156 SMILES Strings for Lysine-specific demethylase 2A

Compound Name
SMILES String
C(C1CCCc2ccccc12)n1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1
C(Cn1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1)c1cccc2ccccc12
C(c1ccccc1)n1cnc(c1)-c1cc2[nH]nnc2cn1
C=CC(=O)N1CCC(CC1)(C(=O)NS(=O)(=O)c1ccccc1)c1ccccc1
C=CC(=O)N1CCC(CC1)(c1nnn[nH]1)c1ccccc1
CC(=O)CC(=O)CCC(O)=O
CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CC(=O)N1CCCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CC(=O)Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
CC(C)CCCCCCCCC(=O)N(O)CCC(O)=O
CC(C)NC(=O)CCC(O)=O
CC(c1ccccc1)n1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1
CCC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCC(=O)N1CCC(CC1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCC(=O)N1CCCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CCC(CC1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCC(=O)N1CCCC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCCCCCCCCC(=O)N(O)CCC(O)=O
CCCCCCCCCSc1ncc(C(O)=O)c(=O)[nH]1
CCCCCCCCOC(=O)c1ccc(O)c2ncccc12
CCCCCCCc1nc(C(=O)NCC(O)=O)c(O)c2ccccc12
CCCCCCN(C)CCc1ccc(cc1)-c1[nH]c2c(cnn2c(=O)c1C(C)C)C#N
CCCCCCN(C)Cc1ccc(cc1)-c1[nH]c2c(cnn2c(=O)c1C(C)C)C#N
CCCCCSc1ncc(C(O)=O)c(=O)[nH]1
CCCCSc1ncc(C(O)=O)c(=O)[nH]1
CCN(CCN(C)C)C(=O)CNCc1cc(ccn1)C(N)=O
CCN(CCN(C)C)C(=O)CNCc1cc(ccn1)C(O)=O
CCOC(=O)N1CCC(CC1)n1cc(nn1)-c1cc(ccn1)C(O)=O
CCOC(=O)\C=C/Sc1ncc(C(O)=O)c(=O)[nH]1
CCOC(=O)c1ccnc(CNCC(=O)N(CC)CCN(C)C)c1
CCOc1cc(ccc1F)-c1c(ncn1C)-c1cc(ccn1)-c1c[nH]nn1
CCOc1ccc(cc1)C1(CCN(CC1)C(=O)C=C)C(O)=O
CCOc1ccc(cc1)C1(CCN(CC1)C(=O)C=C)c1nnn[nH]1
CCOc1cccc(c1)C1(CCN(CC1)C(=O)C=C)c1nnn[nH]1
CCOc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1
CC\C(=C/c1ccccc1)[C@@H]1C[C@H]1NC1CC2(C1)CN(CCO)C2 |r|
CN(C)C(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
CN(C)CCCCCCCCC(=O)N(O)CCC(O)=O
CN(C)CCc1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
CN(C)N(C)C(=O)CCC(O)=O
CN(C)NC(=O)CCC(=O)NN(C)C
CN(C)NC(=O)CCC(O)=O
CN(C)OC(=O)CCC(O)=O
CN(CCc1cnn(c1)-c1nccc2c1nc[nH]c2=O)Cc1ccc(F)cc1
CNC(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
CNNC(=O)CCC(O)=O
COC(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
COC(=O)c1ccnc(c1)-c1cc(ccn1)C(O)=O
COCC(=O)Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
COc1ccc(cc1)C1(CCN(CC1)C(=O)C=C)C(O)=O
COc1ccc(cc1)C1(CCN(CC1)C(=O)C=C)c1nnn[nH]1
COc1cccc(CC(=O)Nc2ccc(O)c(c2)-c2cc(ccn2)C(O)=O)c1
COc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1
CSc1ncc(C(O)=O)c(=O)[nH]1
C[N+](C)(C)NC(=O)CCC(O)=O
Cc1c(O)c(=O)ccn1C
Cc1cc(Cl)ccc1COc1ccnn1-c1cc(ccn1)C(O)=O
Cc1cc(no1)C(=O)Nc1ccc(O)c(c1)-c1cc(ccn1)C(O)=O
Cc1ccc(cc1)N1N=C(SC11SCC(=O)N1c1ccccc1)C(=O)c1ccccc1 |c:9|
Cc1ccsc1C(NC(=O)c1ccccc1)c1cc(Cl)c2cccnc2c1O
Cc1nc(C(=O)NCC(O)=O)c(O)c2ccccc12
Cl.COC(=O)c1ccnc(c1)-c1cc(ccn1)C(=O)Nc1ccc(cc1)[C@@H]1C[C@H]1N |r|
Cl.N[C@@H]1C[C@H]1c1ccc(NC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Cl.N[C@H]1C[C@@H]1c1ccc(NC(=O)CCCCCNC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Cl.N[C@H]1C[C@@H]1c1ccc(NC(=O)CCCCNC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Cl.N[C@H]1C[C@@H]1c1ccc(NC(=O)CCCNC(=O)c2ccc(O)c3ncccc23)cc1 |r|
Clc1cc(Cl)cc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Clc1ccc(CC2CCN(CCc3cnn(c3)-c3nccc4c3nc[nH]c4=O)CC2)cc1
Clc1ccc(Cn2cnc(c2)-c2cc3[nH]nnc3cn2)cc1
Clc1ccc(Cn2cnc(c2)-c2cc3[nH]nnc3cn2)cc1Cl
Clc1ccc(cc1)-n1cnc(c1)-c1cc2[nH]nnc2cn1
Clc1ccc(cc1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Clc1cccc(Cn2cnc(c2)-c2cc(ccn2)-c2c[nH]nn2)c1Cl
Clc1cccc(Cn2cnc(c2)-c2cc3[nH]nnc3cn2)c1
Clc1cccc(c1)-n1cnc(c1)-c1cc2[nH]nnc2cn1
Clc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
Clc1ccccc1-n1cnc(c1)-c1cc2[nH]nnc2cn1
Clc1ccccc1CCn1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1
Clc1ccccc1Cn1cnc(c1)-c1cc(ccn1)-c1c[nH]nn1
Clc1ccccc1Cn1cnc(c1)-c1cc2[nH]nnc2cn1
Cn1cnc(c1-c1ccc(F)cc1OCC1CC1)-c1cc(ccn1)-c1c[nH]nn1 |(1.71,-3.53,;.22,-3.92,;-.68,-5.17,;-2.15,-4.69,;-2.15,-3.15,;-.68,-2.68,;-.29,-1.19,;-1.37,-.1,;-.98,1.39,;.51,1.78,;.91,3.27,;1.6,.7,;1.2,-.79,;2.29,-1.88,;3.78,-1.48,;4.87,-2.57,;5.27,-4.06,;6.36,-2.97,;-3.48,-2.38,;-3.48,-.84,;-4.82,-.07,;-6.15,-.84,;-6.15,-2.38,;-4.82,-3.15,;-4.82,1.47,;-6.06,2.37,;-5.59,3.84,;-4.05,3.84,;-3.57,2.37,)|
FC(F)(F)c1cc(CN2CCCC2)cc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
FC(F)(F)c1cccc(Cn2cnc(c2)-c2cc(ccn2)-c2c[nH]nn2)c1Cl
Fc1cccc(c1)C1CCN(CCc2cnn(c2)-c2nccc3c2nc[nH]c3=O)CC1
NCc1ccc(CN(CCCCN(O)C(=O)C=CC([O-])=O)C(=S)Nc2ccc(c(c2)C([O-])=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)cc1 |w:16.15,(37.34,-10.75,;37.34,-12.29,;36.01,-13.06,;36.02,-14.61,;34.68,-15.38,;33.36,-14.6,;32.02,-15.38,;30.69,-14.61,;29.36,-15.38,;29.36,-16.92,;28.03,-17.7,;26.69,-16.93,;25.36,-17.7,;25.36,-19.24,;24.03,-16.94,;24.02,-15.4,;22.69,-17.71,;21.36,-16.94,;20.03,-17.71,;18.69,-16.95,;20.03,-19.25,;30.69,-13.07,;32.02,-12.3,;29.35,-12.3,;29.35,-10.76,;28.01,-9.99,;28.01,-8.45,;29.35,-7.68,;30.68,-8.45,;30.68,-9.98,;32.01,-7.67,;33.34,-8.44,;33.1,-6.57,;29.34,-6.15,;30.67,-5.38,;32,-6.15,;33.34,-5.38,;33.33,-3.84,;34.66,-3.06,;32,-3.07,;30.68,-3.84,;29.34,-3.07,;28.01,-3.84,;26.69,-3.06,;25.36,-3.84,;24.02,-3.08,;25.36,-5.38,;26.69,-6.14,;28.02,-5.38,;33.34,-13.07,;34.67,-12.3,)|
NCc1ccc(CNCCCCN(O)C(=O)\C=C\C(O)=O)cc1
NNC(=O)CCC(O)=O
N[C@@H]1C[C@H]1c1ccccc1 |r|
Nc1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
Nc1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)nc1
Nc1nc(cs1)-c1cc(ccn1)C(O)=O
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccc(CN3CCCC3)c2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2cccs2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC3(CCc4ccccc34)CC2)cn1
O=c1[nH]cnc2c(nccc12)-n1cc(cn1)C1CCN(CC2CCC2)CC1
OC(=O)C(F)(F)F.N[C@@H]1C[C@H]1c1ccc(NC(=O)c2ccnc(c2)-c2cc(ccn2)C(O)=O)cc1 |r|
OC(=O)C1(CCN(CC1)C(=O)C=C)c1ccc(Cl)cc1
OC(=O)C1(CCN(CC1)C(=O)C=C)c1ccccc1
OC(=O)CNC(=O)C(O)=O
OC(=O)CNC(=O)c1nc(CC=C)c2ccccc2c1O
OC(=O)CNC(=O)c1nc(Cc2ccccc2)c2ccc(Br)cc2c1O
OC(=O)CNC(=O)c1nc(Cc2ccccc2)c2ccccc2c1O
OC(=O)CNC(=O)c1nc(Cl)c2ccccc2c1O
OC(=O)CNC(=O)c1nc(Nc2ccc(cc2)[N+]([O-])=O)ccc1O
OC(=O)CNC(=O)c1nc(Nc2ccc(cn2)[N+]([O-])=O)ccc1O
OC(=O)CNC(=O)c1nc(ccc1O)-c1cccc2ccccc12
OC(=O)CNC(=O)c1nc(ccc1O)-c1cccc2ncccc12
OC(=O)CNC(=O)c1nc(ccc1O)-c1ccccc1
OC(=O)CNC(=O)c1nc(ccc1O)-c1ccccc1-c1ccccc1
OC(=O)\C=C/Sc1ncc(C(O)=O)c(=O)[nH]1
OC(=O)\C=C\C(=O)NNC(=O)c1cnccc1Cc1ccccc1
OC(=O)c1c[nH]c(=S)[nH]c1=O
OC(=O)c1ccc(O)c2ncccc12
OC(=O)c1ccnc(CN2CCNCC2)c1
OC(=O)c1ccnc(c1)-c1c[nH]nn1
OC(=O)c1ccnc(c1)-c1cc(NC(=O)c2ccc(O)cc2)ccc1O
OC(=O)c1ccnc(c1)-c1ccccn1
OC(=O)c1ccnc(c1)-c1cn(CCOc2ccccc2)nn1
OC(=O)c1ccnc(c1)-c1cn(CCc2ccccc2)nn1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCCN(C1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCCN(C1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCCN(C1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(C1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(C1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(CC1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(CC1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CCN(CC1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CN(C1)C(=O)CCc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CN(C1)C(=O)Cc1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)C1CN(C1)C(=O)c1ccccc1
OC(=O)c1ccnc(c1)-c1cn(nn1)[C@@H]1CCCN(C1)C(=O)c1ccccc1 |r|
OC(=O)c1ccnc(c1)-c1cn(nn1)[C@H]1CCCN(C1)C(=O)c1ccccc1 |r|
OC(=O)c1ccnc(c1)C(O)=O
OC(=O)c1cnc(SCC(=O)c2ccccc2)[nH]c1=O
OC(=O)c1cnc(SCC2CCCCC2)[nH]c1=O
OC(=O)c1cnc(SCCCCc2ccccc2)[nH]c1=O
OC(=O)c1cnc(SCCCc2ccccc2)[nH]c1=O
OC(=O)c1cnc(SCCc2ccccc2)[nH]c1=O
OC(=O)c1cnc(SCc2ccccc2)[nH]c1=O
ON(CCC(O)=O)C(=O)CCCCCCCCC1CC1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CCCC1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CCCCC1
ON(CCC(O)=O)C(=O)CCCCCCCCC1CCCCCC1
ON(CCC(O)=O)C(=O)CCCCCCCCc1ccccc1
ONC(=O)CCC(O)=O
O[C@@H](CCC(O)=O)C(O)=O |r|
O[C@H](CCC(O)=O)C(O)=O |r|
[I-].CCCCCC[n+]1ccc(\C=C\c2ccc(cc2)N(C)C)cc1
[I-].CCCCCC[n+]1ccccc1C=Cc1ccc(cc1)N(C)C
[I-].CN(C)c1ccc(\C=C\c2cc[n+](Cc3ccc(F)cc3)cc2)cc1
[K;v0+].[#6]-[#6]-n1cc(nn1)-c1cc(ccn1)-[#6](-[#8-])=O
[K;v0+].[#6]-c1cccc(c1)-n1cc(nn1)-c1cc(ccn1)-[#6](-[#8-])=O
[K;v0+].[#6]-n1cc(nn1)-c1cc(ccn1)-[#6](-[#8-])=O
[K;v0+].[#8-]-[#6](=O)-c1ccnc(c1)-c1cn(-[#6]-c2ccccc2)nn1