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Name | 99946-24-4 |
---|---|
Molecular formula | C21H34O4 |
IUPAC name | 5-[5-hydroxy-6-(3-hydroxyoct-1-enyl)-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid |
Molecular weight | 350.499 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 3.4 |
Synonyms | 2-Pentalenepentanoicacid, 1,3a,4,5,6,6a-hexahydro-5-hydroxy-6-(3-hydroxy-1-octen-1-yl)- CTK3I7219 |
Inchi Key | JANVYOZZTKSZGN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H34O4/c1-2-3-4-8-17(22)10-11-18-19-13-15(7-5-6-9-21(24)25)12-16(19)14-20(18)23/h10-12,16-20,22-23H,2-9,13-14H2,1H3,(H,24,25) |
PubChem CID | 122007 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 85186 |
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 |
---|---|---|---|---|---|
146094 | Prostaglandin E2 receptor EP2 subtype | Q62053 | Ptger2 | Mus musculus (Mouse) | 362 |
556034 | Prostaglandin E2 receptor EP3 subtype | P30557 | Ptger3 | Mus musculus (Mouse) | 365 |
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