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Name | CHEMBL2181226 |
---|---|
Molecular formula | C25H25N3O2 |
IUPAC name | (4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[4-(2,5-dimethylphenoxy)pyridin-3-yl]methanone |
Molecular weight | 399.494 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 4.6 |
Synonyms | ZINC95573321 BDBM50399966 (4-Cyclopropyl-3,4-dihydro-1(2H)-quinoxalinyl)[4-(2,5-dimethylphenoxy)-3-pyridinyl]methanone MolPort-039-052-194 AKOS025293488 [ Show all ] |
Inchi Key | JQULIQJSYPZQMA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H25N3O2/c1-17-7-8-18(2)24(15-17)30-23-11-12-26-16-20(23)25(29)28-14-13-27(19-9-10-19)21-5-3-4-6-22(21)28/h3-8,11-12,15-16,19H,9-10,13-14H2,1-2H3 |
PubChem CID | 71450251 |
ChEMBL | CHEMBL2181226 |
IUPHAR | N/A |
BindingDB | 50399966 |
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 |
---|---|---|---|---|---|
157629 | G-protein coupled bile acid receptor 1 | Q80SS6 | Gpbar1 | Mus musculus (Mouse) | 329 |
157630 | G-protein coupled bile acid receptor 1 | Q8TDU6 | GPBAR1 | Homo sapiens (Human) | 330 |
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