| General Property |
| Molceule ID (DB) | EGIN0004077 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 1o compound |
| IUPAC Name | 1-(4-{[4-({1-[(3-fluorophenyl)methyl]-1H-indazol-5-yl}amino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl}piperazin-1-yl)ethan-1-one |
| Formula | C27H27FN8O |
| Mass | 498.5547 |
| Exact Mass | 498.2291857 |
| Composition | C (65.05%), H (5.46%), F (3.81%), N (22.48%), O (3.21%) |
| Atom Count | 64 |
| PI | 10.5 |
| Smiles | c1(c2n(ncn1)ccc2CN1CCN(CC1)C(=O)C)Nc1cc2c(cc1)n(nc2)Cc1cc(ccc1)F |
| InChI | 1S/C27H27FN8O/c1-19(37)34-11-9-33(10-12-34)17-21-7-8-35-26(21)27(29-18-31-35)32-24-5-6-25-22(14-24)1
5-30-36(25)16-20-3-2-4-23(28)13-20/h2-8,13-15,18H,9-12,16-17H2,1H3,(H,29,31,32) |
| InChIKey | NFDDLNNYPCZJSB-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 | 11388996 |
| ChEMBL Link | CHEMBL231885 |
