| General Property |
| Molceule ID (DB) | EGIN0004089 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 1f compound |
| IUPAC Name | 2-({[4-({1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl}amino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl}(methyl)amino)ethan-1-ol |
| 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 | 11.36 |
| Smiles | c1(c2n(ncn1)ccc2CN(CCO)C)Nc1cc2c(cc1)n(nc2)Cc1cc(ccc1)F |
| InChI | 1S/C24H24FN7O/c1-30(9-10-33)15-18-7-8-31-23(18)24(26-16-28-31)29-21-5-6-22-19(12-21)13-27-32(22)14-1
7-3-2-4-20(25)11-17/h2-8,11-13,16,33H,9-10,14-15H2,1H3,(H,26,28,29) |
| InChIKey | KAQAVWVXKVKDIM-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 17368025 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 11389078 |
| ChEMBL Link | CHEMBL391521 |
