| General Property |
| Molceule ID (DB) | EGIN0003489 |
| Inhibitor Class | Pyrrolo-triazine |
| Molecule Name in Refrence Article | 13 (BMS-645737) |
| IUPAC Name | 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-{2-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl}-5-(propan-2-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine |
| Formula | C20H20N8O |
| Mass | 388.4258 |
| Exact Mass | 388.1760073 |
| Composition | C (61.84%), H (5.19%), N (28.85%), O (4.12%) |
| Atom Count | 49 |
| PI | 9.58 |
| Smiles | n1cnc(c2n1cc(c2C(C)C)c1nnc(o1)C)Nc1cc2c(nc1)[nH]c(c2)C |
| InChI | 1S/C20H20N8O/c1-10(2)16-15(20-27-26-12(4)29-20)8-28-17(16)19(22-9-23-28)25-14-6-13-5-11(3)24-18(13)2
1-7-14/h5-10H,1-4H3,(H,21,24)(H,22,23,25) |
| InChIKey | OOQXPATWSOGSAV-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 | 18395443 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | FGFR1 | Flk-1/mouse | JAK3 | LCK | PDGFR-b | PKC alpha | VEGFR1 | VEGFR2 | ALL |
| Pub Chem Link |
22273644
|
| Drug Bank Link | - |
| ChemSpider Link | 11299359 |
| ChEMBL Link | CHEMBL261592 |
