| General Property |
| Molceule ID (DB) | EGIN0001472 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 33 compound |
| IUPAC Name | N-(5-{[(2S)-morpholin-2-ylmethoxy]methyl}pyrrolo[2,1-f][1,2,4]triazin-4-yl)-1-(pyridin-2-ylmethyl)-1H-indazol-5-amine |
| Formula | C25H26N8O2 |
| Mass | 470.5263 |
| Exact Mass | 470.2178721 |
| Composition | C (63.82%), H (5.57%), N (23.81%), O (6.8%) |
| Atom Count | 61 |
| PI | 11.42 |
| Smiles | [C@H]1(CNCCO1)COCc1c2c(ncnn2cc1)Nc1ccc2c(c1)cnn2Cc1ccccn1 |
| InChI | 1S/C25H26N8O2/c1-2-7-27-21(3-1)14-33-23-5-4-20(11-19(23)12-29-33)31-25-24-18(6-9-32(24)30-17-28-25)1
5-34-16-22-13-26-8-10-35-22/h1-7,9,11-12,17,22,26H,8,10,13-16H2,(H,28,30,31)/t22-/m0/s1 |
| InChIKey | GZOONDSECSSONX-QFIPXVFZSA-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 | 17270437 |
| 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 |
44440839
|
| Drug Bank Link | - |
| ChemSpider Link | 23305122 |
| ChEMBL Link | CHEMBL396079 |
