| General Property |
| Molceule ID (DB) | EGIN0004087 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 1d compound |
| IUPAC Name | 1-[(3-fluorophenyl)methyl]-N-{5-methylpyrrolo[2,1-f][1,2,4]triazin-4-yl}-1H-indazol-5-amine |
| Formula | C21H17FN6 |
| Mass | 372.3983 |
| Exact Mass | 372.1498728 |
| Composition | C (67.73%), H (4.6%), F (5.1%), N (22.57%) |
| Atom Count | 45 |
| PI | 9.03 |
| Smiles | c1(c2n(ncn1)ccc2C)Nc1cc2c(cc1)n(nc2)Cc1cc(ccc1)F |
| InChI | 1S/C21H17FN6/c1-14-7-8-27-20(14)21(23-13-25-27)26-18-5-6-19-16(10-18)11-24-28(19)12-15-3-2-4-17(22)9
-15/h2-11,13H,12H2,1H3,(H,23,25,26) |
| InChIKey | BLRPVPKLIFBVIC-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 |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 23292077 |
| ChEMBL Link | CHEMBL427671 |
