108 SMILES Strings for Lysine-specific demethylase 4B

Compound Name
SMILES String
CC(C)(C)c1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CC(C)CN1CCC(CC1)c1cnn(c1)-c1nccc2c1nc[nH]c2=O
CC(C)COc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CC(C)N1CCC(CC1)c1cnn(c1)-c1nccc2c1nc[nH]c2=O
CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)[C@@H](C)O)[C@@H](C)O)C(N)=O |r|
CC(C)c1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CC1(CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1)c1cccc(Cl)c1
CCN(CC)CCCCNCc1cc(C=O)ccn1
CCN(CCN(C)C)C(=O)CNCc1cc(CNC(=O)C(F)(F)F)ccn1
CCN(CCN(C)C)C(=O)CNCc1cc(ccn1)C(O)=O
CCN1CCC(CC1)c1cnn(c1)-c1nccc2c1nc[nH]c2=O
CCS(=O)(=O)c1ccc(cc1)C(=O)Nc1nc(cs1)-c1ccccn1
CCS(=O)(=O)c1cccc(c1)C(=O)Nc1nc(cs1)-c1ccccn1
CN(C)CCCCCCNC(=O)c1cccc(c1)-c1cc(O)c2ncccc2c1
CN(C)CCc1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CN(C)CCc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CN(C)CCc1cnn(c1)-c1nccc2c1nc[nH]c2=O
CN(C)C[C@H]1C2CCC(C2)([C@H]1O)c1ccccc1 |r|
CN(C)Cc1nccc2c1nc[nH]c2=O
CN(CCCc1cnn(c1)-c1nccc2c1nc[nH]c2=O)Cc1ccc(cc1)C#N
CN(CCc1cnn(c1)-c1nccc2c1nc[nH]c2=O)Cc1ccc(Cl)c(Cl)c1
CN(CCc1cnn(c1)-c1nccc2c1nc[nH]c2=O)Cc1ccc(F)cc1
CN(CCc1cnn(c1)-c1nccc2c1nc[nH]c2=O)Cc1ccc(cc1)C#N
CN(CCc1cnn(c1)-c1nccc2c1nc[nH]c2=O)Cc1ccc(cc1)S(C)(=O)=O
CN(c1ccccc1)c1ccc2[C@H](CNc3cnccc3C(O)=O)CCCc2c1 |r|
CN1CCC(CC1)c1cnn(c1)-c1nccc2c1nc[nH]c2=O
CN1CCN(Cc2nccc3c2nc[nH]c3=O)CC1
COC(=O)Cc1cc(O)n(n1)-c1nc2ccccc2[nH]1
CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,23,t:15,21,34|
CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,25,t:17,23,36|
CO[C@H]1C[C@H](C)CC2=C(OC)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,21,t:13,19,32|
COc1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
COc1cccc(CC2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)c1
COc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CS(=O)(=O)c1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CS(=O)(=O)c1cccc(c1)C(=O)Nc1nc(cs1)-c1ccccn1
Cc1cc(C2CCCCC2)n(O)c(=O)c1
Cc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
Cc1ccc(C)c2c1CCC21CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Cc1nc(cs1)-c1cc(ccn1)C(O)=O
Clc1cc(Cl)cc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Clc1ccc(CC2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)cc1
Clc1ccc(CC2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)cc1Cl
Clc1ccc(N\N=C(/c2ccccc2)c2ccccn2)nc1
Clc1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Clc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Clc1ccccc1C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Cn1cc(CN2CCC(CC2)c2cnn(c2)-c2nccc3c2nc[nH]c3=O)cn1
Cn1ccc(n1)-c1nccc2c1nc[nH]c2=O
FC(F)(F)c1cc(CCN2CCOCC2)cc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
FC(F)(F)c1cc(CN2CCCC2)cc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
FC(F)(F)c1ccc(CC2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)cc1
FC(F)(F)c1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Fc1cc(F)cc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Fc1ccc(C2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)c(F)c1
Fc1ccc(CC2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)cc1
Fc1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Fc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
NC(=O)c1ccnc(c1)-c1csc(N)n1
Nc1nc(cs1)-c1cc(ccn1)C(O)=O
Nc1nc(cs1)-c1nccc2c1nc[nH]c2=O
O=C(Nc1nc(cs1)-c1ccccn1)c1ccccc1
O=C1CCCN1c1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
O=c1[nH]cnc2c(CN3CCCCC3)nccc12
O=c1[nH]cnc2c(CN3CCN(CC3)c3ccccc3)nccc12
O=c1[nH]cnc2c(CN3CCN(CC3)c3ccccn3)nccc12
O=c1[nH]cnc2c(CNCc3ccccc3)nccc12
O=c1[nH]cnc2c(CNCc3ccco3)nccc12
O=c1[nH]cnc2c(nccc12)-c1cc[nH]n1
O=c1[nH]cnc2c(nccc12)-c1cscn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccc(CCN3CCOCC3)cc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccc(cc2)-c2ccccn2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccc(cc2)-c2cccnc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccc(cc2)-c2ccncc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccc(cc2)-c2cncnc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccc(cc2)C#N)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(CCN3CCOCC3)c2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(CN3CCCC3)c2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(CN3CCOCC3)c2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(c2)-c2ccccn2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(c2)-c2cccnc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(c2)-c2cncnc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccccc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccs2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccncc2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(Cc3ccc4OCOc4c3)CC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(Cc3ccccc3)CC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(Cc3cccnc3)CC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(Cc3noc(n3)C3CC3)CC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC3(CC2)OCc2ccccc32)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC3(CCc4ccccc34)CC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCCCC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(cn1)C1CCN(CC1)C1CCCC1
O=c1[nH]cnc2c(nccc12)-n1cc(cn1)C1CCN(CC2CC2)CC1
O=c1[nH]cnc2c(nccc12)-n1cc(cn1)C1CCN(CC2CCC2)CC1
O=c1[nH]cnc2c(nccc12)-n1cccn1
O=c1[nH]cnc2cnccc12
OC(=O)c1cc(O)c(=O)c2c(O)c(O)cc(-c3ccccc3)c2c1
OC(=O)c1ccc(O)c2ncc(cc12)N1CCCN(CCc2cccc3ccccc23)CC1
OC(=O)c1ccc(O)c2ncccc12
OC(=O)c1ccnc(c1)-c1csc(NC(=O)c2ccccc2)n1
OC(=O)c1ccnc(c1)-c1cscn1
OCCc1cnn(c1)-c1nccc2c1nc[nH]c2=O
Oc1cc(cc2cccnc12)-c1cccc(c1)C(=O)NCCCc1ccccc1
[Li+].[O-]C(=O)c1ccnc(CNCc2ccccc2)c1
[Li+].[O-]C(=O)c1ccnc(CNCc2ccco2)c1
[O-][N+](=O)c1cc(c(\C=C\c2ccc(Cl)c(Cl)c2)cc1\C=C\c1ccc(Cl)c(Cl)c1)[N+]([O-])=O