| General Property |
| Molceule ID (DB) | EGIN0001461 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 18 compound |
| IUPAC Name | N-{5-[(3-aminopropoxy)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}-1-[(3-fluorophenyl)methyl]-1H-indazol-5-amine |
| Formula | C24H24FN7O |
| Mass | 445.4921 |
| Exact Mass | 445.2026366 |
| Composition | C (64.71%), H (5.43%), F (4.26%), N (22.01%), O (3.59%) |
| Atom Count | 57 |
| PI | 12.29 |
| Smiles | n1cnn2c(c1Nc1ccc3c(c1)cnn3Cc1cccc(c1)F)c(cc2)COCCCN |
| InChI | 1S/C24H24FN7O/c25-20-4-1-3-17(11-20)14-32-22-6-5-21(12-19(22)13-28-32)30-24-23-18(15-33-10-2-8-26)7-
9-31(23)29-16-27-24/h1,3-7,9,11-13,16H,2,8,10,14-15,26H2,(H,27,29,30) |
| InChIKey | IGODIYJKZLOCRX-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 |
10114464
|
| Drug Bank Link | - |
| ChemSpider Link | 8289987 |
| ChEMBL Link | CHEMBL245667 |
