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Name | CHEMBL3896466 |
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Molecular formula | C26H27F3N2O3 |
IUPAC name | 4-[1-[[6-[[3-(trifluoromethyl)phenyl]methyl]-6-azaspiro[2.5]octane-7-carbonyl]amino]cyclopropyl]benzoic acid |
Molecular weight | 472.508 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 2.6 |
Synonyms | US9181279, E9 AUYTYEPFKREYLH-UHFFFAOYSA-N BDBM191549 SCHEMBL14486697 4-(1-(6-(3-(trifluoromethyl)benzyl)-6-azaspiro[2.5]octane-5-carboxamido)cyclopropyl)benzoic acid |
Inchi Key | AUYTYEPFKREYLH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H27F3N2O3/c27-26(28,29)20-3-1-2-17(14-20)16-31-13-12-24(8-9-24)15-21(31)22(32)30-25(10-11-25)19-6-4-18(5-7-19)23(33)34/h1-7,14,21H,8-13,15-16H2,(H,30,32)(H,33,34) |
PubChem CID | 71186491 |
ChEMBL | CHEMBL3896466 |
IUPHAR | N/A |
BindingDB | 191549 |
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 |
---|---|---|---|---|---|
536377 | Prostaglandin E2 receptor EP4 subtype | P35408 | PTGER4 | Homo sapiens (Human) | 488 |
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