| General Property |
| Molceule ID (DB) | EGIN0001901 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 27 compound |
| IUPAC Name | (2E)-N-{4-[(4-bromo-2-fluorophenyl)amino]quinazolin-6-yl}-4-(dimethylamino)but-2-enamide |
| Formula | C20H19BrFN5O |
| Mass | 444.3 |
| Exact Mass | 443.0757011 |
| Composition | C (54.07%), H (4.31%), Br (17.98%), F (4.28%), N (15.76%), O (3.6%) |
| Atom Count | 47 |
| PI | 11.06 |
| Smiles | c1(ccc2c(c1)c(ncn2)Nc1ccc(cc1F)Br)NC(=O)/C=C/CN(C)C |
| InChI | 1S/C20H19BrFN5O/c1-27(2)9-3-4-19(28)25-14-6-8-17-15(11-14)20(24-12-23-17)26-18-7-5-13(21)10-16(18)22
/h3-8,10-12H,9H2,1-2H3,(H,25,28)(H,23,24,26)/b4-3+ |
| InChIKey | SLZOGARBQLIHCR-ONEGZZNKSA-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 | 17416531 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | VEGFR2 | ALL |
| Pub Chem Link |
44428901
|
| Drug Bank Link | - |
| ChemSpider Link | 23290753 |
| ChEMBL Link | CHEMBL242131 |
