| General Property |
| Molceule ID (DB) | EGIN0000208 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 3 |
| IUPAC Name | N-{4-[(3-bromophenyl)amino]quinazolin-6-yl}prop-2-enamide |
| Formula | C17H13BrN4O |
| Mass | 369.215 |
| Exact Mass | 368.0272737 |
| Composition | C (55.3%), H (3.55%), Br (21.64%), N (15.17%), O (4.33%) |
| Atom Count | 36 |
| PI | 9.17 |
| Smiles | c12c(ccc(c1)NC(=O)C=C)ncnc2Nc1cc(ccc1)Br |
| InChI | 1S/C17H13BrN4O/c1-2-16(23)21-13-6-7-15-14(9-13)17(20-10-19-15)22-12-5-3-4-11(18)8-12/h2-10H,1H2,(H,2
1,23)(H,19,20,22) |
| InChIKey | HTUBKQUPEREOGA-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 | 22280453 | 9751783 | 10346932 | 10753475 | 10956451 | 11495584 | 17154492 | 18316192 | 18667312 | 20151670 | 20222733 | |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Jak3 | Blk | Lkb1 | Bmx | Btk | Itk | Insulin receptor | PDGFr | PKC | Insulin receptor | PDGFr | cSrc-SM | cSrc-DM | ALL |
| Pub Chem Link |
4708
|
| Drug Bank Link | DB07662 |
| ChemSpider Link | 4546 |
| ChEMBL Link | CHEMBL285063 |
