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SMILES_ORIGINAL
string | MUV-737
int64 | SMILES
string | IMAGE
image | SELFIES
string | InChIKey
string | IUPAC
string | template_original
string | template
string |
|---|---|---|---|---|---|---|---|---|
CCc1cccc2c1NC(=O)C21C2C(=O)N(Cc3ccccc3)C(=O)C2C2CCCN21 | 0 | CCc1cccc2c1NC(=O)C21C2C(=O)N(Cc3ccccc3)C(=O)C2C2CCCN21 | [C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][=C][C][C][C][C][N][Ring1][Branch1][Ring2][Ring1][Ring2] | IKGQDFUZZJEFNF-UHFFFAOYSA-N | 2'-benzyl-7-ethylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES CCc1cccc2c1NC(=O)C21C2C(=O)N(Cc3ccccc3)C(=O)C2C2CCCN21 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1c(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)oc2ccccc12 | 0 | Cc1c(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)oc2ccccc12 | [C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][=C][Branch1][C][C][N][Branch1][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N][=O][O][C][=C][C][=C][C][=C][Ring2][Ring1][#Branch2][Ring1][=Branch1] | GGSCRXWEIRWZSW-UHFFFAOYSA-N | N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-methyl-1-benzofuran-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1c(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)oc2ccccc12 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccc(Cn2c(SCCN3CCCCC3)nc3c2c(=O)n(C)c(=O)n3C)cc1 | 0 | Cc1ccc(Cn2c(SCCN3CCCCC3)nc3c2c(=O)n(C)c(=O)n3C)cc1 | [C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][N][C][Branch1][N][S][C][C][N][C][C][C][C][C][Ring1][=Branch1][=N][C][=C][Ring1][=C][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch2][C][C][=C][Ring2][Ring1][=N] | WZFNMLSFEYKFES-UHFFFAOYSA-N | 1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-(2-piperidin-1-ylethylsulfanyl)purine-2,6-dione | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES Cc1ccc(Cn2c(SCCN3CCCCC3)nc3c2c(=O)n(C)c(=O)n3C)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CC(C)(C)n1nnnc1C(c1ccncc1)N1CCCCCC1 | 0 | CC(C)(C)n1nnnc1C(c1ccncc1)N1CCCCCC1 | [C][C][Branch1][C][C][Branch1][C][C][N][N][=N][N][=C][Ring1][Branch1][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][C][C][C][C][C][Ring1][#Branch1] | QTKSZRFHSFUIHK-UHFFFAOYSA-N | 1-[(1-tert-butyltetrazol-5-yl)-pyridin-4-ylmethyl]azepane | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of CC(C)(C)n1nnnc1C(c1ccncc1)N1CCCCCC1 is not a potentiator of the ER-alpha-coact. binding. |
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CCn1cc(S(=O)(=O)c2ccc(C)cc2)n(Cc2ccc(C(C)(C)C)cc2)c1=O | 0 | CCn1cc(S(=O)(=O)c2ccc(C)cc2)n(Cc2ccc(C(C)(C)C)cc2)c1=O | [C][C][N][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][Ring2][Ring1][#Branch2][=O] | HBPRQPKNWHHLPD-UHFFFAOYSA-N | 3-[(4-tert-butylphenyl)methyl]-1-ethyl-4-(4-methylphenyl)sulfonylimidazol-2-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES CCn1cc(S(=O)(=O)c2ccc(C)cc2)n(Cc2ccc(C(C)(C)C)cc2)c1=O is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1cc(C)c(NC(=O)CS(=O)CC(=O)N2CCN(c3ccccc3)CC2)c(C)c1 | 0 | Cc1cc(C)c(NC(=O)CS(=O)CC(=O)N2CCN(c3ccccc3)CC2)c(C)c1 | [C][C][=C][C][Branch1][C][C][=C][Branch2][Ring2][C][N][C][=Branch1][C][=O][C][S][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][C][Branch1][C][C][=C][Ring2][Ring1][=N] | IMKWRUJRAYNPEA-UHFFFAOYSA-N | 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfinyl-N-(2,4,6-trimethylphenyl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES Cc1cc(C)c(NC(=O)CS(=O)CC(=O)N2CCN(c3ccccc3)CC2)c(C)c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CC1CC(=O)c2cnc(NCc3ccco3)nc2C1 | 0 | CC1CC(=O)c2cnc(NCc3ccco3)nc2C1 | [C][C][C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][#Branch2][N][C][C][=C][C][=C][O][Ring1][Branch1][N][=C][Ring1][=N][C][Ring2][Ring1][C] | GULIGWUJEKIEOZ-UHFFFAOYSA-N | 2-(furan-2-ylmethylamino)-7-methyl-7,8-dihydro-6H-quinazolin-5-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CC1CC(=O)c2cnc(NCc3ccco3)nc2C1 is not a potentiator of the ER-alpha-coact. binding. |
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Cc1cc(-c2nnc3sc(C4CCCCC4)nn23)n[nH]1 | 0 | Cc1cc(-c2nnc3sc(C4CCCCC4)nn23)n[nH]1 | [C][C][=C][C][Branch2][Ring1][#Branch1][C][=N][N][=C][S][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][=N][N][Ring1][=C][Ring1][O][=N][NH1][Ring2][Ring1][Ring1] | JICYGHAGARKJBX-UHFFFAOYSA-N | 6-cyclohexyl-3-(5-methyl-1H-pyrazol-3-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of Cc1cc(-c2nnc3sc(C4CCCCC4)nn23)n[nH]1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COc1ccc(NC2=Nc3ccccc3CC2)cc1 | 0 | COc1ccc(NC2=Nc3ccccc3CC2)cc1 | [C][O][C][=C][C][=C][Branch1][S][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][#Branch2][C][=C][Ring1][P] | JSPWKXVREJVMOS-UHFFFAOYSA-N | N-(4-methoxyphenyl)-3,4-dihydroquinolin-2-amine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of COc1ccc(NC2=Nc3ccccc3CC2)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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N#Cc1c(-c2ccccc2)nc(-c2ccccc2)nc1N1CCOCC1 | 0 | N#Cc1c(-c2ccccc2)nc(-c2ccccc2)nc1N1CCOCC1 | [N][#C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring2][Ring1][C][N][C][C][O][C][C][Ring1][=Branch1] | ZYGRWMPTDDLBCJ-UHFFFAOYSA-N | 4-morpholin-4-yl-2,6-diphenylpyrimidine-5-carbonitrile | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of N#Cc1c(-c2ccccc2)nc(-c2ccccc2)nc1N1CCOCC1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCN(CC)C(=O)CSc1nnc(C2CCCCC2)o1 | 0 | CCN(CC)C(=O)CSc1nnc(C2CCCCC2)o1 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][O][Ring1][O] | HQVAKWGYXGLKEG-UHFFFAOYSA-N | 2-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N,N-diethylacetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CCN(CC)C(=O)CSc1nnc(C2CCCCC2)o1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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c1ccc(-c2nnc(CSc3nnc(-c4cccs4)o3)o2)cc1 | 0 | c1ccc(-c2nnc(CSc3nnc(-c4cccs4)o3)o2)cc1 | [C][=C][C][=C][Branch2][Ring1][=N][C][=N][N][=C][Branch2][Ring1][Ring1][C][S][C][=N][N][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][O][Ring1][#Branch2][O][Ring1][P][C][=C][Ring2][Ring1][#Branch1] | HJMHKNVUXQZNFV-UHFFFAOYSA-N | 2-phenyl-5-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1,3,4-oxadiazole | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES c1ccc(-c2nnc(CSc3nnc(-c4cccs4)o3)o2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1cc(C)c(NC(=O)CSc2nnc(-c3ccncc3)n2Cc2ccco2)c(C)c1 | 0 | Cc1cc(C)c(NC(=O)CSc2nnc(-c3ccncc3)n2Cc2ccco2)c(C)c1 | [C][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][C][=C][C][=C][O][Ring1][Branch1][C][Branch1][C][C][=C][Ring2][Ring1][=C] | BVFYXWCYKCSSED-UHFFFAOYSA-N | 2-[[4-(furan-2-ylmethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of Cc1cc(C)c(NC(=O)CSc2nnc(-c3ccncc3)n2Cc2ccco2)c(C)c1 is not a potentiator of the ER-alpha-coact. binding. |
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CCC(OC(=O)c1cc2sccc2n1C)C(=O)NCc1ccco1 | 0 | CCC(OC(=O)c1cc2sccc2n1C)C(=O)NCc1ccco1 | [C][C][C][Branch2][Ring1][Ring1][O][C][=Branch1][C][=O][C][=C][C][S][C][=C][C][=Ring1][Branch1][N][Ring1][Branch2][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1] | CVOQWNSBXBOAPA-UHFFFAOYSA-N | [1-(furan-2-ylmethylamino)-1-oxobutan-2-yl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of CCC(OC(=O)c1cc2sccc2n1C)C(=O)NCc1ccco1 is not a potentiator of the ER-alpha-coact. binding. |
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O=C(NCCc1ccc2c(c1)OCCO2)c1cc2ccccc2o1 | 0 | O=C(NCCc1ccc2c(c1)OCCO2)c1cc2ccccc2o1 | [O][=C][Branch2][Ring1][Ring2][N][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2] | RSSQMAWUVUHHGX-UHFFFAOYSA-N | N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-benzofuran-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES O=C(NCCc1ccc2c(c1)OCCO2)c1cc2ccccc2o1 is not a potentiator of the ER-alpha-coact. binding. |
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Cn1c(=O)c2c(nc(N3CCc4ccccc4C3)n2Cc2ccccc2F)n(C)c1=O | 0 | Cn1c(=O)c2c(nc(N3CCc4ccccc4C3)n2Cc2ccccc2F)n(C)c1=O | [C][N][C][=Branch1][C][=O][C][=C][Branch2][Ring1][S][N][=C][Branch1][#C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][N][Ring1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][Branch1][C][C][C][Ring2][Ring1][=N][=O] | BIQLSAIXCYFREG-UHFFFAOYSA-N | 8-(3,4-dihydro-1H-isoquinolin-2-yl)-7-[(2-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES representation of Cn1c(=O)c2c(nc(N3CCc4ccccc4C3)n2Cc2ccccc2F)n(C)c1=O is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOC(=O)C1(Nc2nccs2)Sc2ccccc2NC1=O | 0 | CCOC(=O)C1(Nc2nccs2)Sc2ccccc2NC1=O | [C][C][O][C][=Branch1][C][=O][C][Branch1][=Branch2][N][C][=N][C][=C][S][Ring1][Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Ring1][S][=O] | HYZOCVOCBWALGQ-UHFFFAOYSA-N | ethyl 3-oxo-2-(1,3-thiazol-2-ylamino)-4H-1,4-benzothiazine-2-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of CCOC(=O)C1(Nc2nccs2)Sc2ccccc2NC1=O is not a potentiator of the ER-alpha-coact. binding. |
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CCC(C)NC(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1C | 0 | CCC(C)NC(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1C | [C][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][N][Ring1][#C][C] | ZOMVYVFFNIEURG-UHFFFAOYSA-N | N-butan-2-yl-2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of CCC(C)NC(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1C is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCN(CC(=O)NC(C)C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2OC)cc1 | 0 | CCN(CC(=O)NC(C)C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2OC)cc1 | [C][C][N][Branch1][N][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=C][Ring2][Ring1][Ring1] | JPKZSXIIJOGIJF-UHFFFAOYSA-N | N-ethyl-4-[(2-methoxyphenyl)-methylsulfamoyl]-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CCN(CC(=O)NC(C)C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2OC)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccc(NC(=O)c2ccco2)cc1C | 0 | Cc1ccc(NC(=O)c2ccco2)cc1C | [C][C][=C][C][=C][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][=C][Ring1][=C][C] | VEGUVCOEABXDND-UHFFFAOYSA-N | N-(3,4-dimethylphenyl)furan-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES representation of Cc1ccc(NC(=O)c2ccco2)cc1C is not a potentiator of the ER-alpha-coact. binding. |
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COc1ccc(CNC(=O)CN(Cc2ccccc2)C(=O)c2csnn2)cc1 | 0 | COc1ccc(CNC(=O)CN(Cc2ccccc2)C(=O)c2csnn2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][S][N][=N][Ring1][Branch1][C][=C][Ring2][Ring1][#Branch2] | WACSKIVBDZQMRU-UHFFFAOYSA-N | N-benzyl-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]thiadiazole-4-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of COc1ccc(CNC(=O)CN(Cc2ccccc2)C(=O)c2csnn2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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c1cc(-c2nc3cc(Oc4ccc5oc(-c6ccncc6)nc5c4)ccc3o2)ccn1 | 0 | c1cc(-c2nc3cc(Oc4ccc5oc(-c6ccncc6)nc5c4)ccc3o2)ccn1 | [C][=C][C][Branch2][Ring2][O][C][=N][C][=C][C][Branch2][Ring1][=Branch2][O][C][=C][C][=C][O][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][C][Ring1][O][=C][Ring1][#C][=C][C][=C][Ring2][Ring1][=Branch1][O][Ring2][Ring1][=Branch2][=C][C][=N][Ring2][Ring1][#C] | SDQTYRHIFVRDTK-UHFFFAOYSA-N | 2-pyridin-4-yl-5-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)oxy]-1,3-benzoxazole | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES c1cc(-c2nc3cc(Oc4ccc5oc(-c6ccncc6)nc5c4)ccc3o2)ccn1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1cccc(-c2nc(CS(=O)CC(=O)NCCCSC3CCCCC3)c(C)o2)c1 | 0 | Cc1cccc(-c2nc(CS(=O)CC(=O)NCCCSC3CCCCC3)c(C)o2)c1 | [C][C][=C][C][=C][C][Branch2][Ring2][=Branch1][C][=N][C][Branch2][Ring1][Branch2][C][S][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C][C][C][S][C][C][C][C][C][C][Ring1][=Branch1][=C][Branch1][C][C][O][Ring2][Ring1][#Branch1][=C][Ring2][Ring1][=N] | GXZOPNFPXQZSTG-UHFFFAOYSA-N | N-(3-cyclohexylsulfanylpropyl)-2-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methylsulfinyl]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of Cc1cccc(-c2nc(CS(=O)CC(=O)NCCCSC3CCCCC3)c(C)o2)c1 is not a potentiator of the ER-alpha-coact. binding. |
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CC(=O)Nc1cccc(C(=O)OCc2ccccc2)c1 | 0 | CC(=O)Nc1cccc(C(=O)OCc2ccccc2)c1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][S] | ZTYNZFSCUSFIHC-UHFFFAOYSA-N | benzyl 3-acetamidobenzoate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES CC(=O)Nc1cccc(C(=O)OCc2ccccc2)c1 is not a potentiator of the ER-alpha-coact. binding. |
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COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC | 0 | COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC | [C][O][C][=C][C][=C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=C][Ring1][=C][C][=C][Ring2][Ring1][Branch2][O][C] | QCOVCUPDOGFZRU-UHFFFAOYSA-N | N-[(3,4-dimethoxyphenyl)methyl]-4-pyrrolidin-1-ylsulfonylbenzamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of COc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC is not a potentiator of the ER-alpha-coact. binding. |
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Oc1ccc(CNc2ccccc2O)cc1 | 0 | Oc1ccc(CNc2ccccc2O)cc1 | [O][C][=C][C][=C][Branch1][N][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][Ring1][#C] | CUXRKYKPFBCCMM-UHFFFAOYSA-N | 2-[(4-hydroxyphenyl)methylamino]phenol | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Oc1ccc(CNc2ccccc2O)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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Brc1ccc(-c2nnc3n2CCCCC3)cc1 | 0 | Brc1ccc(-c2nnc3n2CCCCC3)cc1 | [Br][C][=C][C][=C][Branch1][#C][C][=N][N][=C][N][Ring1][Branch1][C][C][C][C][C][Ring1][#Branch1][C][=C][Ring1][S] | ADECVMMOLHCQTO-UHFFFAOYSA-N | 3-(4-bromophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of Brc1ccc(-c2nnc3n2CCCCC3)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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Cc1sc(NC(=O)CSc2nnc(-c3ccccc3)o2)c(C#N)c1C | 0 | Cc1sc(NC(=O)CSc2nnc(-c3ccccc3)o2)c(C#N)c1C | [C][C][S][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][O][=C][Branch1][Ring1][C][#N][C][=Ring2][Ring1][#Branch1][C] | HGIVTQHWIGAJIC-UHFFFAOYSA-N | N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1sc(NC(=O)CSc2nnc(-c3ccccc3)o2)c(C#N)c1C is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1cccc(C)n1 | 0 | CCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1cccc(C)n1 | [C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][C][=C][Branch1][S][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2][C][Ring1][=C][C][=C][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1] | NWZWLKWHCPYGHL-UHFFFAOYSA-N | ethyl 2,7,7-trimethyl-4-(6-methylpyridin-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES CCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1cccc(C)n1 is not a potentiator of the ER-alpha-coact. binding. |
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COc1cccc(C2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c1OC | 0 | COc1cccc(C2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c1OC | [C][O][C][=C][C][=C][C][Branch2][Ring2][Branch2][C][C][Branch1][Ring1][C][#N][=C][Branch1][C][N][O][C][C][=C][Branch1][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Branch1][C][=O][C][=Ring1][#C][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][N][O][C] | WZRZOWPKCUJRRO-UHFFFAOYSA-N | 2-amino-4-(2,3-dimethoxyphenyl)-7-methyl-5-oxo-6-(pyridin-2-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES COc1cccc(C2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c1OC is not a potentiator of the ER-alpha-coact. binding. |
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CC1CCCC(C)N1C(=O)CSc1nnc(CSc2ncccn2)n1C | 0 | CC1CCCC(C)N1C(=O)CSc1nnc(CSc2ncccn2)n1C | [C][C][C][C][C][C][Branch1][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][O][C][S][C][=N][C][=C][C][=N][Ring1][=Branch1][N][Ring1][=N][C] | DCQOHLFHWOQBPJ-UHFFFAOYSA-N | 1-(2,6-dimethylpiperidin-1-yl)-2-[[4-methyl-5-(pyrimidin-2-ylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of CC1CCCC(C)N1C(=O)CSc1nnc(CSc2ncccn2)n1C is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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C/C(=C1/SC(N2CCOCC2)=NC1=O)c1ccc(Br)cc1 | 0 | C/C(=C1/SC(N2CCOCC2)=NC1=O)c1ccc(Br)cc1 | [C][/C][=Branch2][Ring1][Ring1][=C][/S][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][C][Ring1][O][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1] | RKPRTSBFAHUQCT-RAXLEYEMSA-N | (5Z)-5-[1-(4-bromophenyl)ethylidene]-2-morpholin-4-yl-1,3-thiazol-4-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of C/C(=C1/SC(N2CCOCC2)=NC1=O)c1ccc(Br)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COCCNC(=O)C(c1ccc(C)cc1)N(C(=O)CCC(=O)Nc1ccccn1)C1CCCC1 | 0 | COCCNC(=O)C(c1ccc(C)cc1)N(C(=O)CCC(=O)Nc1ccccn1)C1CCCC1 | [C][O][C][C][N][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][C][C][C][Ring1][Branch1] | YXMIEABNTZKBLU-UHFFFAOYSA-N | N'-cyclopentyl-N'-[2-(2-methoxyethylamino)-1-(4-methylphenyl)-2-oxoethyl]-N-pyridin-2-ylbutanediamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES COCCNC(=O)C(c1ccc(C)cc1)N(C(=O)CCC(=O)Nc1ccccn1)C1CCCC1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1sc2ncnc(NCc3ccccc3)c2c1C | 0 | Cc1sc2ncnc(NCc3ccccc3)c2c1C | [C][C][S][C][=N][C][=N][C][Branch1][O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C][C][=Ring1][P][C] | PLTUYNPFGXPAAT-UHFFFAOYSA-N | N-benzyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES Cc1sc2ncnc(NCc3ccccc3)c2c1C is not a potentiator of the ER-alpha-coact. binding. |
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Cc1cc(C)n2cc(CSc3nnnn3-c3ccccc3)nc2n1 | 0 | Cc1cc(C)n2cc(CSc3nnnn3-c3ccccc3)nc2n1 | [C][C][C][=C][Branch1][C][C][N][C][=C][Branch2][Ring1][C][C][S][C][=N][N][=N][N][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring2][Ring1][C][N][=Ring2][Ring1][#Branch1] | PCUJQZQIVUTHEA-UHFFFAOYSA-N | 5,7-dimethyl-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]imidazo[1,2-a]pyrimidine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1cc(C)n2cc(CSc3nnnn3-c3ccccc3)nc2n1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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N#CCCSCc1ccc(C(=O)O)o1 | 0 | N#CCCSCc1ccc(C(=O)O)o1 | [N][#C][C][C][S][C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][Ring1][Branch2] | KXHJJUBTIZNZRR-UHFFFAOYSA-N | 5-(2-cyanoethylsulfanylmethyl)furan-2-carboxylic acid | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES N#CCCSCc1ccc(C(=O)O)o1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccc(-n2c(SCC(=O)NCC3CCCO3)nc3nnc(C)c-3c2N)cc1Cl | 0 | Cc1ccc(-n2c(SCC(=O)NCC3CCCO3)nc3nnc(C)c-3c2N)cc1Cl | [C][C][=C][C][=C][Branch2][Ring2][Ring2][N][C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][O][Ring1][Branch1][=N][C][=N][N][=C][Branch1][C][C][C][Ring1][=Branch1][=C][Ring2][Ring1][Branch1][N][C][=C][Ring2][Ring1][N][Cl] | DYYONNGWKZZPJD-UHFFFAOYSA-N | 2-[4-azanyl-5-(3-chloranyl-4-methyl-phenyl)-3-methyl-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl-N-(oxolan-2-ylmethyl)ethanamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of Cc1ccc(-n2c(SCC(=O)NCC3CCCO3)nc3nnc(C)c-3c2N)cc1Cl is not a potentiator of the ER-alpha-coact. binding. |
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Cn1ccnc1SCC(=O)c1ccc(Br)cc1 | 0 | Cn1ccnc1SCC(=O)c1ccc(Br)cc1 | [C][N][C][=C][N][=C][Ring1][Branch1][S][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1] | CPHJFOQNOWEJIZ-UHFFFAOYSA-N | 1-(4-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanylethanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES Cn1ccnc1SCC(=O)c1ccc(Br)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccc(-n2nc(C)c3c(C)c(CCC(=O)NC(C)c4ccccc4)c(C)nc32)cc1 | 0 | Cc1ccc(-n2nc(C)c3c(C)c(CCC(=O)NC(C)c4ccccc4)c(C)nc32)cc1 | [C][C][=C][C][=C][Branch2][Ring2][#C][N][N][=C][Branch1][C][C][C][=C][Branch1][C][C][C][Branch2][Ring1][Ring2][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][C][C][N][=C][Ring2][Ring1][Branch1][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][#C] | HHCDBIRXEVPJTA-UHFFFAOYSA-N | N-(1-phenylethyl)-3-[3,4,6-trimethyl-1-(4-methylphenyl)pyrazolo[3,4-b]pyridin-5-yl]propanamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of Cc1ccc(-n2nc(C)c3c(C)c(CCC(=O)NC(C)c4ccccc4)c(C)nc32)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COCCn1c(SCc2nc(N)nc(Nc3ccccc3C)n2)nc2ccccc2c1=O | 0 | COCCn1c(SCc2nc(N)nc(Nc3ccccc3C)n2)nc2ccccc2c1=O | [C][O][C][C][N][C][Branch2][Ring1][#Branch2][S][C][C][=N][C][Branch1][C][N][=N][C][Branch1][O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][Ring1][#C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][O][=O] | XVUWBIQLJXAEPQ-UHFFFAOYSA-N | 2-[[4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(2-methoxyethyl)quinazolin-4-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of COCCn1c(SCc2nc(N)nc(Nc3ccccc3C)n2)nc2ccccc2c1=O is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOc1ccccc1NC(=O)Cn1c(=O)c2ccccc2n(CC)c1=O | 0 | CCOc1ccccc1NC(=O)Cn1c(=O)c2ccccc2n(CC)c1=O | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][Ring1][C][C][C][Ring1][=N][=O] | JKRXVSDHOJQGIA-UHFFFAOYSA-N | N-(2-ethoxyphenyl)-2-(1-ethyl-2,4-dioxoquinazolin-3-yl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES CCOc1ccccc1NC(=O)Cn1c(=O)c2ccccc2n(CC)c1=O is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccccc1SCC(=O)NC1CCOC1=O | 0 | Cc1ccccc1SCC(=O)NC1CCOC1=O | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][C][=Branch1][C][=O][N][C][C][C][O][C][Ring1][Branch1][=O] | FTZAWRDHKONPGZ-UHFFFAOYSA-N | 2-(2-methylphenyl)sulfanyl-N-(2-oxooxolan-3-yl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1ccccc1SCC(=O)NC1CCOC1=O is not a potentiator of the ER-alpha-coact. binding. |
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COc1cc(CNc2ccc3[nH]c(=O)[nH]c3c2)ccc1OCC(=O)NC(C)(C)C | 0 | COc1cc(CNc2ccc3[nH]c(=O)[nH]c3c2)ccc1OCC(=O)NC(C)(C)C | [C][O][C][=C][C][Branch2][Ring1][Ring1][C][N][C][=C][C][=C][NH1][C][=Branch1][C][=O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][=C][C][=C][Ring2][Ring1][C][O][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C] | NUMHPQZDFMJEDT-UHFFFAOYSA-N | N-tert-butyl-2-[2-methoxy-4-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]methyl]phenoxy]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of COc1cc(CNc2ccc3[nH]c(=O)[nH]c3c2)ccc1OCC(=O)NC(C)(C)C is not a potentiator of the ER-alpha-coact. binding. |
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N=c1cc(C2(O)CCCCC2)n2c(nc3ccccc32)s1 | 0 | N=c1cc(C2(O)CCCCC2)n2c(nc3ccccc32)s1 | [N][=C][C][=C][Branch1][N][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][N][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][S][Ring2][Ring1][Ring2] | FISPPCSHWOOUOA-UHFFFAOYSA-N | 1-(2-imino-[1,3]thiazino[3,2-a]benzimidazol-4-yl)cyclohexan-1-ol | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES representation of N=c1cc(C2(O)CCCCC2)n2c(nc3ccccc32)s1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COc1ccc(-n2nc3c(c2NC(=O)c2cc4ccccc4oc2=O)CS(=O)(=O)C3)cc1 | 0 | COc1ccc(-n2nc3c(c2NC(=O)c2cc4ccccc4oc2=O)CS(=O)(=O)C3)cc1 | [C][O][C][=C][C][=C][Branch2][Ring2][O][N][N][=C][C][=Branch2][Ring1][Branch2][=C][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][#Branch2][=O][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][=C] | NWWQNYMIZHUQHX-UHFFFAOYSA-N | N-[2-(4-methoxyphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-oxochromene-3-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES representation of COc1ccc(-n2nc3c(c2NC(=O)c2cc4ccccc4oc2=O)CS(=O)(=O)C3)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COc1ccc(S(=O)(=O)Cc2ccc(C(=O)NCc3ccco3)o2)cc1 | 0 | COc1ccc(S(=O)(=O)Cc2ccc(C(=O)NCc3ccco3)o2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][Branch1][=C][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][O][Ring1][=C][C][=C][Ring2][Ring1][Branch2] | IJLQDYKBTCEVRO-UHFFFAOYSA-N | N-(furan-2-ylmethyl)-5-[(4-methoxyphenyl)sulfonylmethyl]furan-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES COc1ccc(S(=O)(=O)Cc2ccc(C(=O)NCc3ccco3)o2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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O=C(NCc1cccc(F)c1)c1noc2c1CCCC2 | 0 | O=C(NCc1cccc(F)c1)c1noc2c1CCCC2 | [O][=C][Branch1][=C][N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=N][O][C][=C][Ring1][Branch1][C][C][C][C][Ring1][=Branch1] | BVTYOQPQPRDLOT-UHFFFAOYSA-N | N-[(3-fluorophenyl)methyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of O=C(NCc1cccc(F)c1)c1noc2c1CCCC2 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1cccc(CSc2ncnc3c2cnn3Cc2ccccc2)c1 | 0 | Cc1cccc(CSc2ncnc3c2cnn3Cc2ccccc2)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][S][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][Branch2] | MTTRZKBIMYHEMA-UHFFFAOYSA-N | 1-benzyl-4-[(3-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1cccc(CSc2ncnc3c2cnn3Cc2ccccc2)c1 is not a potentiator of the ER-alpha-coact. binding. |
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Cc1ccc2nsnc2c1S(=O)(=O)NCc1ccc2c(c1)OCO2 | 0 | Cc1ccc2nsnc2c1S(=O)(=O)NCc1ccc2c(c1)OCO2 | [C][C][C][=C][C][=N][S][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] | KHDOYHMYMFOYMM-UHFFFAOYSA-N | N-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2,1,3-benzothiadiazole-4-sulfonamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1ccc2nsnc2c1S(=O)(=O)NCc1ccc2c(c1)OCO2 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOC(=O)c1ccc2nc(NC(=O)c3ccco3)sc2c1 | 0 | CCOC(=O)c1ccc2nc(NC(=O)c3ccco3)sc2c1 | [C][C][O][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][S][C][Ring1][=N][=C][Ring1][P] | WOUSKEGPVJGDDQ-UHFFFAOYSA-N | ethyl 2-(furan-2-carbonylamino)-1,3-benzothiazole-6-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES CCOC(=O)c1ccc2nc(NC(=O)c3ccco3)sc2c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccc(-c2noc(-c3cccs3)n2)cc1 | 0 | Cc1ccc(-c2noc(-c3cccs3)n2)cc1 | [C][C][=C][C][=C][Branch1][P][C][=N][O][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][Ring1][#Branch2][C][=C][Ring1][S] | ZBIZYSIIJRBDSE-UHFFFAOYSA-N | 3-(4-methylphenyl)-5-thiophen-2-yl-1,2,4-oxadiazole | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES representation of Cc1ccc(-c2noc(-c3cccs3)n2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COC(=O)c1cccc(Oc2nc(N3CCOCC3)nc(N3CCOCC3)n2)c1 | 0 | COC(=O)c1cccc(Oc2nc(N3CCOCC3)nc(N3CCOCC3)n2)c1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][#C][O][C][=N][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch2] | KCHLRQLIBLVFFS-UHFFFAOYSA-N | methyl 3-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]benzoate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of COC(=O)c1cccc(Oc2nc(N3CCOCC3)nc(N3CCOCC3)n2)c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CSc1nc(N)nc(SCC(=O)c2ccccc2)c1C#N | 0 | CSc1nc(N)nc(SCC(=O)c2ccccc2)c1C#N | [C][S][C][=N][C][Branch1][C][N][=N][C][Branch1][#C][S][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][P][C][#N] | VDOHHHMFBNIKOC-UHFFFAOYSA-N | 2-amino-4-methylsulfanyl-6-phenacylsulfanylpyrimidine-5-carbonitrile | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of CSc1nc(N)nc(SCC(=O)c2ccccc2)c1C#N is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOc1ccc(N(CC(=O)NCC2CCCO2)S(=O)(=O)c2ccc(Cl)cc2)cc1 | 0 | CCOc1ccc(N(CC(=O)NCC2CCCO2)S(=O)(=O)c2ccc(Cl)cc2)cc1 | [C][C][O][C][=C][C][=C][Branch2][Ring2][Ring2][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][C][C][C][O][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][O] | SBUHMTXJRKSATP-UHFFFAOYSA-N | 2-(N-(4-chlorophenyl)sulfonyl-4-ethoxyanilino)-N-(oxolan-2-ylmethyl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of CCOc1ccc(N(CC(=O)NCC2CCCO2)S(=O)(=O)c2ccc(Cl)cc2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CC1=NN(c2nc(C)cc(C)n2)C(=O)C1CCC(C)C | 0 | CC1=NN(c2nc(C)cc(C)n2)C(=O)C1CCC(C)C | [C][C][=N][N][Branch1][#C][C][=N][C][Branch1][C][C][=C][C][Branch1][C][C][=N][Ring1][Branch2][C][=Branch1][C][=O][C][Ring1][=C][C][C][C][Branch1][C][C][C] | DRHYFFWNIXHTAG-UHFFFAOYSA-N | 2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-4-(3-methylbutyl)-4H-pyrazol-3-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CC1=NN(c2nc(C)cc(C)n2)C(=O)C1CCC(C)C is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccc2cc(CN(C(=O)c3ccco3)c3ccccc3C)c(=O)[nH]c2c1 | 0 | Cc1ccc2cc(CN(C(=O)c3ccco3)c3ccccc3C)c(=O)[nH]c2c1 | [C][C][=C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][NH1][C][Ring2][Ring1][#Branch1][=C][Ring2][Ring1][O] | HERBSDRNILRYIV-UHFFFAOYSA-N | N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)furan-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of Cc1ccc2cc(CN(C(=O)c3ccco3)c3ccccc3C)c(=O)[nH]c2c1 is not a potentiator of the ER-alpha-coact. binding. |
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CC1=C(C(=O)Nc2ccc(C)cc2)C(c2ccc(N(C)C)cc2)NC(=O)N1 | 0 | CC1=C(C(=O)Nc2ccc(C)cc2)C(c2ccc(N(C)C)cc2)NC(=O)N1 | [C][C][=C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][Ring1][=Branch2][N][C][=Branch1][C][=O][N][Ring2][Ring1][#Branch2] | KAWWQNSQXAXNEL-UHFFFAOYSA-N | 4-[4-(dimethylamino)phenyl]-6-methyl-N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES CC1=C(C(=O)Nc2ccc(C)cc2)C(c2ccc(N(C)C)cc2)NC(=O)N1 is not a potentiator of the ER-alpha-coact. binding. |
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OC(C#CCN1CCCC1)c1ccccc1 | 0 | OC(C#CCN1CCCC1)c1ccccc1 | [O][C][Branch1][O][C][#C][C][N][C][C][C][C][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] | UVFFBARLBVKJGA-UHFFFAOYSA-N | 1-phenyl-4-pyrrolidin-1-ylbut-2-yn-1-ol | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES OC(C#CCN1CCCC1)c1ccccc1 is not a potentiator of the ER-alpha-coact. binding. |
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Cn1cccc1Cc1nnc(SCC(=O)N2CCCCCC2)n1-c1ccc(F)cc1 | 0 | Cn1cccc1Cc1nnc(SCC(=O)N2CCCCCC2)n1-c1ccc(F)cc1 | [C][N][C][=C][C][=C][Ring1][Branch1][C][C][=N][N][=C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][#Branch1][N][Ring1][S][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | ANGYDAIXSOODOQ-UHFFFAOYSA-N | 1-(azepan-1-yl)-2-[[4-(4-fluorophenyl)-5-[(1-methylpyrrol-2-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cn1cccc1Cc1nnc(SCC(=O)N2CCCCCC2)n1-c1ccc(F)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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Cn1c(Cn2c(=O)sc3ccccc32)nnc1SCC(=O)Nc1ccccc1F | 0 | Cn1c(Cn2c(=O)sc3ccccc32)nnc1SCC(=O)Nc1ccccc1F | [C][N][C][Branch2][Ring1][C][C][N][C][=Branch1][C][=O][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=N][N][=C][Ring1][S][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F] | ZSPROEPHSAWFIA-UHFFFAOYSA-N | N-(2-fluorophenyl)-2-[[4-methyl-5-[(2-oxo-1,3-benzothiazol-3-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES Cn1c(Cn2c(=O)sc3ccccc32)nnc1SCC(=O)Nc1ccccc1F is not a potentiator of the ER-alpha-coact. binding. |
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CCCCN/C(C)=C1/C(=O)Oc2ccccc2C1=O | 0 | CCCCN/C(C)=C1/C(=O)Oc2ccccc2C1=O | [C][C][C][C][N][/C][Branch1][C][C][=C][/C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=O] | UCQKZPIGAIIJPJ-JLHYYAGUSA-N | (3E)-3-[1-(butylamino)ethylidene]chromene-2,4-dione | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of CCCCN/C(C)=C1/C(=O)Oc2ccccc2C1=O is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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C/C(=C\C(=O)c1ccncc1)Nc1ccccc1O | 0 | C/C(=C\C(=O)c1ccncc1)Nc1ccccc1O | [C][/C][=Branch1][=C][=C][\C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][O] | YDDSRCGSOWJCSI-ZHACJKMWSA-N | (E)-3-(2-hydroxyanilino)-1-pyridin-4-ylbut-2-en-1-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES C/C(=C\C(=O)c1ccncc1)Nc1ccccc1O is not a potentiator of the ER-alpha-coact. binding. |
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CN1CCN(S(=O)(=O)c2ccc(-c3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc2)CC1 | 0 | CN1CCN(S(=O)(=O)c2ccc(-c3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc2)CC1 | [C][N][C][C][N][Branch2][Ring2][P][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=C][C][=C][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][=C][Ring1][S][C][=C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][#C] | XWEXUIHEZHRDAR-UHFFFAOYSA-N | 1-methyl-4-[4-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]phenyl]sulfonylpiperazine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of CN1CCN(S(=O)(=O)c2ccc(-c3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cc2)CC1 is not a potentiator of the ER-alpha-coact. binding. |
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COc1cccc(NC(=O)CSc2nnc(COc3ccc4c(c3)CCCC4)o2)c1 | 0 | COc1cccc(NC(=O)CSc2nnc(COc3ccc4c(c3)CCCC4)o2)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch2][Ring1][Ring1][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][Ring1][#Branch1][O][Ring1][P][=C][Ring2][Ring1][N] | JYJBCYKFBWTYOR-UHFFFAOYSA-N | N-(3-methoxyphenyl)-2-[[5-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of COc1cccc(NC(=O)CSc2nnc(COc3ccc4c(c3)CCCC4)o2)c1 is not a potentiator of the ER-alpha-coact. binding. |
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COc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c(OC)c1 | 0 | COc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c(OC)c1 | [C][O][C][=C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][N][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][#C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=Branch2] | IBXYHPFFGXSCND-UHFFFAOYSA-N | [4-(benzenesulfonyl)piperazin-1-yl]-(2,4-dimethoxyphenyl)methanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of COc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c(OC)c1 is not a potentiator of the ER-alpha-coact. binding. |
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CCN(CC)C(=O)CSc1nc2ccccc2n1CC(=O)N1CCN(c2ccccc2OC)CC1 | 0 | CCN(CC)C(=O)CSc1nc2ccccc2n1CC(=O)N1CCN(c2ccccc2OC)CC1 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][S][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][=Branch1][C][=O][N][C][C][N][Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][Ring1][=C] | XQXVQURQRPNXJY-UHFFFAOYSA-N | N,N-diethyl-2-[1-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]benzimidazol-2-yl]sulfanylacetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of CCN(CC)C(=O)CSc1nc2ccccc2n1CC(=O)N1CCN(c2ccccc2OC)CC1 is not a potentiator of the ER-alpha-coact. binding. |
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O=C(Cn1cc(C(=O)c2cccs2)c2ccccc21)NC1CCCCC1 | 0 | O=C(Cn1cc(C(=O)c2cccs2)c2ccccc21)NC1CCCCC1 | [O][=C][Branch2][Ring1][N][C][N][C][=C][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S][N][C][C][C][C][C][C][Ring1][=Branch1] | WBYMZMFKVFPLLY-UHFFFAOYSA-N | N-cyclohexyl-2-[3-(thiophene-2-carbonyl)indol-1-yl]acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES O=C(Cn1cc(C(=O)c2cccs2)c2ccccc21)NC1CCCCC1 is not a potentiator of the ER-alpha-coact. binding. |
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COc1ccc(-n2nc3c(c2NC(=O)c2cc(Br)ccc2Cl)CS(=O)C3)cc1 | 0 | COc1ccc(-n2nc3c(c2NC(=O)c2cc(Br)ccc2Cl)CS(=O)C3)cc1 | [C][O][C][=C][C][=C][Branch2][Ring2][Branch1][N][N][=C][C][=Branch2][Ring1][Branch1][=C][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][Cl][C][S][=Branch1][C][=O][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][#Branch2] | LLYGPPQHRHVZFA-UHFFFAOYSA-N | 5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES COc1ccc(-n2nc3c(c2NC(=O)c2cc(Br)ccc2Cl)CS(=O)C3)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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O=C(c1ccco1)N(Cc1nc(=O)c2ccccc2[nH]1)C1CCCC1 | 0 | O=C(c1ccco1)N(Cc1nc(=O)c2ccccc2[nH]1)C1CCCC1 | [O][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][Branch2][Ring1][Ring1][C][C][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][O][C][C][C][C][C][Ring1][Branch1] | XLLSGPFZIUIDSS-UHFFFAOYSA-N | N-cyclopentyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]furan-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of O=C(c1ccco1)N(Cc1nc(=O)c2ccccc2[nH]1)C1CCCC1 is not a potentiator of the ER-alpha-coact. binding. |
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CCCOc1ccc(N2CC(C(=O)Nc3ccccc3C(=O)NCc3ccco3)CC2=O)cc1 | 0 | CCCOc1ccc(N2CC(C(=O)Nc3ccccc3C(=O)NCc3ccco3)CC2=O)cc1 | [C][C][C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][N][C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][C][C][Ring2][Ring1][#Branch1][=O][C][=C][Ring2][Ring1][=C] | RSYZHANGAAWRHR-UHFFFAOYSA-N | N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of CCCOc1ccc(N2CC(C(=O)Nc3ccccc3C(=O)NCc3ccco3)CC2=O)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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Cc1ccc(-c2nc(NCCN3CCOCC3)c3ccccc3n2)cc1 | 0 | Cc1ccc(-c2nc(NCCN3CCOCC3)c3ccccc3n2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=N][C][=N][C][Branch1][N][N][C][C][N][C][C][O][C][C][Ring1][=Branch1][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch2] | LBFQUIDVSVUBSY-UHFFFAOYSA-N | 2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES Cc1ccc(-c2nc(NCCN3CCOCC3)c3ccccc3n2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CN(C)C(=O)Cn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc2ccccc21 | 0 | CN(C)C(=O)Cn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc2ccccc21 | [C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][C][Branch2][Ring1][#Branch1][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][#Branch1] | BZWSKWAUZMURMR-UHFFFAOYSA-N | 2-[2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylbenzimidazol-1-yl]-N,N-dimethylacetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CN(C)C(=O)Cn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc2ccccc21 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCN1C(=O)c2cccc3c(NC(=O)C(C)(C)C)ccc1c23 | 0 | CCN1C(=O)c2cccc3c(NC(=O)C(C)(C)C)ccc1c23 | [C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][Ring2][Ring1][Ring1][=C][Ring1][P][Ring1][=N] | XIKIBVCKIITEPL-UHFFFAOYSA-N | N-(1-ethyl-2-oxobenzo[cd]indol-6-yl)-2,2-dimethylpropanamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of CCN1C(=O)c2cccc3c(NC(=O)C(C)(C)C)ccc1c23 is not a potentiator of the ER-alpha-coact. binding. |
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Cn1c(-c2ccc(Br)o2)nc2ccccc21 | 0 | Cn1c(-c2ccc(Br)o2)nc2ccccc21 | [C][N][C][Branch1][O][C][=C][C][=C][Branch1][C][Br][O][Ring1][=Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C] | UANYWSTWMGECJO-UHFFFAOYSA-N | 2-(5-bromofuran-2-yl)-1-methylbenzimidazole | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES representation of Cn1c(-c2ccc(Br)o2)nc2ccccc21 is not a potentiator of the ER-alpha-coact. binding. |
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CN(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 | 0 | CN(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 | [C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][O][Ring1][=Branch1][C][=C][Ring1][#C] | VEVFPAWOTCJJDY-UHFFFAOYSA-N | 5-bromo-N-[4-(dimethylsulfamoyl)phenyl]furan-2-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of CN(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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CCCCOc1ccc(-c2nc(=S)[nH][nH]2)cc1 | 0 | CCCCOc1ccc(-c2nc(=S)[nH][nH]2)cc1 | [C][C][C][C][O][C][=C][C][=C][Branch1][O][C][=N][C][=Branch1][C][=S][NH1][NH1][Ring1][=Branch1][C][=C][Ring1][N] | NFMIPYFWIZWEPH-UHFFFAOYSA-N | 5-(4-butoxyphenyl)-1,2-dihydro-1,2,4-triazole-3-thione | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CCCCOc1ccc(-c2nc(=S)[nH][nH]2)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COc1ccc(C(=O)N2CCCC2=O)cc1 | 0 | COc1ccc(C(=O)N2CCCC2=O)cc1 | [C][O][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][=O][C][=C][Ring1][=C] | ZXNRTKGTQJPIJK-UHFFFAOYSA-N | 1-(4-methoxybenzoyl)pyrrolidin-2-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES COc1ccc(C(=O)N2CCCC2=O)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COc1ccc(CCNC(=O)CCn2c(=O)oc3ccccc32)cc1 | 0 | COc1ccc(CCNC(=O)CCn2c(=O)oc3ccccc32)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=C][Ring2][Ring1][#Branch1] | HUUBPNBAKGHLPV-UHFFFAOYSA-N | N-[2-(4-methoxyphenyl)ethyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES COc1ccc(CCNC(=O)CCn2c(=O)oc3ccccc32)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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CC(=O)c1ccc(NC(=O)CCn2c(=O)oc3ccccc32)cc1 | 0 | CC(=O)c1ccc(NC(=O)CCn2c(=O)oc3ccccc32)cc1 | [C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch1] | DCBHKZUKOFLJDR-UHFFFAOYSA-N | N-(4-acetylphenyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES CC(=O)c1ccc(NC(=O)CCn2c(=O)oc3ccccc32)cc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1cc(NC(=O)c2cc(-c3ccncc3)nc3c(C)cccc23)no1 | 0 | Cc1cc(NC(=O)c2cc(-c3ccncc3)nc3c(C)cccc23)no1 | [C][C][=C][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][P][Ring1][#Branch1][=N][O][Ring2][Ring1][=Branch2] | PIDNBKLJZIQIGV-UHFFFAOYSA-N | 8-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-4-ylquinoline-4-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES Cc1cc(NC(=O)c2cc(-c3ccncc3)nc3c(C)cccc23)no1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCc1ccc2oc(=O)cc(CN3CCOCC3)c2c1 | 0 | CCc1ccc2oc(=O)cc(CN3CCOCC3)c2c1 | [C][C][C][=C][C][=C][O][C][=Branch1][C][=O][C][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=C][=C][Ring2][Ring1][C] | CCIWVBOXYCTYKE-UHFFFAOYSA-N | 6-ethyl-4-(morpholin-4-ylmethyl)chromen-2-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES CCc1ccc2oc(=O)cc(CN3CCOCC3)c2c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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O=C(c1cc2ccccc2o1)N1CCN=C1SCc1cccc(F)c1 | 0 | O=C(c1cc2ccccc2o1)N1CCN=C1SCc1cccc(F)c1 | [O][=C][Branch1][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][N][C][C][N][=C][Ring1][Branch1][S][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1] | ODZKUKJPPKDHMW-UHFFFAOYSA-N | 1-benzofuran-2-yl-[2-[(3-fluorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES O=C(c1cc2ccccc2o1)N1CCN=C1SCc1cccc(F)c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOC(=O)N1CCN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC1 | 0 | CCOC(=O)N1CCN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC1 | [C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O][C][Ring1][O][=O][C][C][Ring2][Ring1][Ring2] | QCMRKWYQWVJQJC-UHFFFAOYSA-N | ethyl 4-(6-bromo-2-oxochromene-3-carbonyl)piperazine-1-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CCOC(=O)N1CCN(C(=O)c2cc3cc(Br)ccc3oc2=O)CC1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1cccc(-c2nnc(SCC(=O)Nc3ccnn3C(C)C)n2C)c1 | 0 | Cc1cccc(-c2nnc(SCC(=O)Nc3ccnn3C(C)C)n2C)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][S][C][=N][N][=C][Branch2][Ring1][Ring2][S][C][C][=Branch1][C][=O][N][C][=C][C][=N][N][Ring1][Branch1][C][Branch1][C][C][C][N][Ring2][Ring1][C][C][=C][Ring2][Ring1][=Branch2] | BSVSUKRYLFPDEG-UHFFFAOYSA-N | 2-[[4-methyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES Cc1cccc(-c2nnc(SCC(=O)Nc3ccnn3C(C)C)n2C)c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CC(C)c1cc(NC(=O)CSc2nnc(-c3ccccc3F)n2C)on1 | 0 | CC(C)c1cc(NC(=O)CSc2nnc(-c3ccccc3F)n2C)on1 | [C][C][Branch1][C][C][C][C][=C][Branch2][Ring1][O][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][Ring1][N][C][O][N][=Ring2][Ring1][#Branch1] | UKUQIMQQLOIUKG-UHFFFAOYSA-N | 2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES CC(C)c1cc(NC(=O)CSc2nnc(-c3ccccc3F)n2C)on1 is not a potentiator of the ER-alpha-coact. binding. |
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COc1ccc(Br)cc1C(=O)Nc1cccc(-c2nnc(-c3ccco3)o2)c1 | 0 | COc1ccc(Br)cc1C(=O)Nc1cccc(-c2nnc(-c3ccco3)o2)c1 | [C][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][P][C][=N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][O][Ring1][#Branch2][=C][Ring1][S] | RWHUUAMFWJFHDE-UHFFFAOYSA-N | 5-bromo-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-methoxybenzamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of COc1ccc(Br)cc1C(=O)Nc1cccc(-c2nnc(-c3ccco3)o2)c1 is not a potentiator of the ER-alpha-coact. binding. |
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O=C1C2CC=CCC2C(=O)N1Cc1ccccc1 | 0 | O=C1C2CC=CCC2C(=O)N1Cc1ccccc1 | [O][=C][C][C][C][=C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | KQVNCFJZEZPYOS-UHFFFAOYSA-N | 2-benzyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES O=C1C2CC=CCC2C(=O)N1Cc1ccccc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOC(=O)C1CCN(C(=O)COC(=O)c2ccc(Br)o2)CC1 | 0 | CCOC(=O)C1CCN(C(=O)COC(=O)c2ccc(Br)o2)CC1 | [C][C][O][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][O][Ring1][=Branch1][C][C][Ring2][Ring1][C] | ITZBQNNEYXRWDJ-UHFFFAOYSA-N | ethyl 1-[2-(5-bromofuran-2-carbonyl)oxyacetyl]piperidine-4-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES CCOC(=O)C1CCN(C(=O)COC(=O)c2ccc(Br)o2)CC1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(OCC(=O)N2CCCCC2)cc1 | 0 | CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(OCC(=O)N2CCCCC2)cc1 | [C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][Ring1][Branch2][C][=C][C][=C][Branch1][#C][O][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][S] | RLKDUHHGKFXPRK-UHFFFAOYSA-N | ethyl 6-methyl-2-oxo-4-[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(OCC(=O)N2CCCCC2)cc1 is not a potentiator of the ER-alpha-coact. binding. |
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O=[N+]([O-])/C(=C\Nc1ccccc1)S(=O)(=O)c1ccccc1 | 0 | O=[N+]([O-])/C(=C\Nc1ccccc1)S(=O)(=O)c1ccccc1 | [O][=N+1][Branch1][C][O-1][/C][=Branch1][O][=C][\N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1] | TWLXXTZSFWTEKB-SDNWHVSQSA-N | N-[(E)-2-(benzenesulfonyl)-2-nitroethenyl]aniline | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES representation of O=[N+]([O-])/C(=C\Nc1ccccc1)S(=O)(=O)c1ccccc1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1ccccc1-c1nnn(CC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1 | 0 | Cc1ccccc1-c1nnn(CC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=N][N][Branch2][Ring1][=C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=C][Ring1][=C][N][=Ring2][Ring1][=Branch1] | VGARZXOLYWJUPT-UHFFFAOYSA-N | 2-[5-(2-methylphenyl)tetrazol-2-yl]-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES Cc1ccccc1-c1nnn(CC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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O=C(c1ccccc1)N1CCN(CC#CC2(O)CCCCC2)CC1 | 0 | O=C(c1ccccc1)N1CCN(CC#CC2(O)CCCCC2)CC1 | [O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch1][#C][C][C][#C][C][Branch1][C][O][C][C][C][C][C][Ring1][#Branch1][C][C][Ring1][S] | FMNNHWMRDFJLSD-UHFFFAOYSA-N | [4-[3-(1-hydroxycyclohexyl)prop-2-ynyl]piperazin-1-yl]-phenylmethanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of O=C(c1ccccc1)N1CCN(CC#CC2(O)CCCCC2)CC1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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COC(=O)c1cc(Br)c(=O)n(CCN(C(C)C)C(C)C)c1 | 0 | COC(=O)c1cc(Br)c(=O)n(CCN(C(C)C)C(C)C)c1 | [C][O][C][=Branch1][C][=O][C][C][=C][Branch1][C][Br][C][=Branch1][C][=O][N][Branch1][S][C][C][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C][C][=Ring1][P] | AISWMQDPEPWOTN-UHFFFAOYSA-N | methyl 5-bromo-1-[2-[di(propan-2-yl)amino]ethyl]-6-oxopyridine-3-carboxylate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecule with the SMILES COC(=O)c1cc(Br)c(=O)n(CCN(C(C)C)C(C)C)c1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)C1COc2ccccc2O1 | 0 | O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)C1COc2ccccc2O1 | [O][=C][Branch2][Ring1][N][N][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][S][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#Branch2] | HKOTYAKEPYZKHN-UHFFFAOYSA-N | N-[4-(phenylsulfamoyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)C1COc2ccccc2O1 is not a potentiator of the ER-alpha-coact. binding. |
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Cc1c(O)ccc(C(=O)COc2ccccc2F)c1O | 0 | Cc1c(O)ccc(C(=O)COc2ccccc2F)c1O | [C][C][=C][Branch1][C][O][C][=C][C][Branch1][S][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=C][Ring2][Ring1][C][O] | ZYCMWPLATLINDX-UHFFFAOYSA-N | 1-(2,4-dihydroxy-3-methylphenyl)-2-(2-fluorophenoxy)ethanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES Cc1c(O)ccc(C(=O)COc2ccccc2F)c1O is not a potentiator of the ER-alpha-coact. binding. |
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Cn1ccnc1SCc1cn2cc(Br)ccc2n1 | 0 | Cn1ccnc1SCc1cn2cc(Br)ccc2n1 | [C][N][C][=C][N][=C][Ring1][Branch1][S][C][C][=C][N][C][=C][Branch1][C][Br][C][=C][C][Ring1][#Branch1][=N][Ring1][#Branch2] | AXCWVBQRHXIMPN-UHFFFAOYSA-N | 6-bromo-2-[(1-methylimidazol-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The compound with the SMILES Cn1ccnc1SCc1cn2cc(Br)ccc2n1 is not a potentiator of the ER-alpha-coact. binding. |
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CCOC(=O)C(C(=O)Nc1cccc(C)n1)C1CCCCC1 | 0 | CCOC(=O)C(C(=O)Nc1cccc(C)n1)C1CCCCC1 | [C][C][O][C][=Branch1][C][=O][C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C][C][C][C][C][C][Ring1][=Branch1] | CJWKXSUBMNHABH-UHFFFAOYSA-N | ethyl 2-cyclohexyl-3-[(6-methylpyridin-2-yl)amino]-3-oxopropanoate | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The molecular species with the SMILES representation of CCOC(=O)C(C(=O)Nc1cccc(C)n1)C1CCCCC1 is not a potentiator of the ER-alpha-coact. binding. |
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C=CCN1C(=O)C(Cc2ccc(OC)cc2)S/C1=N\N=C\c1cccs1 | 0 | C=CCN1C(=O)C(Cc2ccc(OC)cc2)S/C1=N\N=C\c1cccs1 | [C][=C][C][N][C][=Branch1][C][=O][C][Branch1][=C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][S][/C][Ring1][#C][=N][\N][=C][\C][=C][C][=C][S][Ring1][Branch1] | YQBJJSPHFYJNRJ-OYLDMMOPSA-N | (2Z)-5-[(4-methoxyphenyl)methyl]-3-prop-2-enyl-2-[(E)-thiophen-2-ylmethylidenehydrazinylidene]-1,3-thiazolidin-4-one | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical compound with the SMILES C=CCN1C(=O)C(Cc2ccc(OC)cc2)S/C1=N\N=C\c1cccs1 is not a potentiator of the ER-alpha-coact. binding. |
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CS(=O)(=O)N1CCN(C(=O)c2cc(-c3ccncc3)nc3ccc(Cl)cc23)CC1 | 0 | CS(=O)(=O)N1CCN(C(=O)c2cc(-c3ccncc3)nc3ccc(Cl)cc23)CC1 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][S][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][P][Ring1][#Branch1][C][C][Ring2][Ring1][=Branch2] | IFKBEFPQEZBSBY-UHFFFAOYSA-N | (6-chloro-2-pyridin-4-ylquinolin-4-yl)-(4-methylsulfonylpiperazin-1-yl)methanone | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES CS(=O)(=O)N1CCN(C(=O)c2cc(-c3ccncc3)nc3ccc(Cl)cc23)CC1 is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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Cc1nc2ccccn2c1C(=O)N/N=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C | 0 | Cc1nc2ccccn2c1C(=O)N/N=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C | [C][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][C][=Ring1][=Branch2][C][=Branch1][C][=O][N][/N][=C][/C][C][=C][Branch1][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Ring1][=N][C] | ZOCNZYYEEUHHLV-ZMOGYAJESA-N | N-[(E)-[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-methylimidazo[1,2-a]pyridine-3-carboxamide | The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} is {MUV-737#not &NULL}{MUV-737__names__noun}. | The chemical with the SMILES representation of Cc1nc2ccccn2c1C(=O)N/N=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C is not a potentiator of the estrogen receptor-alpha-coactivator binding. |
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