| General Property |
| Molceule ID (DB) | EGIN0000744 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 41 compound |
| IUPAC Name | 4-N-(3-bromophenyl)-7-N-ethylquinazoline-4,7-diamine |
| Formula | C16H15BrN4 |
| Mass | 343.221 |
| Exact Mass | 342.0480091 |
| Composition | C (55.99%), H (4.41%), Br (23.28%), N (16.32%) |
| Atom Count | 36 |
| PI | 10.93 |
| Smiles | c12c(cc(cc1)NCC)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C16H15BrN4/c1-2-18-12-6-7-14-15(9-12)19-10-20-16(14)21-13-5-3-4-11(17)8-13/h3-10,18H,2H2,1H3,(H,1
9,20,21) |
| InChIKey | GXYLLTHBINHTRN-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 |
5328209
|
| Drug Bank Link | - |
| ChemSpider Link | 4485374 |
| ChEMBL Link | CHEMBL420254 |
