Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003710
Inhibitor ClassIndolinone
Molecule Name in Refrence Article28 compound
IUPAC Name4-{[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}benzoic acid
FormulaC16H11NO3
Mass265.2634
Exact Mass265.0738932
Composition C (72.45%), H (4.18%), N (5.28%), O (18.09%)
Atom Count31
PI1.02
SmilesC1(=C/c2ccc(C(=O)O)cc2)/C(=O)Nc2c1cccc2
InChI1S/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-
InChIKeyYILTUWKDVMACDH-LCYFTJDESA-N
2D Structure
Structure Backbone
View Structure in JmolClick to view 3 d structure                            Download Mol File
Drug Like PropertyDruglikeliness
Symmetry & GeometrySymmetry And Geometrical Information
Activity & Binding Activity against isoform and covalant binding information
Topological PropertiesDescriptors
Reference9651163
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesFLK-1 | IGF1R | PDGFR | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 1766896
ChEMBL Link CHEMBL313259
 
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