| General Property |
| Molceule ID (DB) | EGIN0004576 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 2a |
| IUPAC Name | 4-[(3-chlorophenyl)amino]-6,7-dimethoxyquinoline-3-carboxylic acid |
| Formula | C18H15ClN2O4 |
| Mass | 358.776 |
| Exact Mass | 358.0720347 |
| Composition | C (60.26%), H (4.21%), Cl (9.88%), N (7.81%), O (17.84%) |
| Atom Count | 40 |
| PI | 5.05 |
| Smiles | c1c(c(cc2c1c(c(cn2)C(=O)O)Nc1cc(ccc1)Cl)OC)OC |
| InChI | 1S/C18H15ClN2O4/c1-24-15-7-12-14(8-16(15)25-2)20-9-13(18(22)23)17(12)21-11-5-3-4-10(19)6-11/h3-9H,1-
2H3,(H,20,21)(H,22,23) |
| InChIKey | OUHSPDFUQQCRMP-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 |
57400360
|
| Drug Bank Link | - |
| ChemSpider Link | 28431326 |
| ChEMBL Link | CHEMBL1947122 |
