| General Property |
| Molceule ID (DB) | EGIN0001389 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 7a compound |
| IUPAC Name | 4-[(1-benzyl-1H-indazol-5-yl)amino]-5-ethylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide |
| Formula | C23H21N7O |
| Mass | 411.4591 |
| Exact Mass | 411.1807583 |
| Composition | C (67.14%), H (5.14%), N (23.83%), O (3.89%) |
| Atom Count | 52 |
| PI | 7.6 |
| Smiles | n1cnn2c(c1Nc1ccc3c(c1)cnn3Cc1ccccc1)c(c(c2)C(=O)N)CC |
| InChI | 1S/C23H21N7O/c1-2-18-19(22(24)31)13-30-21(18)23(25-14-27-30)28-17-8-9-20-16(10-17)11-26-29(20)12-15-
6-4-3-5-7-15/h3-11,13-14H,2,12H2,1H3,(H2,24,31)(H,25,27,28) |
| InChIKey | UMFUSRXYNCISOO-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 |
23646544
|
| Drug Bank Link | - |
| ChemSpider Link | 23261343 |
| ChEMBL Link | CHEMBL194958 |
