| General Property |
| Molceule ID (DB) | EGIN0000883 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 2b |
| IUPAC Name | 4-[(3-bromophenyl)amino]-6,7-dimethoxyquinoline-3-carboxylic acid |
| Formula | C18H15BrN2O4 |
| Mass | 403.227 |
| Exact Mass | 402.0215196 |
| Composition | C (53.62%), H (3.75%), Br (19.82%), N (6.95%), O (15.87%) |
| Atom Count | 40 |
| PI | 5.05 |
| Smiles | c12c(cc(c(c1)OC)OC)ncc(c2Nc1cccc(c1)Br)C(=O)O |
| InChI | 1S/C18H15BrN2O4/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 | CISJBDCCOIMBGW-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 | 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 |
5328878
|
| Drug Bank Link | - |
| ChemSpider Link | 4486040 |
| ChEMBL Link | CHEMBL541988 |
