| General Property |
| Molceule ID (DB) | EGIN0004717 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 20 |
| IUPAC Name | 6-{2-[bis(2-methoxyethyl)amino]ethoxy}-N-(3-chloro-4-fluorophenyl)-7-methoxyquinazolin-4-amine |
| Formula | C23H28ClFN4O4 |
| Mass | 478.944 |
| Exact Mass | 478.1783113 |
| Composition | C (57.68%), H (5.89%), Cl (7.4%), F (3.97%), N (11.7%), O (13.36%) |
| Atom Count | 61 |
| PI | 12.07 |
| Smiles | c1c(c(cc2c1c(ncn2)Nc1ccc(c(c1)Cl)F)OC)OCCN(CCOC)CCOC |
| InChI | 1S/C23H28ClFN4O4/c1-30-9-6-29(7-10-31-2)8-11-33-22-13-17-20(14-21(22)32-3)26-15-27-23(17)28-16-4-5-1
9(25)18(24)12-16/h4-5,12-15H,6-11H2,1-3H3,(H,26,27,28) |
| InChIKey | WFOGDVXKFPKAIQ-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 |
19077504
|
| Drug Bank Link | - |
| ChemSpider Link | 13940734 |
| ChEMBL Link | CHEMBL294395 |
