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Name | CHEMBL2331646 |
---|---|
Molecular formula | C22H29N5O2 |
IUPAC name | 2-(ethylamino)-6-[3-(4-propan-2-ylphenyl)propanoyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-4-carboxamide |
Molecular weight | 395.507 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 2.5 |
Synonyms | BDBM50428095 |
Inchi Key | BXJNYBTXBRHAEU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H29N5O2/c1-4-24-22-25-18-11-12-27(13-17(18)20(26-22)21(23)29)19(28)10-7-15-5-8-16(9-6-15)14(2)3/h5-6,8-9,14H,4,7,10-13H2,1-3H3,(H2,23,29)(H,24,25,26) |
PubChem CID | 71541719 |
ChEMBL | CHEMBL2331646 |
IUPHAR | N/A |
BindingDB | 50428095 |
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 |
---|---|---|---|---|---|
35136 | G-protein coupled bile acid receptor 1 | Q8TDU6 | GPBAR1 | Homo sapiens (Human) | 330 |
35137 | G-protein coupled bile acid receptor 1 | Q80SS6 | Gpbar1 | Mus musculus (Mouse) | 329 |
35138 | G-protein coupled bile acid receptor 1 | Q80T02 | Gpbar1 | Rattus norvegicus (Rat) | 329 |
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