| General Property |
| Molceule ID (DB) | EGIN0000922 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 33 compound |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}ethene-1-sulfonamide |
| Formula | C16H13BrN4O2S |
| Mass | 405.269 |
| Exact Mass | 403.994259 |
| Composition | C (47.42%), H (3.23%), Br (19.72%), N (13.82%), O (7.9%), S (7.91%) |
| Atom Count | 37 |
| PI | 7.1 |
| Smiles | n1cnc2c(c1Nc1cccc(c1)Br)cc(cc2)NS(=O)(=O)C=C |
| InChI | 1S/C16H13BrN4O2S/c1-2-24(22,23)21-13-6-7-15-14(9-13)16(19-10-18-15)20-12-5-3-4-11(17)8-12/h2-10,21H,
1H2,(H,18,19,20) |
| InChIKey | XDSBIBMMFWAPMJ-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 | 11462982 |
| 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 |
5329094
|
| Drug Bank Link | - |
| ChemSpider Link | 4486256 |
| ChEMBL Link | CHEMBL136511 |
