| General Property |
| Molceule ID (DB) | EGIN0002536 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 8a compound |
| IUPAC Name | N-{5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}-1-methyl-1H-indazol-5-amine |
| Formula | C20H24N8 |
| Mass | 376.4582 |
| Exact Mass | 376.2123928 |
| Composition | C (63.81%), H (6.43%), N (29.77%) |
| Atom Count | 52 |
| PI | 12.44 |
| Smiles | n1cnc(c2n1ccc2CN1CC[C@H](CC1)N)Nc1cc2c(cc1)n(nc2)C |
| InChI | 1S/C20H24N8/c1-26-18-3-2-17(10-15(18)11-23-26)25-20-19-14(4-9-28(19)24-13-22-20)12-27-7-5-16(21)6-8-
27/h2-4,9-11,13,16H,5-8,12,21H2,1H3,(H,22,24,25) |
| InChIKey | KVCFBSPPQNDXTQ-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 | 21177105 |
| 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 |
53318117
|
| Drug Bank Link | - |
| ChemSpider Link | 26378436 |
| ChEMBL Link | CHEMBL1645464 |
