264 SMILES Strings for Glutamate receptor ionotropic, NMDA 2C

Compound Name
SMILES String
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2ccccc2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(F)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(Cl)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(Br)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(c2)C(F)(F)F)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(C)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(OC)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2ccc(Cl)cc2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccs2)cc1
CCc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2ccccc2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2ccc(Cl)c(Cl)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(I)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(Cl)c2Cl)cc1
COc1ccc(OC[C@H]2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(Cl)c2)cc1 |r|
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(c2)[N+]([O-])=O)cc1
COc1ccc(OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)c2ccc(F)c(Cl)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)cc(OC)c23)C(=O)c2ccccc2)cc1
COc1ccc(OCC2N(CCc3cc(OC)cc(OC)c23)C(=O)c2cccc(Cl)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)cc(OC)c23)C(=O)c2cccc(Br)c2)cc1
COc1ccc(OCC2N(CCc3cc4OCOc4cc23)C(=O)c2cccc(Cl)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)ccc23)C(=O)c2cccc(Cl)c2)cc1
COc1ccc(OCC2N(CCc3cc(OC)ccc23)C(=O)c2cccc(Br)c2)cc1
COc1ccc(\C=C\C2N(CCc3cc(OC)c(OC)cc23)C(=O)c2cccc(Cl)c2)cc1
Cc1cc(C(O)=O)c(NC(=O)c2ccc(cc2)C(C)(C)C)s1
Cc1sc(NC(=O)c2ccc(cc2)C(C)(C)C)c(C(O)=O)c1C
CCc1cc(C(O)=O)c(NC(=O)c2ccc(cc2)C(C)(C)C)s1
CC(C)(C)c1ccc(cc1)C(=O)Nc1sc2CCCc2c1C(O)=O
CC(C)(C)c1ccc(cc1)C(=O)Nc1sc2CCCCc2c1C(O)=O
CC(C)(C)c1ccc(cc1)C(=O)NC1=C(C2CCCCCC2S1)C(O)=O |t:14|
CC(C)(C)c1ccc(cc1)C(=O)Nc1scc(c1C(O)=O)-c1ccccc1
CCOc1ccc(cc1)-c1csc(NC(=O)c2ccc(cc2)C(C)(C)C)c1C(O)=O
COc1ccc(cc1)-c1csc(NC(=O)c2ccc(cc2)C(C)(C)C)c1C(O)=O
Cc1ccc(cc1)-c1csc(NC(=O)c2ccc(cc2)C(C)(C)C)c1C(O)=O
Cc1sc(NC(=O)c2ccc(cc2)C(C)(C)C)c(C(N)=O)c1C
CSC1=NCCN1C(=O)c1ccc(cc1)C(C)(C)C |t:2|
CC(C)(C)c1ccc(CSc2nc(N)cc(O)n2)cc1
c1ccc-2c(c1)NC(=O)c3n2c(nn3)S
Clc1ccc(CCN[C@@H]2CCCC[C@@H]2N2CCCC2)cc1Cl
C(CN1CCC(CC1)c1ccccc1)Cc1ccccc1
C(CCN1CCC(CC1)c1ccccc1)CCc1ccccc1
C(CCc1ccccc1)CN1CCN(CC1)c1ccccc1
C(CN1CCN(CC1)c1ccccc1)Cc1ccc2ccccc2c1
FC(F)(F)c1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:21|
CSc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:19|
C1CCC(CC1)(N1CCC=CC1)c1ccccc1 |c:10|
C1CCC(CC1)(N1CCC=CC1)c1cccs1 |c:10|
O=NCc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:20|
Cc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:18|
Fc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:18|
Oc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:18|
O=Cc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:19|
COc1cc(OC)cc(c1)C1(CCCCC1)N1CCC=CC1 |c:21|
C=Cc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:19|
COc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:19|
C1COC(O1)c1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:23|
CC(=O)Oc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:21|
COCOc1cccc(c1)C1(CCCCC1)N1CCC=CC1 |c:21|
C(Oc1cccc(c1)C1(CCCCC1)N1CCC=CC1)c1ccccc1 |c:19|
CC1CCCN(C1)C1(CCCCC1)c1ccccc1
c1ccc(cc1)C2(CCCCC2)N3CCCCC3
C[C@@H]1CCC[C@](C1)(N1CCCCC1)c1ccccc1
C[C@H]1CCC[C@](C1)(N1CCCCC1)c1ccccc1
C[C@@H]1CCC[C@@](C1)(N1CCCCC1)c1ccccc1
C[C@H]1CCC[C@@](C1)(N1CCCCC1)c1ccccc1
C[C@H](C[C@H](N)C(O)=O)C(O)=O |r|
[O-][N+](=O)c1cc([N+]([O-])=O)c2[nH]c(=O)c(=[OH+])[n-]c2c1
OC(=O)CSc1c([nH]c2cc(Cl)cc(Cl)c12)C(O)=O
c1c(cc(c2c1[nH]c(c2CCC(=O)O)C(=O)O)Cl)Cl
N[C@@H]1CCN(O)C1=O
ON1C2CC(NCC2)C1=O |TLB:0:1:3:5.7.6,THB:9:8:3:5.7.6|
OC(=O)Cc1c([nH]c2cc(Cl)ccc12)C(O)=O
N[C@@H]1[C@H](O)CN(O)C1=O
C[C@@H]1CN(O)C(=O)[C@@H]1N
Clc1cc2nc(C(=O)NS(=O)(=O)c3ccccc3)c(=O)[nH]c2cc1Cl
C1CC(C1)(C(=O)O)N
CCOC(=O)Cc1c([nH]c2cc(Cl)ccc12)C(O)=O
N[C@@H]1CON=C1O |r,c:4|
Oc1ccc(cc1)-c1c(O)c2c(Cl)cc(Cl)cc2[nH]c1=O
Cc1nccn1CC2CCc3c(c4ccccc4n3C)C2=O
Cc1nccn1C[C@H]1CCc2c(C1=O)c1cccc3CCCn2c13
c1ccc(cc1)C(=O)NNC(=O)c2ccc(cc2)CNS(=O)(=O)c3ccc(c(c3)Cl)F
CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OS(=O)(=O)O)C)C
OC(=O)c1ccc2cc(I)c3ccccc3c2c1
CCCc1nc2[nH]c(C)c(NS(=O)(=O)c3ccc(cc3)C3CCCCC3)c(=O)n2n1
OC(=O)c1cc2cc(Br)ccc2oc1=O
Cc1ccc2[nH]c(=O)c(C3=NN(C(C3)c3ccc(Br)cc3)C(=O)CCC(O)=O)c(-c3ccccc3)c2c1 |t:9|
C[C@@H](C(c1ccc(cc1)O)O)N2CCC(CC2)Cc3ccccc3
CC(C)CCCc1ccc2cc(ccc2c1)C(O)=O
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Br)cc1)c1c(-c2ccccc2)c2cc(Br)ccc2[nH]c1=O |c:8|
[H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)OS(O)(=O)=O |r|
OC(=O)c1cc2cc(ccc2c(Br)c1O)-c1ccccc1
Cc1c(c2ccccc2[nH]1)CCN3[C@@H](C(=C(C3=O)O)C(=O)C)c4ccc(cc4)C(=O)OC
CCN(CC)C(=S)Oc1ccc(cc1)C(=O)Nc1cccc2ccccc12
OC(=O)c1cc2cccc(O)c2cc1O
COc1ccc2nc(\C=C\c3cccc(c3)[N+]([O-])=O)n(-c3ccc(cc3)C(O)=O)c(=O)c2c1
CCC(N)[C@@H]1C[C@@]1(C(=O)N(CC)CC)c1ccccc1
CCC(N)[C@H]1C[C@]1(C(=O)N(CC)CC)c1ccccc1
CCN(CC)C(=O)[C@]1(C[C@H]1C(C)N)c1ccccc1
O=S1(=O)c2ccccc2CCC11CCN(Cc2ccccc2)CC1
O=S1c2ccccc2CCC11CCN(Cc2ccccc2)CC1
C(N1CCC2(CC1)CCc1ccccc1S2)c1ccccc1
O=C1c2ccccc2CCC11CCN(Cc2ccccc2)CC1
C(N1CCC2(CC1)CCc1ccccc1O2)c1ccccc1
OC1(Cc2ccccc2)CCN(CCC#Cc2cnc[nH]2)CC1
Cc1ccc(CC2CCN(CCC#Cc3cnc[nH]3)CC2)cc1
C(C#Cc1cn[nH]c1)N1CCC(Cc2ccccc2)CC1
C(CN1CCC(Cc2ccccc2)CC1)C#Cc1cc[nH]c1
C(CN1CCC(CC1)c1ccccc1)C#Cc1cnc[nH]1
C(CN1CCC(Cc2ccccc2)CC1)C#Cc1cn[nH]c1
C(CN1CCC(Cc2ccccc2)CC1)C#Cc1cnc[nH]1
Clc1ccc(CC2CCN(CCC#Cc3cnc[nH]3)CC2)cc1
C(C#Cc1cnc[nH]1)N1CCC(Cc2ccccc2)CC1
C(C#Cc1cc[nH]c1)N1CCC(Cc2ccccc2)CC1
Fc1ccc(CC2CCN(CCC#Cc3cnc[nH]3)CC2)cc1
OC1(CCN(CCC#Cc2cnc[nH]2)CC1)c1ccccc1
C(CN1CCC(Cc2ccccc2)CC1)Sc1nc2ccccc2[nH]1
C(CN1CCC(Cc2ccccc2)CC1)Sc1ncc[nH]1
Cc1nnc(SCCCN2CCC(Cc3ccccc3)CC2)[nH]1
[O-][N+](=O)c1ccc2nc(SCCCN3CCC(Cc4ccccc4)CC3)[nH]c2c1
Cc1nnc(SCCN2CCC(Cc3ccccc3)CC2)[nH]1
C(CN1CCC(Cc2ccccc2)CC1)Sc1nnc[nH]1
Nc1nnc(SCCCN2CCC(Cc3ccccc3)CC2)[nH]1
Nc1nnc(SCCN2CCC(Cc3ccccc3)CC2)[nH]1
Cc1nnc(SCCCN2CCC(Cc3ccccc3)CC2)s1
Oc1ccc(SCCN2CCC(Cc3ccccc3)CC2)cc1
C(CSc1ncc[nH]1)CN1CCC(Cc2ccccc2)CC1
Cc1nnc(SCCN2CCC(Cc3ccccc3)CC2)s1
Nc1nnc(SCCN2CCC(Cc3ccccc3)CC2)s1
C(CN1CCC(Cc2ccccc2)CC1)Sc1nc2ncccc2[nH]1
C(CSc1nnc[nH]1)CN1CCC(Cc2ccccc2)CC1
C(CN1CCC(Cc2ccccc2)CC1)Sc1ccccc1
[O-][N+](=O)c1ccc2nc(SCCN3CCC(Cc4ccccc4)CC3)[nH]c2c1
C(CSc1nc2ccccc2[nH]1)CN1CCC(Cc2ccccc2)CC1
Nc1nnc(SCCCN2CCC(Cc3ccccc3)CC2)s1
C(CSc1ccccc1)CN1CCC(Cc2ccccc2)CC1
Oc1ccc(cc1)C#CCCN1CCC(Cc2ccccc2)CC1
C(CSc1nc2ncccc2[nH]1)CN1CCC(Cc2ccccc2)CC1
O=c1[nH]c2ccccc2n1CCCCCN1CCC(Cc2ccccc2)CC1
Oc1c[nH]c(=O)n1CCCN1CCC(Cc2ccccc2)CC1
Fc1ccc(CC2CCN(CCCn3c4ccccc4[nH]c3=O)CC2)cc1
O=c1[nH]c2ccccc2n1CCCN1CCC(Cc2ccccc2)CC1
Oc1ccc(OCCN2CCC(Cc3ccccc3)CC2)cc1
Oc1c[nH]c(=O)n1CCCCN1CCC(Cc2ccccc2)CC1
Oc1c[nH]c(=O)n1CCCCCN1CCC(Cc2ccccc2)CC1
O=c1[nH]c2ccccc2n1CCCCN1CCC(Cc2ccccc2)CC1
C(CN1CCC(Cc2ccccc2)CC1)C#Cc1ccc2[nH]ccc2c1
OC1(Cc2ccc(F)cc2)CCN(CC#Cc2ccc3[nH]c(=O)[nH]c3c2)CC1
O=C1Nc2ccc(cc2C1=O)C#CCCN1CCC(Cc2ccccc2)CC1
Oc1ccc(cc1)C#CCN1CCC(Cc2ccccc2)CC1
C(CN1CCC(Cc2ccccc2)CC1)C#Cc1ccc2cc[nH]c2c1
Cn1c2cc(ccc2[nH]c1=O)C#CCN1CCC(Cc2ccccc2)CC1
COC1Cc2ccccc2C2(CCN(Cc3ccccc3)CC2)O1
COC1Cc2ccccc2C2(CCN(CCCc3ccccc3)CC2)O1
COC1OC2(CCN(Cc3ccccc3)CC2)c2ccccc12
NC(Cc1o[nH]c(=O)c1Cl)C(O)=O
NC(Cc1o[nH]c(=O)c1Br)C(O)=O
Cc1o[nH]c(=O)c1CC(N)C(O)=O
Cc1cc(Cn2nc(Br)cc2Cl)cc(=O)n1C[C@H]1C[C@@H]1C#N |r|
Nc1nccn1Cc1cn(nn1)-c1ccc(Cl)c(c1)C(=O)C(F)F
FC(F)Oc1cc(ccc1Cl)-n1cc(COc2ncccn2)nn1
COCc1ccnc(OCc2cn(nn2)-c2ccc(F)c(OC(F)F)c2)n1
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#16]-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#16])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#16])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](-[#8])=O |r|
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6](-[#8])=O)-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](-[#7])=O |r|
Cn1c2cc(Cl)c(Cl)cc2[nH]c(=O)c1=O
Clc1cc2[nH]c(=O)c3nncn3c2cc1Cl
Clc1cc2[nH]c(=O)c3nccn3c2cc1Cl
CCn1c2cc(Cl)c(Cl)cc2[nH]c(=O)c1=O
Clc1cc2[nH]c(=O)c(=O)[nH]c2cc1Cl
OC(CN1CCC(Cc2ccc(F)cc2)CC1)c1ccc(Cl)cc1
C[C@@H]([C@H](O)c1ccc2NC(=O)Cc2c1)N1CCC(Cc2ccccc2)CC1
C[C@@H]([C@@H](O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1
C[C@@H]([C@@H](O)c1ccc2NC(=O)Cc2c1)N1CCC(Cc2ccccc2)CC1
C[C@@H](C(c1ccc(cc1)O)O)N2CCC(CC2)Cc3ccccc3
OC(CN1CCC(Cc2ccc(F)cc2)CC1)c1ccc2NC(=O)Cc2c1
C[C@@H]([C@@H](O)c1ccc2NC(=O)Cc2c1)N1CCC(CC1)c1ccccc1
OC(=O)[C@@H]1C[C@H](CN1)c1nnn[nH]1
OC(=O)[C@H]1C[C@@H](CN1)c1nnn[nH]1
OC(=O)[C@H]1CN[C@@H](C1)C(O)=O |r|
c1cc2c(c(c1)S(=O)(=O)N)c(cc3c2NC(=O)C(=O)N3)[N+](=O)[O-]
OC(=O)CCn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1cccc1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1cccc1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)[N+]([O-])=O)-n1cccc1
OC(=O)CCn1c2cc(c(cc2[nH]c(=O)c1=O)[N+]([O-])=O)-n1cccc1
[O-][N+](=O)c1cc2[n-]c(=[OH+])c(=[OH+])[n-]c2cc1-n1cccc1
CCOC(=O)CCn1c2cc(c(cc2[nH]c(=O)c1=O)[N+]([O-])=O)-n1cccc1
[O-][N+](=O)c1cc2[nH]c(=O)c(=[OH+])[n-]c2cc1-n1ccc(CNC(=O)Nc2ccccc2)c1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1ccc(CNC(=O)Nc2ccc(cc2)[N+]([O-])=O)c1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1ccc(CNC(=O)Nc2ccccc2)c1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1ccc(CNC(=O)c2ccccc2)c1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1ccc(CNC(=O)NCc2ccccc2)c1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)[N+]([O-])=O)-n1ccc(CNC(=O)Nc2ccccc2)c1
CC(=O)NCc1ccn(c1)-c1cc2n(CC(O)=O)c(=O)c(=O)[nH]c2cc1C(F)(F)F
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1ccc(CNC(=O)Nc2ccc(cc2)C(F)(F)F)c1
OC(=O)Cn1c2cc(c(cc2[nH]c(=O)c1=O)C(F)(F)F)-n1ccc(CNC(=O)Nc2ccc(Br)cc2)c1
CC(C)C1N(C)CCc2ccsc12
COc1ccccc1-c1cccc2CCNCc12
CCOCCN1CCc2ccccc2C1c1ccccc1
C1Cc2ccsc2C(N1)c1ccccc1
CC(C)C1NCCc2ccsc12
COc1ccc(cc1)C1NCCc2ccccc12
C1Cc2ccccc2C(N1)c1cccs1
CC1NCCc2ccsc12
CCN1CCc2ccsc2C1C(C)C
CC(C)C1N(CC=C)CCc2ccsc12
CN(CCN1CCCC1)CCc1cc(Cl)c(Cl)cc1I
CCCCCN1CC[C@]2(C)[C@H](C)C1Cc1ccc(O)cc21 |TLB:4:5:10:20.14.13,THB:19:20:10:5.7.6|
COc1cccc2C(CCCNCCc3ccccc3)CCCc12
C(CN1CCN(Cc2ccccc2)CC1)CC1=CCCc2ccccc12 |t:18|
COc1cccc2C(CCCNCCNc3ccccc3)CCCc12
COc1cccc2C(CCCNCCCc3ccccc3)CCCc12
CC1C2Cc3ccc(O)cc3C1CCN2CC=C |TLB:0:1:10.4.3:14.12.13,15:14:1:10.4.3,THB:9:10:1:14.12.13|
COc1cccc2C(CCCN3CCN(Cc4ccccc4)CC3)CCCc12
COc1cccc2C(CCCN3CCN(CC3)C3CCCCC3)CCCc12
COc1cccc2C(CCCCN3CCN(CC3)C3=NCCCC3)CCCc12 |t:19|
Cc1o[nH]c(=O)c1C[C@H](N)C(O)=O
CC12CC3CC(C)(C1)CC(N)(C3)C2 |TLB:7:1:4.5.8:11,10:9:4:2.7.1,0:1:4:8.9.11,THB:7:5:11:2.1.12,12:1:4:8.9.11,12:9:4:2.7.1,6:5:11:2.1.12|
C1C2CC(CC12)[C@H](N1CCCCC1)c1ccccc1 |r|
C1C2CC(CC12)[C@@H](N1CCCCC1)c1ccccc1 |r|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2cccc(c2)C#N)c2ccccc2[nH]c1=O |c:8|
COc1cccc(c1)-c1c(C2=NN(C(C2)c2ccc(Cl)cc2)C(=O)CCC(O)=O)c(=O)[nH]c2ccccc12 |t:11|
Cc1cccc(c1)-c1c(C2=NN(C(C2)c2ccc(Cl)cc2)C(=O)CCC(O)=O)c(=O)[nH]c2ccccc12 |t:10|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2cccc(Cl)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2cccc(F)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(cc2)C(F)(F)F)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(cc2)C#N)c2ccccc2[nH]c1=O |c:8|
COc1ccc(cc1)-c1c(C2=NN(C(C2)c2ccc(Cl)cc2)C(=O)CCC(O)=O)c(=O)[nH]c2ccccc12 |t:11|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(F)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(C[C@@H]1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |r,c:8|
OC(=O)CCC(=O)N1N=C(C[C@H]1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |r,c:8|
OC(=O)CCCN1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:7|
NC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:9|
OC(=O)CCCC(=O)N1N=C(CC1c1ccc(cc1)[N+]([O-])=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:9|
OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |c:9|
COC(=O)C=CC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |w:4.3,c:9|
OC(=O)C=CC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |w:3.2,c:8|
OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Br)cc1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:9|
OC(=O)C=CC(=O)N1N=C(CC1c1ccc(Br)cc1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |w:4.4,c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2cc(Cl)cc(Cl)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2cc(F)cc(F)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(F)c(F)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)c(Cl)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(F)c(Cl)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)c(F)c2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2cccc(c2)C(F)(F)F)c2ccccc2[nH]c1=O |c:8|
Cc1ccc(cc1)-c1c(C2=NN(C(C2)c2ccc(Cl)cc2)C(=O)CCC(O)=O)c(=O)[nH]c2ccccc12 |t:10|
OC(=O)CCC(=O)N1N=C(CC1c1ccccc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(F)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Br)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccccc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(F)cc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Br)cc1)c1c(-c2ccc(Br)cc2)c2ccccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc2OCOc2c1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|
CN(C)c1ccc(cc1)C1CC(=NN1C(=O)CCC(O)=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:12|
COc1ccc(cc1)C1CC(=NN1C(=O)CCC(O)=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:11|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)C(F)(F)F)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|
COC(=O)c1ccc(cc1)C1CC(=NN1C(=O)CCC(O)=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:13|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)[N+]([O-])=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Br)cc1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccc(F)cc1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|
OC(=O)CCC(=O)N1N=C(CC1c1ccccc1)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O |c:8|