| General Property |
| Molceule ID (DB) | EGIN0003963 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 27 compound |
| IUPAC Name | N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[2-(1-methylpiperidin-4-yl)ethoxy]quinazolin-4-amine |
| Formula | C23H26BrFN4O2 |
| Mass | 489.381 |
| Exact Mass | 488.1223169 |
| Composition | C (56.45%), H (5.36%), Br (16.33%), F (3.88%), N (11.45%), O (6.54%) |
| Atom Count | 57 |
| PI | 11.52 |
| Smiles | c12c(Nc3c(cc(cc3)Br)F)ncnc1cc(c(c2)OC)OCCC1CCN(CC1)C |
| InChI | 1S/C23H26BrFN4O2/c1-29-8-5-15(6-9-29)7-10-31-22-13-20-17(12-21(22)30-2)23(27-14-26-20)28-19-4-3-16(2
4)11-18(19)25/h3-4,11-15H,5-10H2,1-2H3,(H,26,27,28) |
| InChIKey | OORQGKRPXSYBAR-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 | 11881999 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Flt1 | FGFR | KDR | ALL |
| Pub Chem Link |
5329053
|
| Drug Bank Link | - |
| ChemSpider Link | 4486215 |
| ChEMBL Link | CHEMBL24979 |
