| General Property |
| Molceule ID (DB) | EGIN0000645 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | PD160879 |
| IUPAC Name | (2E)-N-{4-[(3-bromophenyl)amino]quinazolin-7-yl}but-2-enamide |
| Formula | C18H15BrN4O |
| Mass | 383.242 |
| Exact Mass | 382.0429238 |
| Composition | C (56.41%), H (3.95%), Br (20.85%), N (14.62%), O (4.17%) |
| Atom Count | 39 |
| PI | 8.76 |
| Smiles | c12c(cc(cc1)NC(=O)/C=C/C)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C18H15BrN4O/c1-2-4-17(24)22-14-7-8-15-16(10-14)20-11-21-18(15)23-13-6-3-5-12(19)9-13/h2-11H,1H3,(
H,22,24)(H,20,21,23)/b4-2+ |
| InChIKey | DLDLSHFGFDPLKJ-DUXPYHPUSA-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 | 9751783 |
| 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 |
10068517
|
| Drug Bank Link | - |
| ChemSpider Link | 8244057 |
| ChEMBL Link | CHEMBL511874 |
