| General Property |
| Molceule ID (DB) | EGIN0003949 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 12 compound |
| IUPAC Name | 3-fluoro-4-[(6-methoxy-7-{[(2E)-4-(pyrrolidin-1-yl)but-2-en-1-yl]oxy}quinazolin-4-yl)amino]benzonitrile |
| Formula | C24H24FN5O2 |
| Mass | 433.4781 |
| Exact Mass | 433.1914032 |
| Composition | C (66.5%), H (5.58%), F (4.38%), N (16.16%), O (7.38%) |
| Atom Count | 56 |
| PI | 11.17 |
| Smiles | c12c(Nc3c(cc(C#N)cc3)F)ncnc1cc(c(c2)OC)OC/C=C/CN1CCCC1 |
| InChI | 1S/C24H24FN5O2/c1-31-22-13-18-21(14-23(22)32-11-5-4-10-30-8-2-3-9-30)27-16-28-24(18)29-20-7-6-17(15-
26)12-19(20)25/h4-7,12-14,16H,2-3,8-11H2,1H3,(H,27,28,29)/b5-4+ |
| InChIKey | DIZVEEIWWJAIEW-SNAWJCMRSA-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 | FGFR | KDR | Flt1 | ALL |
| Pub Chem Link |
5329040
|
| Drug Bank Link | - |
| ChemSpider Link | 4486202 |
| ChEMBL Link | CHEMBL24026 |
