| General Property |
| Molceule ID (DB) | EGIN0001390 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 7b compound |
| IUPAC Name | 4-[(1-benzyl-1H-indazol-5-yl)amino]-5-ethyl-N-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide |
| Formula | C24H23N7O |
| Mass | 425.4857 |
| Exact Mass | 425.1964084 |
| Composition | C (67.75%), H (5.45%), N (23.04%), O (3.76%) |
| Atom Count | 55 |
| PI | 7.74 |
| Smiles | n1cnn2c(c1Nc1ccc3c(c1)cnn3Cc1ccccc1)c(c(c2)C(=O)NC)CC |
| InChI | 1S/C24H23N7O/c1-3-19-20(24(32)25-2)14-31-22(19)23(26-15-28-31)29-18-9-10-21-17(11-18)12-27-30(21)13-
16-7-5-4-6-8-16/h4-12,14-15H,3,13H2,1-2H3,(H,25,32)(H,26,28,29) |
| InChIKey | XSUGKVVBKGFATM-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 | 16111887 |
| 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 |
23646545
|
| Drug Bank Link | - |
| ChemSpider Link | 23261344 |
| ChEMBL Link | CHEMBL197689 |
