| General Property |
| Molceule ID (DB) | EGIN0003718 |
| Inhibitor Class | Indolinone |
| Molecule Name in Refrence Article | 36 compound |
| IUPAC Name | (3Z)-3-[(3-bromo-5-tert-butyl-4-methoxyphenyl)methylidene]-5-chloro-2,3-dihydro-1H-indol-2-one |
| Formula | C20H19BrClNO2 |
| Mass | 420.727 |
| Exact Mass | 419.0287692 |
| Composition | C (57.09%), H (4.55%), Br (18.99%), Cl (8.43%), N (3.33%), O (7.61%) |
| Atom Count | 44 |
| PI | 4.62 |
| Smiles | C1(=C/c2cc(c(c(c2)Br)OC)C(C)(C)C)/C(=O)Nc2c1cc(cc2)Cl |
| InChI | 1S/C20H19BrClNO2/c1-20(2,3)15-8-11(9-16(21)18(15)25-4)7-14-13-10-12(22)5-6-17(13)23-19(14)24/h5-10H,
1-4H3,(H,23,24)/b14-7- |
| InChIKey | NWSAURDZWOHHFM-AUWJEWJLSA-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 | FLK-1 | IGF1R | PDGFR | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 23176642 |
| ChEMBL Link | CHEMBL86944 |
