| General Property |
| Molceule ID (DB) | EGIN0003390 |
| Inhibitor Class | Quinoline |
| Molecule Name in Refrence Article | 6ab compound |
| IUPAC Name | 1-(2,4-difluorophenyl)-3-{4-[(6,7-dimethoxyquinolin-4-yl)oxy]-2-fluorophenyl}urea |
| Formula | C24H18F3N3O4 |
| Mass | 469.4126 |
| Exact Mass | 469.1249407 |
| Composition | C (61.41%), H (3.87%), F (12.14%), N (8.95%), O (13.63%) |
| Atom Count | 52 |
| PI | 8.04 |
| Smiles | c12c(cc(c(c1)OC)OC)nccc2Oc1cc(c(NC(=O)Nc2c(cc(cc2)F)F)cc1)F |
| InChI | 1S/C24H18F3N3O4/c1-32-22-11-15-20(12-23(22)33-2)28-8-7-21(15)34-14-4-6-19(17(27)10-14)30-24(31)29-18
-5-3-13(25)9-16(18)26/h3-12H,1-2H3,(H2,29,30,31) |
| InChIKey | LFKQSJNCVRGFCC-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 | 15743179 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Src | EGFR | MAPK | MEK1 | PKA | PKC alpha | VEGFR2 | ALL |
| Pub Chem Link |
11317348
|
| Drug Bank Link | - |
| ChemSpider Link | 9492314 |
| ChEMBL Link | CHEMBL178455 |
