Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002588
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence Article11 compound
IUPAC Namemethyl 5-[(E)-[(3,4-dihydroxyphenyl)methylidene]amino]-2-hydroxybenzoate
FormulaC15H13NO5
Mass287.2674
Exact Mass287.0793725
Composition C (62.72%), H (4.56%), N (4.88%), O (27.85%)
Atom Count34
PI5.31
Smilesc1(C(=O)OC)c(ccc(/N=C/c2cc(c(cc2)O)O)c1)O
InChI1S/C15H13NO5/c1-21-15(20)11-7-10(3-5-12(11)17)16-8-9-2-4-13(18)14(19)6-9/h2-8,17-19H,1H3/b16-8+
InChIKeyBGESZZJVBUFLFZ-LZYBPNLTSA-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 15857251
Drug Bank Link -
ChemSpider Link 23210069
ChEMBL Link CHEMBL131092
 
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