General Property |
Molceule ID (DB) | EGIN0003717 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 35 compound |
IUPAC Name | (3Z)-3-[(4-bromophenyl)methylidene]-1-methyl-2,3-dihydro-1H-indol-2-one |
Formula | C16H12BrNO |
Mass | 314.177 |
Exact Mass | 313.0102267 |
Composition | C (61.17%), H (3.85%), Br (25.43%), N (4.46%), O (5.09%) |
Atom Count | 31 |
PI | No isoelectric point. |
Smiles | C1(=C/c2ccc(Br)cc2)/C(=O)N(c2c1cccc2)C |
InChI | 1S/C16H12BrNO/c1-18-15-5-3-2-4-13(15)14(16(18)19)10-11-6-8-12(17)9-7-11/h2-10H,1H3/b14-10- |
InChIKey | NQKLYDSSGXCLDH-UVTDQMKNSA-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 |
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Drug Bank Link | - |
ChemSpider Link | 4557664 |
ChEMBL Link | CHEMBL314021 |