| General Property |
| Molceule ID (DB) | EGIN0001391 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 7c compound |
| IUPAC Name | 4-[(1-benzyl-1H-indazol-5-yl)amino]-5-ethyl-N,N-dimethylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide |
| Formula | C25H25N7O |
| Mass | 439.5123 |
| Exact Mass | 439.2120585 |
| Composition | C (68.32%), H (5.73%), N (22.31%), O (3.64%) |
| Atom Count | 58 |
| PI | 8.02 |
| Smiles | n1cnn2c(c1Nc1ccc3c(c1)cnn3Cc1ccccc1)c(c(c2)C(=O)N(C)C)CC |
| InChI | 1S/C25H25N7O/c1-4-20-21(25(33)30(2)3)15-32-23(20)24(26-16-28-32)29-19-10-11-22-18(12-19)13-27-31(22)
14-17-8-6-5-7-9-17/h5-13,15-16H,4,14H2,1-3H3,(H,26,28,29) |
| InChIKey | FAFIJKWOYIPTEN-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 |
21945841
|
| Drug Bank Link | - |
| ChemSpider Link | 10700370 |
| ChEMBL Link | CHEMBL372293 |
