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Name | CHEMBL1771236 |
---|---|
Molecular formula | C27H25N5OS |
IUPAC name | 4-(2-methylphenyl)-N-(3-methylsulfanylphenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide |
Molecular weight | 467.591 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | BDBM50343101 N-(3-(methylthio)phenyl)-2-(pyridin-3-yl)-4-o-tolyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide SCHEMBL13246206 |
Inchi Key | WOSIYTYNKICHOR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H25N5OS/c1-18-7-3-4-11-22(18)25-23-17-32(27(33)29-20-9-5-10-21(15-20)34-2)14-12-24(23)30-26(31-25)19-8-6-13-28-16-19/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,29,33) |
PubChem CID | 54583515 |
ChEMBL | CHEMBL1771236 |
IUPHAR | N/A |
BindingDB | 50343101 |
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 |
---|---|---|---|---|---|
378610 | P2Y purinoceptor 14 | Q9ESG6 | P2ry14 | Mus musculus (Mouse) | 338 |
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