Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002594
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence Article2 compound
IUPAC Name5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxybenzoic acid
FormulaC14H13NO5
Mass275.2567
Exact Mass275.0793725
Composition C (61.09%), H (4.76%), N (5.09%), O (29.06%)
Atom Count33
PI4.13
Smilesc1cc(cc(c1O)C(=O)O)NCc1c(ccc(c1)O)O
InChI1S/C14H13NO5/c16-10-2-4-12(17)8(5-10)7-15-9-1-3-13(18)11(6-9)14(19)20/h1-6,15-18H,7H2,(H,19,20)
InChIKeyLULATDWLDJOKCX-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
Reference7990108 | 8105084 | 8145236 | 8258833 |
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 3896
Drug Bank Link -
ChemSpider Link 3759
ChEMBL Link CHEMBL319620
 
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