| General Property |
| Molceule ID (DB) | EGIN0003401 |
| Inhibitor Class | Triazine |
| Molecule Name in Refrence Article | 37 compound |
| IUPAC Name | 2,4-difluoro-N-methoxy-5-{[6-(5-methyl-1,3,4-oxadiazol-2-yl)-5-(propan-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino}benzamide |
| Formula | C20H19F2N7O3 |
| Mass | 443.4068 |
| Exact Mass | 443.1517439 |
| Composition | C (54.17%), H (4.32%), F (8.57%), N (22.11%), O (10.82%) |
| Atom Count | 51 |
| PI | 4.85 |
| Smiles | c1(c(c2n(c1)ncnc2Nc1cc(c(cc1F)F)C(=O)NOC)C(C)C)c1nnc(o1)C |
| InChI | 1S/C20H19F2N7O3/c1-9(2)16-12(20-27-26-10(3)32-20)7-29-17(16)18(23-8-24-29)25-15-5-11(19(30)28-31-4)1
3(21)6-14(15)22/h5-9H,1-4H3,(H,28,30)(H,23,24,25) |
| InChIKey | DSBPVMDUESDKNK-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 | 15943473 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PDGFR beta | IGF1R | CDK2 | PKC alpha | VEGFR2 | FGFR1 | LCK | Flk-1 | ALL |
| Pub Chem Link |
10478569
|
| Drug Bank Link | - |
| ChemSpider Link | 8653977 |
| ChEMBL Link | CHEMBL365318 |
