| General Property |
| Molceule ID (DB) | EGIN0003471 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 10 (BJ2000) |
| IUPAC Name | N-(3-chlorophenyl)-6-[(2E)-3-methyltriaz-2-en-1-yl]quinazolin-4-amine |
| Formula | C15H13ClN6 |
| Mass | 312.757 |
| Exact Mass | 312.0890222 |
| Composition | C (57.6%), H (4.19%), Cl (11.34%), N (26.87%) |
| Atom Count | 35 |
| PI | 10.14 |
| Smiles | c1(c2c(ncn1)ccc(N/N=N/C)c2)Nc1cc(Cl)ccc1 |
| InChI | 1S/C15H13ClN6/c1-17-22-21-12-5-6-14-13(8-12)15(19-9-18-14)20-11-4-2-3-10(16)7-11/h2-9H,1H3,(H,17,21)
(H,18,19,20) |
| InChIKey | BQYLYGKCCJLIKQ-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 |
9818251
|
| Drug Bank Link | - |
| ChemSpider Link | 7994001 |
| ChEMBL Link | CHEMBL133024 |
