| General Property |
| Molceule ID (DB) | EGIN0004075 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 1m compound |
| IUPAC Name | 1-[(3-fluorophenyl)methyl]-N-{5-[(4-methylpiperazin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}-1H-indazol-5-amine |
| Formula | C26H27FN8 |
| Mass | 470.5446 |
| Exact Mass | 470.2342711 |
| Composition | C (66.37%), H (5.78%), F (4.04%), N (23.81%) |
| Atom Count | 62 |
| PI | 11.32 |
| Smiles | c1(c2n(ncn1)ccc2CN1CCN(CC1)C)Nc1cc2c(cc1)n(nc2)Cc1cc(ccc1)F |
| InChI | 1S/C26H27FN8/c1-32-9-11-33(12-10-32)17-20-7-8-34-25(20)26(28-18-30-34)31-23-5-6-24-21(14-23)15-29-35
(24)16-19-3-2-4-22(27)13-19/h2-8,13-15,18H,9-12,16-17H2,1H3,(H,28,30,31) |
| InChIKey | DQYLUXJFGRYNJA-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 | 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 |
10217304
|
| Drug Bank Link | - |
| ChemSpider Link | 8392796 |
| ChEMBL Link | CHEMBL232082 |
