| General Property |
| Molceule ID (DB) | EGIN0003157 |
| Inhibitor Class | Triazine |
| Molecule Name in Refrence Article | 5 compound |
| IUPAC Name | N-[4-methyl-3-({3-[4-(methylamino)-1,3,5-triazin-2-yl]pyridin-2-yl}oxy)phenyl]-3-(1,1,2,2-tetrafluoroethoxy)benzamide |
| Formula | C25H20F4N6O3 |
| Mass | 528.4583 |
| Exact Mass | 528.1533014 |
| Composition | C (56.82%), H (3.81%), F (14.38%), N (15.9%), O (9.08%) |
| Atom Count | 58 |
| PI | 6.6 |
| Smiles | c1(cc(ccc1)OC(C(F)F)(F)F)C(=O)Nc1cc(Oc2c(c3nc(ncn3)NC)cccn2)c(cc1)C |
| InChI | 1S/C25H20F4N6O3/c1-14-8-9-16(34-21(36)15-5-3-6-17(11-15)38-25(28,29)23(26)27)12-19(14)37-22-18(7-4-1
0-31-22)20-32-13-33-24(30-2)35-20/h3-13,23H,1-2H3,(H,34,36)(H,30,32,33,35) |
| InChIKey | GHRNBCMJJKMYNR-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 | 17350837 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | BTK | c-Kit | c-Met | EGFR | FGFR | IGFR1 | Jak2 | JNK3 | KDR | Lck | p38 | Src | TIE2 | Zap70 | ALL |
| Pub Chem Link |
17748275
|
| Drug Bank Link | - |
| ChemSpider Link | 23304547 |
| ChEMBL Link | CHEMBL246356 |
