| General Property |
| Molceule ID (DB) | EGIN0004568 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 2c |
| IUPAC Name | 4-[(3-chloro-4-fluorophenyl)amino]-6,7-dimethoxyquinoline-3-carboxylic acid |
| Formula | C18H14ClFN2O4 |
| Mass | 376.766 |
| Exact Mass | 376.0626129 |
| Composition | C (57.38%), H (3.75%), Cl (9.41%), F (5.04%), N (7.44%), O (16.99%) |
| Atom Count | 40 |
| PI | 5.06 |
| Smiles | c1c(c(cc2c1c(c(cn2)C(=O)O)Nc1cc(c(cc1)F)Cl)OC)OC |
| InChI | 1S/C18H14ClFN2O4/c1-25-15-6-10-14(7-16(15)26-2)21-8-11(18(23)24)17(10)22-9-3-4-13(20)12(19)5-9/h3-8H
,1-2H3,(H,21,22)(H,23,24) |
| InChIKey | AAVGHUCVRHUVEM-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 | 22309911 |
| 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 |
57400361
|
| Drug Bank Link | - |
| ChemSpider Link | 28431371 |
| ChEMBL Link | CHEMBL1947123 |
