| General Property |
| Molceule ID (DB) | EGIN0003476 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 15 compound |
| IUPAC Name | N-(3-bromophenyl)-6-[(2E)-3-(2-methoxyethyl)triaz-2-en-1-yl]quinazolin-4-amine |
| Formula | C17H17BrN6O |
| Mass | 401.26 |
| Exact Mass | 400.0647218 |
| Composition | C (50.89%), H (4.27%), Br (19.91%), N (20.94%), O (3.99%) |
| Atom Count | 42 |
| PI | 10.19 |
| Smiles | c1(c2c(ncn1)ccc(N/N=N/CCOC)c2)Nc1cc(Br)ccc1 |
| InChI | 1S/C17H17BrN6O/c1-25-8-7-21-24-23-14-5-6-16-15(10-14)17(20-11-19-16)22-13-4-2-3-12(18)9-13/h2-6,9-11
H,7-8H2,1H3,(H,21,23)(H,19,20,22) |
| InChIKey | BXSIIPHCRZNAEI-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 | 13678409 |
| 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 |
10222656
|
| Drug Bank Link | - |
| ChemSpider Link | 8398148 |
| ChEMBL Link | CHEMBL136674 |
