| General Property |
| Molceule ID (DB) | EGIN0000750 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 47 compound |
| IUPAC Name | 4-N-(3-bromophenyl)-7-chloroquinazoline-4,6-diamine |
| Formula | C14H10BrClN4 |
| Mass | 349.613 |
| Exact Mass | 347.9777367 |
| Composition | C (48.1%), H (2.88%), Br (22.85%), Cl (10.14%), N (16.03%) |
| Atom Count | 30 |
| PI | 10.17 |
| Smiles | c12c(cc(c(c1)N)Cl)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C14H10BrClN4/c15-8-2-1-3-9(4-8)20-14-10-5-12(17)11(16)6-13(10)18-7-19-14/h1-7H,17H2,(H,18,19,20) |
| InChIKey | DXPXPVHLPOANFF-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 |
5328213
|
| Drug Bank Link | - |
| ChemSpider Link | 4485378 |
| ChEMBL Link | CHEMBL63469 |
