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Name | CHEMBL3889508 |
---|---|
Molecular formula | C23H33NO7S |
IUPAC name | (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4-phenoxybut-1-enyl]cyclopentyl]-N-methylsulfonylhept-5-enamide |
Molecular weight | 467.577 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 4 |
XlogP | 1.4 |
Synonyms | BDBM50206016 |
Inchi Key | HOLXELUFBALNSM-CNAXQHPCSA-N |
Inchi ID | InChI=1S/C23H33NO7S/c1-32(29,30)24-23(28)12-8-3-2-7-11-19-20(22(27)15-21(19)26)14-13-17(25)16-31-18-9-5-4-6-10-18/h2,4-7,9-10,13-14,17,19-22,25-27H,3,8,11-12,15-16H2,1H3,(H,24,28)/b7-2-,14-13+/t17-,19-,20-,21+,22-/m1/s1 |
PubChem CID | 14429703 |
ChEMBL | CHEMBL3889508 |
IUPHAR | N/A |
BindingDB | 50206016 |
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 |
---|---|---|---|---|---|
549339 | Prostacyclin receptor | P43119 | PTGIR | Homo sapiens (Human) | 386 |
549338 | Prostaglandin E2 receptor EP3 subtype | P43115 | PTGER3 | Homo sapiens (Human) | 390 |
549337 | Prostaglandin F2-alpha receptor | P43088 | PTGFR | Homo sapiens (Human) | 359 |
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