| General Property |
| Molceule ID (DB) | EGIN0001577 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 50 compound |
| IUPAC Name | N-(2H-1,3-benzodioxol-5-yl)-8-methylquinazolin-4-amine |
| Formula | C16H13N3O2 |
| Mass | 279.2933 |
| Exact Mass | 279.1007767 |
| Composition | C (68.81%), H (4.69%), N (15.05%), O (11.46%) |
| Atom Count | 34 |
| PI | 10.16 |
| Smiles | c12c(c(ccc1)C)ncnc2Nc1ccc2c(c1)OCO2 |
| InChI | 1S/C16H13N3O2/c1-10-3-2-4-12-15(10)17-8-18-16(12)19-11-5-6-13-14(7-11)21-9-20-13/h2-8H,9H2,1H3,(H,17
,18,19) |
| InChIKey | LLKVAJNWEGCXTD-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
|
| 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 | 18702009 |
| 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 |
11420204
|
| Drug Bank Link | - |
| ChemSpider Link | 9589676 |
| ChEMBL Link | CHEMBL496174 |
