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Name | BDBM50437881 |
---|---|
Molecular formula | C24H24N2O3 |
IUPAC name | 2-[4-[1-(2-methylphenyl)-3-(2-methylpyridin-4-yl)-3-nitrosopropyl]phenyl]acetic acid |
Molecular weight | 388.467 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | N/A |
Inchi Key | GGSCWSOJUPJACO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H24N2O3/c1-16-5-3-4-6-21(16)22(19-9-7-18(8-10-19)14-24(27)28)15-23(26-29)20-11-12-25-17(2)13-20/h3-13,22-23H,14-15H2,1-2H3,(H,27,28) |
PubChem CID | 91898728 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50437881 |
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 |
---|---|---|---|---|---|
95983 | G-protein coupled bile acid receptor 1 | Q8TDU6 | GPBAR1 | Homo sapiens (Human) | 330 |
95984 | G-protein coupled bile acid receptor 1 | Q80SS6 | Gpbar1 | Mus musculus (Mouse) | 329 |
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