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Name | SMR000154711 |
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Molecular formula | C23H22N2O4S |
IUPAC name | 2-[(7,8-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one |
Molecular weight | 422.499 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.3 |
Synonyms | CHEMBL1438530 Z17970299 2-{[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]sulfanyl}-3-(3-hydroxypropyl)-3,4-dihydroquinazolin-4-one MLS000568580 AKOS033592364 [ Show all ] |
Inchi Key | AFXFBLLMQINSEP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H22N2O4S/c1-14-8-9-17-16(12-20(27)29-21(17)15(14)2)13-30-23-24-19-7-4-3-6-18(19)22(28)25(23)10-5-11-26/h3-4,6-9,12,26H,5,10-11,13H2,1-2H3 |
PubChem CID | 2575417 |
ChEMBL | CHEMBL1438530 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
4585 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
4586 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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