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Name | CHEMBL3904360 |
---|---|
Molecular formula | C28H26FNO5 |
IUPAC name | 2-[3-[2-(3,4-dihydro-2H-chromene-4-carbonyl)-5-fluoro-3,4-dihydro-1H-isoquinolin-8-yl]-4-methoxyphenyl]acetic acid |
Molecular weight | 475.516 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | BDBM205803 SCHEMBL15056462 US9255090, 272 |
Inchi Key | ACKUAISWFUWYKG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H26FNO5/c1-34-25-9-6-17(15-27(31)32)14-22(25)18-7-8-24(29)19-10-12-30(16-23(18)19)28(33)21-11-13-35-26-5-3-2-4-20(21)26/h2-9,14,21H,10-13,15-16H2,1H3,(H,31,32) |
PubChem CID | 89648921 |
ChEMBL | CHEMBL3904360 |
IUPHAR | N/A |
BindingDB | 205803 |
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 |
---|---|---|---|---|---|
535960 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
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