Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002590
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence Article13 compound
IUPAC Name2-hydroxy-5-{[(2-hydroxyphenyl)methyl]amino}benzoic acid
FormulaC14H13NO4
Mass259.2573
Exact Mass259.0844579
Composition C (64.86%), H (5.05%), N (5.4%), O (24.68%)
Atom Count32
PI4.13
Smilesc1(C(=O)O)c(ccc(c1)NCc1c(O)cccc1)O
InChI1S/C14H13NO4/c16-12-4-2-1-3-9(12)8-15-10-5-6-13(17)11(7-10)14(18)19/h1-7,15-17H,8H2,(H,18,19)
InChIKeyWSUKEAJMTLBGAN-UHFFFAOYSA-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 10106602
Drug Bank Link -
ChemSpider Link 8282128
ChEMBL Link CHEMBL131407
 
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