| General Property |
| Molceule ID (DB) | EGIN0004090 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 1g compound |
| IUPAC Name | 1-[(3-fluorophenyl)methyl]-N-[5-(pyrrolidin-1-ylmethyl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]-1H-indazol-5-amine |
| Formula | C25H24FN7 |
| Mass | 441.5034 |
| Exact Mass | 441.207722 |
| Composition | C (68.01%), H (5.48%), F (4.3%), N (22.21%) |
| Atom Count | 57 |
| PI | 11.54 |
| Smiles | c1(c2n(ncn1)ccc2CN1CCCC1)Nc1cc2c(cc1)n(nc2)Cc1cc(ccc1)F |
| InChI | 1S/C25H24FN7/c26-21-5-3-4-18(12-21)15-33-23-7-6-22(13-20(23)14-28-33)30-25-24-19(16-31-9-1-2-10-31)8
-11-32(24)29-17-27-25/h3-8,11-14,17H,1-2,9-10,15-16H2,(H,27,29,30) |
| InChIKey | PDXYGSYLHJULFZ-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 | 11389028 |
| ChEMBL Link | CHEMBL391675 |
