| General Property |
| Molceule ID (DB) | EGIN0003472 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 11 compound |
| IUPAC Name | N-(3-bromophenyl)-6-[(2E)-3-methyltriaz-2-en-1-yl]quinazolin-4-amine |
| Formula | C15H13BrN6 |
| Mass | 357.208 |
| Exact Mass | 356.0385071 |
| Composition | C (50.44%), H (3.67%), Br (22.37%), N (23.53%) |
| Atom Count | 35 |
| PI | 10.19 |
| Smiles | c1(c2c(ncn1)ccc(N/N=N/C)c2)Nc1cc(Br)ccc1 |
| InChI | 1S/C15H13BrN6/c1-17-22-21-12-5-6-14-13(8-12)15(19-9-18-14)20-11-4-2-3-10(16)7-11/h2-9H,1H3,(H,17,21)
(H,18,19,20) |
| InChIKey | MJYHECTVHQNNJE-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 | 13678409 |
| 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 |
9885081
|
| Drug Bank Link | - |
| ChemSpider Link | 8060755 |
| ChEMBL Link | CHEMBL137617 |
