| General Property |
| Molceule ID (DB) | EGIN0003470 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 9 (SMA41) |
| IUPAC Name | N-(3-methylphenyl)-6-[(2E)-3-methyltriaz-2-en-1-yl]quinazolin-4-amine |
| Formula | C16H16N6 |
| Mass | 292.3384 |
| Exact Mass | 292.1436445 |
| Composition | C (65.74%), H (5.52%), N (28.75%) |
| Atom Count | 38 |
| PI | 10.42 |
| Smiles | c1(c2c(ncn1)ccc(N/N=N/C)c2)Nc1cc(ccc1)C |
| InChI | 1S/C16H16N6/c1-11-4-3-5-12(8-11)20-16-14-9-13(21-22-17-2)6-7-15(14)18-10-19-16/h3-10H,1-2H3,(H,17,21
)(H,18,19,20) |
| InChIKey | LVSKRGBRYXZIRX-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 |
9882519
|
| Drug Bank Link | - |
| ChemSpider Link | 8058194 |
| ChEMBL Link | CHEMBL137189 |
