| General Property |
| Molceule ID (DB) | EGIN0004761 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 15 |
| IUPAC Name | N-{4-[(3-chloro-4-fluorophenyl)amino]-3-cyano-7-ethoxyquinolin-6-yl}-3-(dimethylamino)propanamide |
| Formula | C23H23ClFN5O2 |
| Mass | 455.912 |
| Exact Mass | 455.1524309 |
| Composition | C (60.59%), H (5.08%), Cl (7.78%), F (4.17%), N (15.36%), O (7.02%) |
| Atom Count | 55 |
| PI | 10.7 |
| Smiles | c1c(c(cc2c1c(c(cn2)C#N)Nc1ccc(c(c1)Cl)F)OCC)NC(=O)CCN(C)C |
| InChI | 1S/C23H23ClFN5O2/c1-4-32-21-11-19-16(10-20(21)29-22(31)7-8-30(2)3)23(14(12-26)13-27-19)28-15-5-6-18(
25)17(24)9-15/h5-6,9-11,13H,4,7-8H2,1-3H3,(H,27,28)(H,29,31) |
| InChIKey | DRBYRIHQPVZFMW-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 | 22280453 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 28511388 |
| ChEMBL Link | - |
