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Name | BDBM50437883 |
---|---|
Molecular formula | C22H21BrN2O2 |
IUPAC name | 5-[3-(4-bromophenyl)-3-(2-methylphenyl)-1-nitrosopropyl]-1-methylpyridin-2-one |
Molecular weight | 425.326 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 4.1 |
Synonyms | N/A |
Inchi Key | JCNNMOCPEWZLCZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H21BrN2O2/c1-15-5-3-4-6-19(15)20(16-7-10-18(23)11-8-16)13-21(24-27)17-9-12-22(26)25(2)14-17/h3-12,14,20-21H,13H2,1-2H3 |
PubChem CID | 91898730 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50437883 |
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 |
---|---|---|---|---|---|
147593 | G-protein coupled bile acid receptor 1 | Q8TDU6 | GPBAR1 | Homo sapiens (Human) | 330 |
147594 | G-protein coupled bile acid receptor 1 | Q80SS6 | Gpbar1 | Mus musculus (Mouse) | 329 |
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