| General Property |
| Molceule ID (DB) | EGIN0004099 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 17 compound |
| IUPAC Name | N-(3-chlorophenyl)-6-[(1E)-3-[2-(dimethylamino)ethyl]triaz-1-en-1-yl]quinazolin-4-amine |
| Formula | C18H20ClN7 |
| Mass | 369.851 |
| Exact Mass | 369.1468714 |
| Composition | C (58.45%), H (5.45%), Cl (9.59%), N (26.51%) |
| Atom Count | 46 |
| PI | 11.85 |
| Smiles | N(CCN/N=N/c1ccc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)(C)C |
| InChI | 1S/C18H20ClN7/c1-26(2)9-8-22-25-24-15-6-7-17-16(11-15)18(21-12-20-17)23-14-5-3-4-13(19)10-14/h3-7,10
-12H,8-9H2,1-2H3,(H,22,24)(H,20,21,23) |
| InChIKey | GOVBHWZRXMKGIA-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 | 17472358 |
| 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 |
11326156
|
| Drug Bank Link | - |
| ChemSpider Link | 9501108 |
| ChEMBL Link | CHEMBL225720 |
