| General Property |
| Molceule ID (DB) | EGIN0003713 |
| Inhibitor Class | Indolinone |
| Molecule Name in Refrence Article | 31 compound |
| IUPAC Name | (3Z)-3-[(3-bromo-5-tert-butyl-4-methoxyphenyl)methylidene]-2,3-dihydro-1H-indol-2-one |
| Formula | C20H20BrNO2 |
| Mass | 386.282 |
| Exact Mass | 385.0677415 |
| Composition | C (62.19%), H (5.22%), Br (20.69%), N (3.63%), O (8.28%) |
| Atom Count | 44 |
| PI | 4.63 |
| Smiles | C1(=C/c2cc(c(c(c2)Br)OC)C(C)(C)C)/C(=O)Nc2c1cccc2 |
| InChI | 1S/C20H20BrNO2/c1-20(2,3)15-10-12(11-16(21)18(15)24-4)9-14-13-7-5-6-8-17(13)22-19(14)23/h5-11H,1-4H3
,(H,22,23)/b14-9- |
| InChIKey | XEFHBSLLSUQSHE-ZROIWOOFSA-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 | 9651163 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | IGF1R | PDGFR | FLK-1 | ALL |
| Pub Chem Link |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 23176551 |
| ChEMBL Link | CHEMBL87746 |
