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96 SMILES Strings for Alpha-glucosidase MAL12

Compound NameSMILES String
BDBM4374 OC(=O)\C=C\c1ccc(O)cc1
BDBM152494 CCCN1C(=O)\C(=N\NC(=O)Cc2ccc(Cl)cc2Cl)c2ccccc12
BDBM152495 Cc1ccc(cc1)C(=O)N\N=C1\C(=O)Nc2ccc(Cl)cc12
BDBM152496 Clc1ccc(CC(=O)N\N=C2\C(=O)Nc3cc(Br)ccc23)cc1Cl
BDBM152497 Clc1ccc(CC(=O)N\N=C2\C(=O)Nc3cc(Br)ccc23)c(Cl)c1
BDBM152498 Oc1ccccc1C(=O)N\N=C1\C(=O)Nc2cc(Br)ccc12
BDBM152499 CCCCCCCCCCCC(=O)N\N=C1\C(=O)Nc2ccccc12
BDBM18351 OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O
BDBM23406 C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)OC(O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O |t:37|
BDBM23926 Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
BDBM26194 OC(=O)c1ccc(O)cc1
BDBM84959 Nc1ccc(\C=C\c2ccc(O)c(O)c2)cc1
BDBM84960 CNc1ccc(\C=C\c2ccc(O)c(O)c2)cc1
BDBM84961 CC(=O)Nc1ccc(\C=C\c2ccc(O)c(O)c2)cc1
BDBM84962 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccccc3)cc2)cc1O
BDBM84963 COc1ccc(NC(=O)Nc2ccc(\C=C\c3ccc(O)c(O)c3)cc2)cc1
BDBM84964 Nc1ccc(NC(=O)Nc2ccc(\C=C\c3ccc(O)c(O)c3)cc2)cc1
BDBM84965 Cc1ccc(NC(=O)Nc2ccc(\C=C\c3ccc(O)c(O)c3)cc2)cc1
BDBM84966 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2)cc1O
BDBM84967 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccc(F)cc3)cc2)cc1O
BDBM84968 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccc(F)cc3F)cc2)cc1O
BDBM84969 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc1O
BDBM84970 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccccc3)cc2)cc1
BDBM84971 COc1ccc(NC(=O)Nc2ccc(\C=C\c3ccc(O)cc3)cc2)cc1
BDBM84972 Oc1ccc(\C=C\c2ccc(NC(=O)Nc3ccc(F)cc3F)cc2)cc1
BDBM84973 Oc1cc(O)cc(\C=C\c2ccc(NC(=O)Nc3ccccc3)cc2)c1
BDBM84974 COc1ccc(NC(=O)Nc2ccc(\C=C\c3cc(O)cc(O)c3)cc2)cc1
BDBM84975 Oc1cc(O)cc(\C=C\c2ccc(NC(=O)Nc3ccc(F)cc3F)cc2)c1
BDBM108031 OC(=O)c1c(O)cc(O)cc1O
BDBM108032 CC[C@H]1O[C@@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
BDBM108033 CC[C@H]1O[C@@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(OC)c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
BDBM108034 OCC1OC(Oc2cc3c(cc(O)cc3=[OH+])oc2-c2ccc(O)cc2)C(O)C(O)C1O
BDBM108035 COc1cc(ccc1O)-c1oc2cc(O)cc(=[OH+])c2cc1OC1OC(CO)C(O)C(O)C1O
BDBM112642 CCOC(=O)C1C(NC(=O)N=C1C)c1ccccc1 |c:10|
BDBM112643 CCOC(=O)C1C(NC(=O)N=C1C)c1ccc(Cl)cc1 |c:10|
BDBM112646 CCOC(=O)C1C(NC(=O)N=C1C)c1ccc(C)cc1 |c:10|
BDBM112651 CCOC(=O)C1C(NC(=S)N=C1C)c1ccc(C)cc1 |c:10|
BDBM112652 CCOC(=O)[C@H]1[C@@H]2NC(=O)NC1(C)Oc1ccccc21 |r,TLB:9:8:5:19.14.13|
BDBM112645 CCOC(=O)C1C(NC(=O)N=C1C)c1ccc(O)c(OC)c1 |c:10|
BDBM50100861 OC(=O)c1ccc(O)c(O)c1
BDBM50173649 Nc1ccc(\C=C\c2ccc(O)cc2)cc1
BDBM50207546 N[C@@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O
BDBM50214744 COc1cc(\C=C\C(O)=O)ccc1O
BDBM50308255 CO[C@@H]1O[C@H](Cn2cc(nn2)-c2ccccc2)[C@H]2OC(C)(C)O[C@@H]12 |r|
BDBM50308256 CO[C@@H]1O[C@H](Cn2cc(nn2)C2=CCCCC2)[C@H]2OC(C)(C)O[C@@H]12 |r,t:12|
BDBM50308257 CCOC(=O)c1cn(C[C@H]2O[C@@H](OC)[C@@H]3OC(C)(C)O[C@H]23)nn1 |r|
BDBM50308258 CO[C@@H]1O[C@H](Cn2cc(COc3ccccc3)nn2)[C@H]2OC(C)(C)O[C@@H]12 |r|
BDBM50308259 CO[C@@H]1O[C@H](Cn2cc(nn2)C2(O)CCCCC2)[C@H]2OC(C)(C)O[C@@H]12 |r|
BDBM50308260 CO[C@@H]1O[C@H](Cn2cc(COC3CCCCO3)nn2)[C@H]2OC(C)(C)O[C@@H]12 |r|
BDBM50322066 Nc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
BDBM50337364 COc1cc(ccc1O)C(O)=O
BDBM50333465 C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O |r,t:37|
BDBM50336487 COc1ccc(cc1OC)C(O)=O
BDBM50347135 OCC1OC(Oc2cc3c(cc(O)cc3=[OH+])oc2-c2ccc(O)c(O)c2)C(O)C(O)C1O
BDBM181071 Fc1ccccc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
BDBM60591 Fc1cccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c1
BDBM181074 COc1ccccc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
BDBM181058 COc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
BDBM181059 Oc1ccccc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
BDBM181060 Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
BDBM181061 CC(C)(C)c1cc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c(O)c(c1)C(C)(C)C
BDBM181062 Oc1c(Cl)cc(Cl)cc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
BDBM181063 Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1F
BDBM181064 Oc1ccc(Cl)cc1\C=N\NC(=O)c1nc(cs1)-c1cc2ccccc2oc1=O
BDBM181065 COc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c(O)c1
BDBM181066 Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c(O)c1
BDBM181067 Oc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1O
BDBM181068 Clc1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
BDBM181069 Clc1cccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c1
BDBM181070 FC(F)(F)c1ccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)cc1
BDBM181073 Brc1cccc(\C=N\NC(=O)c2nc(cs2)-c2cc3ccccc3oc2=O)c1
BDBM197302 OC(=O)c1ccccc1
BDBM50180587 [H]C1(OC2C(CO)OC([H])(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)OC(C)C(NC2([H])C=C(CO)C(O)C(O)C2O)C(O)C1O |t:35|
BDBM50190317 c1ccc(cc1)-c1ccnc2nnnn12
BDBM50190321 [O-][N+](=O)c1ccc(cc1)-c1ccnc2nnnn12
BDBM50190318 Clc1ccc(cc1)-c1ccnc2nnnn12
BDBM50190319 Fc1ccc(cc1)-c1ccnc2nnnn12
BDBM50190320 Cc1ccc(cc1)-c1ccnc2nnnn12
BDBM50190322 Oc1ccccc1-c1ccnc2nnnn12
BDBM50190323 COc1ccc(cc1)-c1ccnc2nnnn12
BDBM50190324 c1ccc(nc1)-c1ccnc2nnnn12
BDBM50190325 O=c1oc2ccccc2cc1-c1ccnc2nnnn12
BDBM50190326 c1csc(c1)-c1ccnc2nnnn12
BDBM243063 COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](CO)OC3c2c1O |r|
BDBM243064 COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccccc4)OC3c2c1O |r|
BDBM243065 COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccc(O)cc4)OC3c2c1O |r|
BDBM243066 COc1ccc(cc1)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O |r|
BDBM243067 COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccc(O)c(O)c4)OC3c2c1O |r|
BDBM243068 COc1ccc(cc1OC)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O |r|
BDBM243069 COc1cc(ccc1O)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O |r|
BDBM243070 COc1cc(OC)cc(c1)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O |r|
BDBM243071 COc1cc(cc(OC)c1O)C(=O)OC[C@H]1OC2C(OC(=O)c3cc(O)c(OC)c(O)c23)[C@@H](O)[C@@H]1O |r|
BDBM243072 COc1ccc(cc1)C(O)=O
BDBM243073 OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(O)cc2)c2[nH]c(=O)[nH]c(=O)c12
BDBM243074 OCC(O)C(O)C(O)C(O)C1c2c([nH]c(=O)[nH]c2=O)N(c2ccc(Br)cc2)c2[nH]c(=O)[nH]c(=O)c12
BDBM243075 Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)N1c2[nH]c(=O)[nH]c(=O)c2C(C(O)C(O)C(O)C(O)CO)c2c1[nH]c(=O)[nH]c2=O