| General Property |
| Molceule ID (DB) | EGIN0001463 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 20 compound |
| IUPAC Name | N-(5-{[3-(dimethylamino)propoxy]methyl}pyrrolo[2,1-f][1,2,4]triazin-4-yl)-1-[(3-fluorophenyl)methyl]-1H-indazol-5-amine |
| Formula | C26H28FN7O |
| Mass | 473.5452 |
| Exact Mass | 473.2339368 |
| Composition | C (65.94%), H (5.96%), F (4.01%), N (20.7%), O (3.38%) |
| Atom Count | 63 |
| PI | 11.95 |
| Smiles | n1cnn2c(c1Nc1ccc3c(c1)cnn3Cc1cccc(c1)F)c(cc2)COCCCN(C)C |
| InChI | 1S/C26H28FN7O/c1-32(2)10-4-12-35-17-20-9-11-33-25(20)26(28-18-30-33)31-23-7-8-24-21(14-23)15-29-34(2
4)16-19-5-3-6-22(27)13-19/h3,5-9,11,13-15,18H,4,10,12,16-17H2,1-2H3,(H,28,30,31) |
| InChIKey | NKAFAOZJYRUFSQ-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 |
22390490
|
| Drug Bank Link | - |
| ChemSpider Link | 11389014 |
| ChEMBL Link | CHEMBL245868 |
