| General Property |
| Molceule ID (DB) | EGIN0001449 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 7 compound |
| IUPAC Name | 1-benzyl-N-{5-methylpyrrolo[2,1-f][1,2,4]triazin-4-yl}-1H-indazol-5-amine |
| Formula | C21H18N6 |
| Mass | 354.4078 |
| Exact Mass | 354.1592946 |
| Composition | C (71.17%), H (5.12%), N (23.71%) |
| Atom Count | 45 |
| PI | 9.03 |
| Smiles | n1cnn2c(c1Nc1ccc3c(c1)cnn3Cc1ccccc1)c(cc2)C |
| InChI | 1S/C21H18N6/c1-15-9-10-26-20(15)21(22-14-24-26)25-18-7-8-19-17(11-18)12-23-27(19)13-16-5-3-2-4-6-16/
h2-12,14H,13H2,1H3,(H,22,24,25) |
| InChIKey | QUMXZLSLZVWESB-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 | 17270437 |
| 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 |
44440815
|
| Drug Bank Link | - |
| ChemSpider Link | 23305097 |
| ChEMBL Link | CHEMBL429827 |
