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Name | CHEMBL185484 |
---|---|
Molecular formula | C26H35F3O6 |
IUPAC name | propan-2-yl (E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoate |
Molecular weight | 500.555 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 3 |
XlogP | 4.1 |
Synonyms | AC1O5PGZ (E)-7-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(E)-3-hydroxy-4-(3-trifluoromethyl-phenoxy)-but-1-enyl]-cyclopentyl}-hept-5-enoic acid isopropyl ester SCHEMBL11907124 BDBM50150906 NCGC00181317-01 [ Show all ] |
Inchi Key | MKPLKVHSHYCHOC-ZRUANHCFSA-N |
Inchi ID | InChI=1S/C26H35F3O6/c1-17(2)35-25(33)11-6-4-3-5-10-21-22(24(32)15-23(21)31)13-12-19(30)16-34-20-9-7-8-18(14-20)26(27,28)29/h3,5,7-9,12-14,17,19,21-24,30-32H,4,6,10-11,15-16H2,1-2H3/b5-3+,13-12+/t19?,21-,22-,23+,24-/m1/s1 |
PubChem CID | 6438324 |
ChEMBL | CHEMBL185484 |
IUPHAR | N/A |
BindingDB | 50150906 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
207788 | Prostaglandin F2-alpha receptor | P37289 | PTGFR | Bos taurus (Bovine) | 362 |
207789 | Prostaglandin F2-alpha receptor | P43088 | PTGFR | Homo sapiens (Human) | 359 |
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