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Name | CHEMBL3290706 |
---|---|
Molecular formula | C25H21N3O3 |
IUPAC name | [4-(1-benzofuran-5-yloxy)pyridin-3-yl]-(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)methanone |
Molecular weight | 411.461 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 4.3 |
Synonyms | BDBM50019494 |
Inchi Key | KYBOAWZHMHJXLA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H21N3O3/c29-25(28-13-12-27(18-5-6-18)21-3-1-2-4-22(21)28)20-16-26-11-9-24(20)31-19-7-8-23-17(15-19)10-14-30-23/h1-4,7-11,14-16,18H,5-6,12-13H2 |
PubChem CID | 71626492 |
ChEMBL | CHEMBL3290706 |
IUPHAR | N/A |
BindingDB | 50019494 |
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 |
---|---|---|---|---|---|
180951 | G-protein coupled bile acid receptor 1 | Q8TDU6 | GPBAR1 | Homo sapiens (Human) | 330 |
180952 | G-protein coupled bile acid receptor 1 | Q80SS6 | Gpbar1 | Mus musculus (Mouse) | 329 |
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