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Name | SCHEMBL6117837 |
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Molecular formula | C21H17NO4 |
IUPAC name | 3-[[2-(furan-3-yl)-5-methoxyindol-1-yl]methyl]benzoic acid |
Molecular weight | 347.37 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 3.8 |
Synonyms | BDBM119458 US8680120, 9-32 CHEMBL3665552 |
Inchi Key | JCCLVIMVFWCORQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H17NO4/c1-25-18-5-6-19-17(10-18)11-20(16-7-8-26-13-16)22(19)12-14-3-2-4-15(9-14)21(23)24/h2-11,13H,12H2,1H3,(H,23,24) |
PubChem CID | 50907865 |
ChEMBL | CHEMBL3665552 |
IUPHAR | N/A |
BindingDB | 119458 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
147277 | Prostaglandin E2 receptor EP1 subtype | P70597 | Ptger1 | Rattus norvegicus (Rat) | 405 |
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