccc2s1)C1=COCCO1 |t:14|
COc1cccc(NC(=O)c2ccc3OCOc3c2)c1
CCOc1cc(\C=N/NC(=O)c2ccc(NC(=O)C(C)(C)C)cc2)ccc1OC(=O)c1cccc(C)c1
O=C(Nc1cc2ccccc2oc1=O)c1ccccc1
O=C(N\N=C\c1cccnc1)c1ccc2OCOc2c1
[O-][N+](=O)c1ccc(cc1)C(=O)Nc1nc2ccccc2[nH]1
Cc1ccccc1-c1nc2sc3CCCCc3c2c(=O)n1N
CC(=O)c1sc(NC(=O)c2cc(=O)c3ccccc3o2)nc1C
O=C(NC1CCCCC1)Nc1ccc2OCCOc2c1
CCc1ccc(OCc2nc(no2)-c2ccccn2)c(Br)c1
Clc1ccc2C(=O)c3c(cccc3S(=O)(=O)c2c1)C(=O)N1CCC(Cc2ccccc2)CC1
OC(=O)C(CC(=O)c1ccccc1)Nc1ccc(F)cc1
Cc1cc2nc([nH]c2cc1C)-c1ccc(SCC(=O)Nc2nccs2)nc1
C(Sc1ccc(nn1)-c1ccco1)c1ccccc1
Fc1ccc(cc1)-c1cc2nc(cc(=O)n2[nH]1)-c1ccccc1
COc1ccc(cc1OC)C1=NNC(S1)c1ccc(C)cc1 |t:11|
CCCOc1ccc(cc1[N+]([O-])=O)-c1cn2ccccc2n1
Cc1ccsc1C(=O)Nc1ccc2OCCOc2c1
Nc1nn2cc(nc2c2ccccc12)-c1ccccc1
CC(C)C(=O)Nc1ccc(NC(=O)c2ccccn2)cn1
OCC1OC(Oc2ccc3c(c2)occ(-c2ccc4OCCOc4c2)c3=O)C(O)C(O)C1O
Cc1ccc2nc(NC(=O)c3ccc(s3)-c3nc4ccccc4s3)sc2c1
CCOc1ccc2nc(NC(=O)c3cccc(c3)-c3cc4ccccc4oc3=O)sc2c1
COc1ccc(cc1)C(=O)CC=Nc1cc(C)ccn1 |w:12.13|
CCC(C)c1ccc(O)c(NC(=S)NC(=O)c2cccs2)c1
COc1ccc(cc1)C(=O)CC=Nc1cccc(O)c1 |w:12.13|
Clc1ccc(cc1)C(=O)ONC1=NCCCCC1 |t:12|
CC(=O)c1cccc(NC(=O)CSc2ccc(nn2)-c2ccc3OCOc3c2)c1
OC(=O)c1ccc(NC(=O)C(\NC(=O)c2ccccc2Cl)=C/C=C/c2ccccc2)cc1
COC(=O)c1ccc(NC(=O)C(=O)c2cccn2C)cc1
CC(=NNC(=O)c1csc(C)c1C)c1ccco1 |w:2.2|
Clc1ccccc1-c1nnc(o1)-c1ccc2OCOc2c1
Cn1c2nc(nc(SCC(=O)Nc3ccccc3F)c2c(=O)n(C)c1=O)C1CC1
CCCC(=O)N1CCCC(C1)c1cc(no1)C(=O)Nc1ccccc1
CCOc1ccc2cc(C#N)c(SCC(=O)OC)nc2c1
CCc1ccc2nc(sc2c1)N(CCCN(C)C)C(=O)c1ccc(cc1)C(=O)c1ccccc1
CN(C1CC1)C(=O)c1ccc(NC(=O)Cc2cccc(NC(=O)C3CCCN(C3)S(=O)(=O)c3cccc(c3)[N+]([O-])=O)c2)cc1
CCOc1ccc2nc(NC(=O)c3ccc(C)o3)sc2c1
Cc1ccc(C(=O)Nc2ccc(Cl)cc2C)c(Cl)c1
Cc1ccnc(NC(=O)CCC2CCCCC2)c1
Oc1cccc(c1)-n1c(=O)c2ccc3c4c(ccc(c24)c1=O)c(=O)n(-c1cccc(O)c1)c3=O
Cc1cccc2nc(=S)n(C(=O)c3ccco3)n12
Clc1ccc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)c(Cl)c1
O=C(Nc1nc2ccccc2n1CCN1CCCCC1)C1CCCCC1
CC(C)C[C@H](NC(=O)c1nc[nH]c1C(=O)N[C@@H](CC(C)C)C(=O)OCc1ccccc1)C(=O)OCc1ccccc1
COc1ccc(cc1)-c1cn2ccsc2n1
CCCCc1nc(NCCN)c(C#N)c2CC(C)(C)SCc12
CC(C)c1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(F)cc2)s1
CCCC1(CCC)C(=O)NC(NCc2ccccc2)=NC1=O |c:19|
Oc1ccccc1-c1cc(no1)-c1ccccc1
COc1ccc2nc(Nc3nc(cs3)-c3cc4ccccc4oc3=O)sc2c1
CC1CCc2c(C1)sc(NC(=O)c1cc(C)on1)c2C#N
Cc1ccc(cc1[N+]([O-])=O)-c1nc(no1)-c1ccccn1
Brc1ccc(s1)-c1cn2ccccc2n1
Cc1cc(N=NCc2ccccc2)nc(NCc2ccccc2)n1 |w:4.3|
O=C(NC(=S)Nc1nc2CCCCc2s1)c1ccccc1
Cc1ccc2\C(=N/C3CCCCC3)c3cc4ccccc4nc3-c2c1
Cc1ccnc(NC(=O)Nc2ccc3OCOc3c2)c1
CC(=NNC(=O)COc1ccc(cc1)C(C)(C)C)c1ccc(cc1)-n1ccnc1 |w:2.2|
COn1c(SCc2ccc(C)cc2C)nc2ccccc2c1=O
CCN(CC)c1ccc(cc1)-c1sc(Nc2ccc(CC)cc2)n[n+]1-c1ccccc1
CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCCc2ccccc12)c1nc2ccc(F)cc2s1
COC(=O)Cc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C(C)=Nc1ccc(OC)cc1 |w:22.25|
O=C(Nc1sc2CCCCCc2c1C#N)c1ccccc1
CC1(C)N=C(N)N=C(N)N1c1ccc(Oc2ccc(Cl)cc2)c(Cl)c1 |t:3,6|
CCN(CC)c1ccc(\C=N\NC(=O)c2ccco2)cc1
Clc1ccc(cc1)-n1ncc2c(ncnc12)N1CCCC1
Oc1ccc(NC(=O)c2ccc3C(=O)N(Cc4ccccc4)C(=O)c3c2)cc1
COc1cccc(c1)C(=O)\C=C1/Sc2ccccc2N1C
O=C(Nc1ccc2[nH]ccc2c1)c1cccs1
COC(=O)c1ccc(C=Cc2nc3ccccc3c(=O)[nH]2)cc1 |w:9.9|
Cn1cccc1\C=C1/CCc2ccccc2C1=O
CSc1ccc(NC(=O)Nc2cc(C)ccn2)cc1
Clc1ccc(cc1)C(=O)CC=Nc1ccccc1C#N |w:11.12|
Cc1ccnc(NC(=O)c2ccc(Br)s2)c1
CC1(C)N=C(N)N=C(N)N1c1ccc(CCCCc2ccccc2)cc1 |t:3,6|
O=C(NC(=O)c1ccccc1)Nc1ccccc1
COc1ccc(cc1)C(C)N=Nc1nncc2ccccc12 |w:11.12|
C[C@H](NC(=O)c1nc[nH]c1C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)C(=O)OCc1ccccc1
CCOC(=O)c1cnc2c(cnn2c1N)-c1ccccc1
Nc1nc(cs1)-c1ccc(cc1)-c1ccccc1
[O-][N+](=O)c1cc(c(Nc2ccccn2)c(c1)[N+]([O-])=O)[N+]([O-])=O
Nc1c2CCCCCc2nc2sc3CCCCCc3c12
O=C(COc1ccc2OCOc2c1)Nc1nccs1
Nc1cc2sc(nc2cc1Cl)-c1ccc(cc1)C(O)=O
CC(OC(=O)c1cc(O)c2ccccc2c1O)C(=O)Nc1ccc(cc1)C(N)=O
N(N=Cc1ccccn1)C1=Nc2cccc3cccc1c23 |w:1.0,t:10|
ONc1ccc(N=O)c2ccccc12
Fc1ccc(cc1)C(=O)N\N=C\c1cccc(OC(=O)c2ccco2)c1
Cc1cccc(CC(=O)Nc2cc(C)c3c(n2)c2ccccc2oc3=O)c1
COc1ccc(cc1)-c1cc(C(=O)OCC(=O)Nc2ccc3OCOc3c2)c2ccccc2n1
O=C(N1CCCCC1)c1cc(on1)-c1ccc2OCOc2c1
CCOC(=O)c1sc2nc3c(SCC(O)=O)cc(cn3c(=O)c2c1C)C(=O)c1ccccc1O
Clc1cc(cnc1Cl)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1
Cc1nc2cc(NC(=O)c3ccco3)ccc2n1C
Cc1cc(no1)C(=O)Nc1sc2CCCCc2c1C#N
Nc1c(cnc2c(cnn12)-c1ccc(F)cc1)-c1cccs1
FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NNC(=O)c1ccc(Cl)c(Cl)c1
Cc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)Nc1nc(cs1)-c1ccc(F)cc1
Fc1cc(Br)ccc1NC(=O)c1ccc2OCCOc2c1
COc1cccc(c1)C(=O)Nc1ccc(cc1)C1CC1(Cl)Cl
COc1ccc(NC(=O)c2ccc3OCCOc3c2)cc1OC
COc1cc(SC#N)ccc1N=Cc1c(C)[nH]n(-c2ccc(Cl)cc2)c1=O |w:11.11|
Cc1cc(NC(=O)c2cncc(Br)c2)ccc1NC(=O)c1cc2ccccc2o1
C\C(\C=N\NC(=O)c1cccs1)=C/c1ccccc1
Cc1cc(NC(=O)C2CCCC2)nc2c3ccccc3oc(=O)c12
[#6]-[#6]-[#8]-[#6](=O)-[#6](=[#6]/[#6]=[#6]-1/[#6]=[#6]-[#7](-[#6]-[#6]=[#6])-[#6]=[#6]-1)\C#N |c:9,15|
CCOc1ccc(C=CC(=O)Nc2cccc(c2)C(C)=O)cc1 |w:7.6|
CC(C)Cc1nc2oc3c(Cl)ncnc3c2c2CCCCc12
COCCCNc1ccn2nc(cc2n1)-c1ccccc1
Cc1ccc-2c(c1)\C(=N/C1CCCCC1)c1cc3ccccc3nc-21
CN(C)CCCN(C(=O)c1ccc(cc1)C(=O)c1ccccc1)c1nc2ccc(F)cc2s1
CCOc1ccc(cc1)-c1nnc(o1)-c1ccccc1
CN(C)c1ccc(cc1)N=CCC(=O)c1ccco1 |w:9.9|
Cc1ccc(cc1)-n1nnc(n1)-c1cccnc1Cl
Cc1nc2cc(nn2c(N)c1-c1ccccc1)-c1ccccc1
CCOC(=O)c1ccc(cc1)N=CCC(=O)c1ccco1 |w:11.11|
Cc1cc2ncc(cn2n1)-c1ncc(cc1Cl)C(F)(F)F
O=C(CSC(=S)N1CCCCC1)c1ccccc1
Cc1c(csc1-c1ccccc1)C(=O)Nc1cccc(c1)[N+]([O-])=O
CCC(=O)c1ccc(C=Cc2nc3ccccc3n2C)o1 |w:9.9|
CCOc1ccc(cc1)-c1cc(C(=O)N2CCC(C)CC2)c2ccccc2n1
CC(C)(C)OC(=O)NCCCCCc1cn(nn1)[C@@H](CO)C(=O)NCCCCCCCCCCC(=O)N1CCN(CC1)C(=O)OC(C)(C)C
[H][C@]12CN(C)C(=O)[C@](Cc3ccccc3)(N1C(=O)c1ccc(cc1)C(C)(C)C)[C@@]1([H])C(=O)N(Cc3ccccc3)C(=O)[C@@]21[H] |TLB:30:28:15:3.2.5,THB:6:5:15:28.42,40:42:15:3.2.5|
CCCCc1ccc(NC(=O)c2cnccn2)cc1
Cc1c([n+]2ccccc2n1CCc1ccccc1)P(=S)(c1ccccc1)c1ccccc1
Cc1ccc(cc1)-c1cn2cc(ccc2n1)[N+]([O-])=O
NNc1nc(nc2sc3CCCCc3c12)-c1ccccc1
C1CN(CCO1)c1nc(cs1)-c1cc2ccccc2o1
NNC(=O)C1CCCn2c1nc1sc3CCCCc3c1c2=O
CC(N=Nc1nc2ccccc2[nH]1)c1cc2ccccc2o1 |w:3.3|
CCOC(=O)c1sc(NC(=O)Nc2ccc(F)cc2)nc1C
Clc1nc(Cl)c2ncn(-c3ccccc3)c2n1
CCN(CC)c1ccc(\C=N\NC(=O)c2ccccn2)cc1
Cc1ccc(cc1)-c1nnc(Nc2ccccc2)o1
Cc1ccc(C(=O)NC2CCCCCCC2)c(Cl)c1
Cc1ccc(\C=N\NC(=O)c2nn(C)cc2Cl)cc1
O=C(CC=Nc1ccccn1)c1ccccc1 |w:4.4|
CC(C)(C)OC(=O)NCc1ccc(NC(=O)c2nc[nH]c2C(=O)N[C@@H](Cc2ccccc2)C(=O)OCc2ccccc2)cc1
COCCNc1c(nc2ccccn12)-c1cc2ccc(C)c(C)c2[nH]c1=O
O=C(Nc1ccc2OCCOc2c1)c1ccccc1
Cc1cc(nc(Nc2nc3c(C)cccc3c(=O)[nH]2)n1)-c1ccccc1
Cc1csc(NC(=S)NC(=O)c2ccccc2)n1
Cc1ccc(cc1)C(=O)COC(=O)c1ccc2C(=O)N(C(=O)c2c1)c1cccc2ncccc12
COc1ccc(cc1)-c1cc(no1)C(=O)N1CCOCC1
CCCCCc1cc(=O)oc2c(C(CCN(CC)CC)c3cc(OC)c(OC)c(OC)c3)c(OC)cc(OC)c12
O=C(N\N=C\c1cn(nc1-c1cc2ccccc2o1)-c1ccccc1)c1cccnc1
Clc1cc(CN2CCOCC2)c(OC(=O)c2cccs2)c2ncccc12
C\C(\C=N\NC(=O)c1cccs1)=C\c1ccccc1
CC(C)(C)OC(=O)N(Cc1ccccc1)CC1(CC(=O)C#C)CCCCC1
N(c1nnc(s1)-c1cccnc1)c1ccccc1
CCOC(=O)c1sc2nc(ccc2c1N)-c1cccnc1
O=C1N(\N=C\c2ccccc2)C(Nc2ccccc12)c1ccccc1
COc1cccc(c1)N=CCC(=O)c1ccc(Cl)cc1 |w:8.8|
COc1ccc(cc1)-c1nn(cc1\C=N\NC(=O)c1ccc(Br)o1)-c1ccccc1
CC(C)CCn1cnc2c([nH]c3cccc(Cl)c23)c1=O
COc1ccc(cc1)C(=O)Nc1cccc(OC)c1
OC(=O)c1ccccc1NC(=O)Nc1ccc(Cl)cc1
CCCCCCc1cc2cc(c(=O)oc2cc1O)S(=O)(=O)c1ccc(F)c(Cl)c1
Cc1ccn2cc(nc2c1)C(=O)Nc1ccc2OCCOc2c1
[H][C@]12N(Cc3ccccc3)C(=O)c3cc(OC)ccc3[C@]1(Cc1cc3ccccc3cc21)C(=O)OCC
C[C+](Cn1nnc(n1)[N+]([O-])=O)[N-]NC(=O)c1ccc(O)cc1
Clc1cccc(c1)-c1cc(c2CC(=O)Nc3ccccc3-c2n1)-c1ccccc1
O=C(N\N=C\c1ccc2cccnc2c1)c1ccco1
Oc1ccc(O)n1-c1ccc(cc1)-c1nc2ccccc2s1
COc1cccc(NC(=O)Nc2nccc(C)n2)c1
COC(=O)c1ccc(cc1)-c1nc2cc(N)ccc2o1
Cc1nc(Cl)c2oc3ccccc3c2n1
Cc1ccc(cc1)-c1nn(CC(=O)NCc2cc(ccc2C)-c2nn(C)c(=O)c3ccccc23)c(=O)c2ccccc12
Cc1ccc(NC(=O)c2cc3ccccc3o2)nc1
CCc1ccc(cc1)-n1nc2cc(C)c(N)cc2n1
COc1ccc(cc1)-c1cc(C(=O)N\N=C\c2cccnc2)c2ccccc2n1
Fc1ccc(CN=Nc2nc(nc3ccccc23)-c2cccnc2)cc1 |w:7.7|
NC(=O)c1c(NC(=O)c2cc3ccccc3o2)sc2CCCc12
CN(C)c1ccc2nc3cc(C)c(N)cc3nc2c1
CC(N=Nc1nc2ccccc2s1)c1cccs1 |w:3.3|
Brc1cc(coc1=O)C(=O)NCCC1=CCCCC1 |t:14|
CCOC(=O)c1ccc(cc1)\N=c1/sc(cc(=O)n1-c1ccc(cc1)C(=O)OCC)C(=O)OC
Cc1nn(-c2ccccc2)c2nc(N)c(C#N)c(-c3ccc(F)cc3)c12
Cc1cc(N2CCOCC2)n2ncc(-c3ccccc3)c2n1
O=C(CC=Nc1ccccc1)c1ccccc1 |w:4.4|
Fc1ccc(cc1)-c1cnn2c(ccnc12)-c1ccncc1
[#6]-1-[#6]-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#7]/[#7]-c1nc2ccccc2s1
Oc1ccc(cc1)C(=O)N\N=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1
CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OCc1ccccc1
Cc1onc(c1C(=O)ONC(=O)c1ccccc1)-c1c(Cl)cccc1Cl |(7.42,2.64,;6.52,1.39,;4.98,1.39,;4.5,-.07,;5.75,-.98,;6.99,-.07,;8.5,.25,;9.53,-.9,;8.98,1.71,;10.48,2.03,;10.96,3.49,;9.93,4.64,;12.46,3.82,;12.94,5.28,;14.45,5.6,;15.48,4.46,;15,2.99,;13.49,2.67,;5.75,-2.52,;7.08,-3.29,;8.41,-2.52,;7.08,-4.83,;5.75,-5.6,;4.41,-4.83,;4.41,-3.29,;3.08,-2.52,)|
CC(C)CCn1c2ccccc2c(O)c(C(=O)Nc2ccccc2S(N)(=O)=O)c1=O
O=C(NC1=NC2CCCCC2N1)c1ccccc1 |t:3|
COc1ccc2nc(Nc3ccccc3)sc2c1
Fc1ccccc1NC(=O)CSc1nnc(o1)-c1ccccc1
COc1ccc2nc(sc2c1)-n1c(O)c[nH]c1=S
O=C(NC1=NCCS1)c1cc2ccccc2o1 |t:3|
CN(C)CCCN(C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1)c1nc2ccc(F)cc2s1
COc1ccc(cc1)-c1cc2ccccc2cn1
N#Cc1c2CCCCCc2sc1\N=C\c1cccs1
Fc1ccccc1NC(=O)COc1ccc(Cl)cc1Cl
CSc1nc(N)n2nc(cc2n1)-c1ccc(Cl)cc1
COC(=O)c1ccc(\C=C(/C#N)c2ccccn2)cc1
Oc1ccc(C(=O)Cc2ccc3ccccc3n2)c(O)c1
COc1ccccc1C=NNC(=O)NN=Cc1ccccc1OC |w:14.14,9.10|
COCCn1c(C)cc(C(=O)CSc2nnc(C)s2)c1C
CCN(CC)S(=O)(=O)c1cccc(NC(=O)Nc2cccc(c2)C(F)(F)F)c1
Cc1cc(C(=O)COC(=O)c2cccnc2Cl)c(C)n1C
Cc1cc(NCCCn2ccnc2)n2ncc(-c3ccc(Cl)cc3)c2n1
CC12CCC3C(CCC4CC(O)CCC34C)C1(O)CC(O)C2C1=CC(=O)OC1 |t:26|
[H][C@]12N(Cc3ccccc3)C(=O)c3ccccc3[C@]1(Cc1cc3ccccc3cc21)C(=O)OCC
CCOc1ccc(NC(=O)Nc2cccnc2)cc1
CC1(Cc2ccc(OC(F)(F)F)cc2)C(=O)Nc2ccc(cc12)S(=O)(=O)NC1CCCCC1
Cc1ccc(CN=Nc2ccc3ccccc3n2)o1 |w:7.7|
CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1[nH]cnc1C(=O)Nc1ccccc1F
Cc1ccc(NC(=O)CSc2nc3ccc(Nc4nc(nc(n4)N4CCOCC4)N4CCOCC4)cc3s2)cc1
CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(SCC(=O)NCC2CCCO2)s1
Clc1ccccc1C=C1CCc2ccccc2C1=O
COc1ccc(CN=Nc2nc3ccccc3c(=O)n2-c2ccccc2)cc1OC |w:8.8|
COc1ccc(cc1)-c1noc(n1)-c1ccc2OCOc2c1
CCc1ccc(NC(=O)Nc2cccs2)cc1
Cn1nnc(NC(=O)c2ccc(cc2)C(C)(C)C)n1
O=S(=O)(c1nnn2c1nc(NC1CCN(Cc3ccccc3)CC1)c1ccccc21)c1ccccc1
CCCCC1CCC(CC1)C(=O)N(CCC(C)C)c1c(N)n(CCCC)c(=O)[nH]c1=O |(3.08,6.26,;4.6,6.53,;5.59,5.35,;7.1,5.62,;8.09,4.44,;7.57,2.99,;8.56,1.81,;10.07,2.08,;10.6,3.53,;9.61,4.71,;11.06,.9,;10.54,-.55,;12.58,1.17,;12.58,2.71,;13.91,3.48,;13.91,5.02,;15.25,5.79,;12.58,5.79,;13.91,.4,;13.91,-1.14,;12.58,-1.91,;15.25,-1.91,;15.25,-3.45,;16.58,-4.22,;16.58,-5.76,;17.91,-6.53,;16.58,-1.14,;17.91,-1.91,;16.58,.4,;15.25,1.17,;15.25,2.71,)|
Cc1c(oc2ccccc12)C(=O)N1CCc2ccccc12
CCOC(=O)c1nn(cc1O)-c1ccc2N(CCc2c1)C(C)=O
CCCOc1ccc(cc1)-c1nnc(o1)-c1ccco1
CCOc1ccc(NC(=O)Nc2cccs2)cc1
CCC(=O)N1CCN(CC1)c1ccc(NC(=O)c2cc3ccccc3o2)cc1Cl
Cc1ccc(NC(=O)c2ccccc2O)cc1
[O-][N+](=O)c1ccc(F)c(C(=O)Nc2ccc3nc4CCCCCn4c(=O)c3c2)c1F
CC(=O)Nc1nc2ccccc2n1CCOc1ccccc1
Cn1c2NC(=NC(c2c(=O)n(C)c1=O)(C(F)(F)F)C(F)(F)F)c1ccc(Cl)cc1 |c:4|
Clc1ccc(cc1)C(=O)Nc1ccc2ccccc2c1
COc1cc(C=Cc2nc3ccccc3c(=O)[nH]2)ccc1OC(F)F |w:6.6|
Fc1ccc2[nH]c3c(ncn(C4CCCCC4)c3=O)c2c1
O=C(Nc1ccc2OCCOc2c1)c1ccc2nccnc2c1
Fc1cccc(\C=C\C(=O)N2CCc3ccccc23)c1
CN=c1scc(-c2ccccc2F)n1N=C(C)c1cccnc1 |w:14.15,1.0|
COC(=O)CSc1nc2cc(C)ccc2cc1C#N
Nc1nn2cc(nc2c2ccccc12)-c1ccc(Br)cc1
COc1cc(\C=N\NC(=O)COc2ccc(C)cc2)ccc1OC(=O)c1cccs1
Clc1cc(CN2CCOCC2)c(OC(=O)c2ccccc2Br)c2ncccc12
CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)Nc1ccc(cc1)-c1nc2ccc(C)cc2s1
Fc1ccc(cc1)C(=O)Nc1ccc2CCCc2c1
Cc1nc2cc(NC(=O)Nc3cccc(c3)[N+]([O-])=O)ccc2n1C
Cc1cccc(c1)-n1ncc2c(NC3CCCCC3)ncnc12
CCCCCCCn1c2CCCc2c(=N)c2ccccc12
O=C(CCN1C(=O)NC2(CCCC2)C1=O)Nc1ccc(cc1)-c1nc2ccccc2s1