| General Property |
| Molceule ID (DB) | EGIN0000842 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 5 compound |
| IUPAC Name | ethyl 4-[(3-bromophenyl)amino]-6,7-dimethoxyquinoline-3-carboxylate |
| Formula | C20H19BrN2O4 |
| Mass | 431.28 |
| Exact Mass | 430.0528198 |
| Composition | C (55.7%), H (4.44%), Br (18.53%), N (6.5%), O (14.84%) |
| Atom Count | 46 |
| PI | 11.54 |
| Smiles | c12c(cc(c(c1)OC)OC)ncc(c2Nc1cccc(c1)Br)C(=O)OCC |
| InChI | 1S/C20H19BrN2O4/c1-4-27-20(24)15-11-22-16-10-18(26-3)17(25-2)9-14(16)19(15)23-13-7-5-6-12(21)8-13/h5
-11H,4H2,1-3H3,(H,22,23) |
| InChIKey | JTCMPRGLTUXNFT-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 | 10966743 |
| 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 |
5328837
|
| Drug Bank Link | - |
| ChemSpider Link | 4485999 |
| ChEMBL Link | CHEMBL443277 |
