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Name | CHEMBL597785 |
---|---|
Molecular formula | C29H29F4NO4 |
IUPAC name | 3-[2-[[1-[3-fluoro-5-(trifluoromethyl)phenyl]-3-methylbutyl]carbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid |
Molecular weight | 531.548 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 6.6 |
Synonyms | BDBM50307432 SCHEMBL2976046 3-[2-[({1-[3-Fluoro-5-(trifluoromethyl)phenyl]-3-methylbutyl}amino)carbonyl]-4-(phenoxymethyl)phenyl]propanoic acid |
Inchi Key | BCWGHIPBCVXSKW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H29F4NO4/c1-18(2)12-26(21-14-22(29(31,32)33)16-23(30)15-21)34-28(37)25-13-19(8-9-20(25)10-11-27(35)36)17-38-24-6-4-3-5-7-24/h3-9,13-16,18,26H,10-12,17H2,1-2H3,(H,34,37)(H,35,36) |
PubChem CID | 23017669 |
ChEMBL | CHEMBL597785 |
IUPHAR | N/A |
BindingDB | 50307432 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
20592 | Prostaglandin E2 receptor EP3 subtype | P30557 | Ptger3 | Mus musculus (Mouse) | 365 |
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