General Property |
Molceule ID (DB) | EGIN0003737 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 55 compound |
IUPAC Name | (3Z)-3-[(4-bromothiophen-2-yl)methylidene]-2,3-dihydro-1H-indol-2-one |
Formula | C13H8BrNOS |
Mass | 306.178 |
Exact Mass | 304.9509972 |
Composition | C (51%), H (2.63%), Br (26.1%), N (4.57%), O (5.23%), S (10.47%) |
Atom Count | 25 |
PI | 4.61 |
Smiles | C1(=C/c2cc(cs2)Br)/C(=O)Nc2c1cccc2 |
InChI | 1S/C13H8BrNOS/c14-8-5-9(17-7-8)6-11-10-3-1-2-4-12(10)15-13(11)16/h1-7H,(H,15,16)/b11-6- |
InChIKey | ONXUHKXDKGXHFK-WDZFZDKYSA-N |
2D Structure | | Structure Backbone | |
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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 |
6036100
|
Drug Bank Link | - |
ChemSpider Link | 4786582 |
ChEMBL Link | CHEMBL316268 |