Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002586
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence Article9 compound
IUPAC Namemethyl 5-[(E)-[(2,5-dimethoxyphenyl)methylidene]amino]-2-hydroxybenzoate
FormulaC17H17NO5
Mass315.3206
Exact Mass315.1106727
Composition C (64.75%), H (5.43%), N (4.44%), O (25.37%)
Atom Count40
PI5.25
Smilesc1(C(=O)OC)c(ccc(/N=C/c2c(ccc(c2)OC)OC)c1)O
InChI1S/C17H17NO5/c1-21-13-5-7-16(22-2)11(8-13)10-18-12-4-6-15(19)14(9-12)17(20)23-3/h4-10,19H,1-3H3/b18-
10+
InChIKeyNXHOBVAJCSTTHA-VCHYOVAHSA-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 8556416
ChEMBL Link CHEMBL340449
 
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