| PDB CCD ID: | MUO |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C22 H24 O4 S |
| InChI: | InChI=1S/C22H24O4S/c1-14-12-16(13-15(2)20(14)26-22(3,4)21(24)25)6-11-19(23)17-7-9-18(27-5)10-8-17/h6-13H,1-5H3,(H,24,25)/b11-6+ |
| InChIKey: | AFLFKFHDSCQHOL-IZZDOVSWSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | CSc1ccc(cc1)C(=O)/C=C/c2cc(C)c(OC(C)(C)C(O)=O)c(C)c2 | | OpenEye OEToolkits 2.0.7 | Cc1cc(cc(c1OC(C)(C)C(=O)O)C)C=CC(=O)c2ccc(cc2)SC | | CACTVS 3.385 | CSc1ccc(cc1)C(=O)C=Cc2cc(C)c(OC(C)(C)C(O)=O)c(C)c2 | | OpenEye OEToolkits 2.0.7 | Cc1cc(cc(c1OC(C)(C)C(=O)O)C)/C=C/C(=O)c2ccc(cc2)SC |
|
| Name: | 2-[2,6-dimethyl-4-[(~{E})-3-(4-methylsulfanylphenyl)-3-oxidanylidene-prop-1-enyl]phenoxy]-2-methyl-propanoic acid;
elafibranor |
| ChEMBL: | CHEMBL3707395 |
| DrugBank: | DB05187 |
| ZINC: | ZINC000114643710 |
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