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Name | CHEMBL3953493 |
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Molecular formula | C25H25F3N2O3 |
IUPAC name | 4-[1-[[3-[[4-(trifluoromethyl)phenyl]methyl]-3-azabicyclo[4.1.0]heptane-4-carbonyl]amino]cyclopropyl]benzoic acid |
Molecular weight | 458.481 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 1.9 |
Synonyms | US9181279, E23 BDBM191557 BEUQPJMSVYNQEM-UHFFFAOYSA-N SCHEMBL14486373 4-(1-(3-(4-(trifluoromethyl)benzyl)-3-azabicyclo[4.1.0]heptane-4-carboxamido)cyclopropyl)benzoic acid |
Inchi Key | BEUQPJMSVYNQEM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H25F3N2O3/c26-25(27,28)20-5-1-15(2-6-20)13-30-14-18-11-17(18)12-21(30)22(31)29-24(9-10-24)19-7-3-16(4-8-19)23(32)33/h1-8,17-18,21H,9-14H2,(H,29,31)(H,32,33) |
PubChem CID | 71186249 |
ChEMBL | CHEMBL3953493 |
IUPHAR | N/A |
BindingDB | 191557 |
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 |
---|---|---|---|---|---|
536535 | Prostaglandin E2 receptor EP4 subtype | P35408 | PTGER4 | Homo sapiens (Human) | 488 |
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