Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002878
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence ArticleI10 compound
IUPAC NameN-(tert-butoxy)-5-[(E)-[(2,5-dihydroxyphenyl)methylidene]amino]-2-hydroxybenzamide
FormulaC18H20N2O5
Mass344.3618
Exact Mass344.1372218
Composition C (62.78%), H (5.85%), N (8.13%), O (23.23%)
Atom Count45
PI4.48
Smilesc1(C(=O)NOC(C)(C)C)c(ccc(/N=C/c2c(ccc(c2)O)O)c1)O
InChI1S/C18H20N2O5/c1-18(2,3)25-20-17(24)14-9-12(4-6-16(14)23)19-10-11-8-13(21)5-7-15(11)22/h4-10,21-23H,
1-3H3,(H,20,24)/b19-10+
InChIKeyZFSPTZPQHFFVNF-VXLYETTFSA-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
Reference8145236
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 15467467
Drug Bank Link -
ChemSpider Link 23239399
ChEMBL Link CHEMBL353879
 
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