| General Property |
| Molceule ID (DB) | EGIN0004461 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 5h compound |
| IUPAC Name | 4-N-(3-bromophenyl)-6-N-[(3-bromophenyl)methyl]quinazoline-4,6-diamine |
| Formula | C21H16Br2N4 |
| Mass | 484.187 |
| Exact Mass | 481.9741718 |
| Composition | C (52.09%), H (3.33%), Br (33.01%), N (11.57%) |
| Atom Count | 43 |
| PI | 10.52 |
| Smiles | n1cnc(c2c1ccc(c2)NCc1cc(ccc1)Br)Nc1cc(ccc1)Br |
| InChI | 1S/C21H16Br2N4/c22-15-4-1-3-14(9-15)12-24-17-7-8-20-19(11-17)21(26-13-25-20)27-18-6-2-5-16(23)10-18/
h1-11,13,24H,12H2,(H,25,26,27) |
| InChIKey | PYSCJGUETRCALG-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 | 22112541 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | - |
