General Property |
Molceule ID (DB) | EGIN0003710 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 28 compound |
IUPAC Name | 4-{[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}benzoic acid |
Formula | C16H11NO3 |
Mass | 265.2634 |
Exact Mass | 265.0738932 |
Composition | C (72.45%), H (4.18%), N (5.28%), O (18.09%) |
Atom Count | 31 |
PI | 1.02 |
Smiles | C1(=C/c2ccc(C(=O)O)cc2)/C(=O)Nc2c1cccc2 |
InChI | 1S/C16H11NO3/c18-15-13(12-3-1-2-4-14(12)17-15)9-10-5-7-11(8-6-10)16(19)20/h1-9H,(H,17,18)(H,19,20)/b
13-9- |
InChIKey | YILTUWKDVMACDH-LCYFTJDESA-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 | 1766896 |
ChEMBL Link | CHEMBL313259 |