| General Property |
| Molceule ID (DB) | EGIN0000748 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 45 compound |
| IUPAC Name | 4-N-(3-bromophenyl)-7-N,7-N-dimethylquinazoline-4,6,7-triamine |
| Formula | C16H16BrN5 |
| Mass | 358.236 |
| Exact Mass | 357.0589082 |
| Composition | C (53.64%), H (4.5%), Br (22.3%), N (19.55%) |
| Atom Count | 38 |
| PI | 11.62 |
| Smiles | c12c(cc(c(c1)N)N(C)C)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C16H16BrN5/c1-22(2)15-8-14-12(7-13(15)18)16(20-9-19-14)21-11-5-3-4-10(17)6-11/h3-9H,18H2,1-2H3,(H
,19,20,21) |
| InChIKey | LVYWXEWYKYOVOX-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 | 8568816 |
| 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 |
5328211
|
| Drug Bank Link | - |
| ChemSpider Link | 4485376 |
| ChEMBL Link | CHEMBL96489 |
