| General Property |
| Molceule ID (DB) | EGIN0004128 |
| Inhibitor Class | Pyrrole-dione |
| Molecule Name in Refrence Article | 24 compound |
| IUPAC Name | 4-{1-[(tert-butoxy)methyl]-1H-indol-3-yl}-3-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one |
| Formula | C26H30N2O5 |
| Mass | 450.5268 |
| Exact Mass | 450.2154721 |
| Composition | C (69.31%), H (6.71%), N (6.22%), O (17.76%) |
| Atom Count | 63 |
| PI | 7.34 |
| Smiles | C1(=C(CNC1=O)c1cn(c2c1cccc2)COC(C)(C)C)c1cc(c(c(c1)OC)OC)OC |
| InChI | 1S/C26H30N2O5/c1-26(2,3)33-15-28-14-19(17-9-7-8-10-20(17)28)18-13-27-25(29)23(18)16-11-21(30-4)24(32
-6)22(12-16)31-5/h7-12,14H,13,15H2,1-6H3,(H,27,29) |
| InChIKey | ZFKGDYZACMFEDS-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 | 18529047 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | TIE2 | FLT3 | CDK2/CycA | CDK4/CycD1 | InsR | FAK | SAK | MET | Aurora A | BRAF-VE | PDGFR beta | Aurora B | SRC | VEGFR2 | VEGFR3 | IGF1R | COT | ALL |
| Pub Chem Link |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 23329543 |
| ChEMBL Link | CHEMBL488646 |
