Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002585
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence Article8 compound
IUPAC Name3-[(E)-[(2,5-dihydroxyphenyl)methylidene]amino]benzoic acid
FormulaC14H11NO4
Mass257.2414
Exact Mass257.0688078
Composition C (65.37%), H (4.31%), N (5.44%), O (24.88%)
Atom Count30
PI2.81
Smilesc1(/C=N/c2cc(C(=O)O)ccc2)c(ccc(c1)O)O
InChI1S/C14H11NO4/c16-12-4-5-13(17)10(7-12)8-15-11-3-1-2-9(6-11)14(18)19/h1-8,16-17H,(H,18,19)/b15-8+
InChIKeyVULKLJVTDOSAHQ-OVCLIPMQSA-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
Reference8258833
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 23210121
ChEMBL Link CHEMBL130116
 
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