| General Property |
| Molceule ID (DB) | EGIN0000843 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 6 compound |
| IUPAC Name | 4-[(3-bromophenyl)amino]-6,7-diethoxyquinoline-3-carbonitrile |
| Formula | C20H18BrN3O2 |
| Mass | 412.28 |
| Exact Mass | 411.0582395 |
| Composition | C (58.26%), H (4.4%), Br (19.38%), N (10.19%), O (7.76%) |
| Atom Count | 44 |
| PI | 10.78 |
| Smiles | c12c(cc(c(c1)OCC)OCC)ncc(c2Nc1cccc(c1)Br)C#N |
| InChI | 1S/C20H18BrN3O2/c1-3-25-18-9-16-17(10-19(18)26-4-2)23-12-13(11-22)20(16)24-15-7-5-6-14(21)8-15/h5-10
,12H,3-4H2,1-2H3,(H,23,24) |
| InChIKey | ZXILYRWRAKLTOG-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 |
5328838
|
| Drug Bank Link | - |
| ChemSpider Link | 4486000 |
| ChEMBL Link | CHEMBL109212 |
