| General Property |
| Molceule ID (DB) | EGIN0000584 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 13 compound |
| IUPAC Name | N-(3-chloro-4-fluorophenyl)-7-methoxy-5-(oxan-4-yloxy)quinazolin-4-amine |
| Formula | C20H19ClFN3O3 |
| Mass | 403.835 |
| Exact Mass | 403.1098974 |
| Composition | C (59.48%), H (4.74%), Cl (8.78%), F (4.7%), N (10.41%), O (11.89%) |
| Atom Count | 47 |
| PI | 10.05 |
| Smiles | c12c(cc(cc1OC1CCOCC1)OC)ncnc2Nc1ccc(c(c1)Cl)F |
| InChI | 1S/C20H19ClFN3O3/c1-26-14-9-17-19(18(10-14)28-13-4-6-27-7-5-13)20(24-11-23-17)25-12-2-3-16(22)15(21)
8-12/h2-3,8-11,13H,4-7H2,1H3,(H,23,24,25) |
| InChIKey | BXHASRYUULFTCY-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 | 16380259 |
| 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 |
44409387
|
| Drug Bank Link | - |
| ChemSpider Link | 23268200 |
| ChEMBL Link | CHEMBL205783 |
