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Name | CHEMBL1774893 |
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Molecular formula | C22H13F3O3S |
IUPAC name | 4-thiophen-3-yl-7-[4-(trifluoromethoxy)phenyl]naphthalene-2-carboxylic acid |
Molecular weight | 414.398 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 6.8 |
Synonyms | BDBM50343878 SCHEMBL2927195 4-(thiophen-3-yl)-7-(4-(trifluoromethoxy)phenyl)-2-naphthoic acid |
Inchi Key | GKGGDVCJQYSQAU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H13F3O3S/c23-22(24,25)28-18-4-1-13(2-5-18)14-3-6-19-16(9-14)10-17(21(26)27)11-20(19)15-7-8-29-12-15/h1-12H,(H,26,27) |
PubChem CID | 42630806 |
ChEMBL | CHEMBL1774893 |
IUPHAR | N/A |
BindingDB | 50343878 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
98606 | P2Y purinoceptor 14 | Q9ESG6 | P2ry14 | Mus musculus (Mouse) | 338 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417