General Property |
Molceule ID (DB) | EGIN0000366 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 1f compound |
IUPAC Name | 5-methoxy-8-nitroquinazolin-4-ol |
Formula | C9H7N3O4 |
Mass | 221.1696 |
Exact Mass | 221.0436557 |
Composition | C (48.87%), H (3.19%), N (19%), O (28.94%) |
Atom Count | 23 |
PI | 4.9 |
Smiles | c12c(c(ccc1OC)N(=O)=O)ncnc2O |
InChI | 1S/C9H7N3O4/c1-16-6-3-2-5(12(14)15)8-7(6)9(13)11-4-10-8/h2-4H,1H3,(H,10,11,13) |
InChIKey | PUSCEDGMZSHSHY-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 15993078 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 23335065 |
ChEMBL Link | CHEMBL445167 |