| General Property |
| Molceule ID (DB) | EGIN0004755 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 15 |
| IUPAC Name | N-(3-chloro-4-fluorophenyl)-7-methoxy-6-{2-[(2-methoxyethyl)amino]ethoxy}quinazolin-4-amine |
| Formula | C20H22ClFN4O3 |
| Mass | 420.865 |
| Exact Mass | 420.1364465 |
| Composition | C (57.08%), H (5.27%), Cl (8.42%), F (4.51%), N (13.31%), O (11.4%) |
| Atom Count | 51 |
| PI | 12.48 |
| Smiles | c1c(c(cc2c1c(ncn2)Nc1ccc(c(c1)Cl)F)OC)OCCNCCOC |
| InChI | 1S/C20H22ClFN4O3/c1-27-7-5-23-6-8-29-19-10-14-17(11-18(19)28-2)24-12-25-20(14)26-13-3-4-16(22)15(21)
9-13/h3-4,9-12,23H,5-8H2,1-2H3,(H,24,25,26) |
| InChIKey | FDBDZTQUOIKCIZ-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 | 11459659 |
| 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 |
44299983
|
| Drug Bank Link | - |
| ChemSpider Link | 23150446 |
| ChEMBL Link | CHEMBL56912 |
