| General Property |
| Molceule ID (DB) | EGIN0004953 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 31b |
| IUPAC Name | 2-chloro-6,7-dimethoxy-N-(4-methylphenyl)quinazolin-4-amine |
| Formula | C17H16ClN3O2 |
| Mass | 329.781 |
| Exact Mass | 329.0931045 |
| Composition | C (61.91%), H (4.89%), Cl (10.75%), N (12.74%), O (9.7%) |
| Atom Count | 39 |
| PI | 9.18 |
| Smiles | c12cc(c(cc1nc(nc2Nc1ccc(cc1)C)Cl)OC)OC |
| InChI | 1S/C17H16ClN3O2/c1-10-4-6-11(7-5-10)19-16-12-8-14(22-2)15(23-3)9-13(12)20-17(18)21-16/h4-9H,1-3H3,(H
,19,20,21) |
| InChIKey | VBFXQIVTEKYBPS-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 | 8879541 |
| 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 |
5328829
|
| Drug Bank Link | - |
| ChemSpider Link | 4485991 |
| ChEMBL Link | - |
