| General Property |
| Molceule ID (DB) | EGIN0001067 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 20 compound |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}-1-methyl-1,2,5,6-tetrahydropyridine-3-carboxamide |
| Formula | C21H20BrN5O |
| Mass | 438.32 |
| Exact Mass | 437.0851229 |
| Composition | C (57.54%), H (4.6%), Br (18.23%), N (15.98%), O (3.65%) |
| Atom Count | 48 |
| PI | 11.17 |
| Smiles | c12c(ccc(c1)NC(=O)C1=CCCN(C1)C)ncnc2Nc1cccc(c1)Br |
| InChI | 1S/C21H20BrN5O/c1-27-9-3-4-14(12-27)21(28)26-17-7-8-19-18(11-17)20(24-13-23-19)25-16-6-2-5-15(22)10-
16/h2,4-8,10-11,13H,3,9,12H2,1H3,(H,26,28)(H,23,24,25) |
| InChIKey | QHSKAAHDPBBIMT-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 | 11495584 |
| 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 |
5328984
|
| Drug Bank Link | - |
| ChemSpider Link | 4486146 |
| ChEMBL Link | CHEMBL92902 |
