Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000522
Inhibitor ClassThiazolidinone
Molecule Name in Refrence Article20 compound
IUPAC Name2-[(E)-2-[(3-nitrophenyl)methylidene]hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one
FormulaC10H8N4O3S
Mass264.261
Exact Mass264.0317108
Composition C (45.45%), H (3.05%), N (21.2%), O (18.16%), S (12.13%)
Atom Count26
PI6.54
Smilesc1c(cccc1N(=O)=O)/C=N/NC1=NC(=O)CS1
InChI1S/C10H8N4O3S/c15-9-6-18-10(12-9)13-11-5-7-2-1-3-8(4-7)14(16)17/h1-5H,6H2,(H,12,13,15)/b11-5+
InChIKeyYNQAVHDYELGQNG-VZUCSPMQSA-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
Reference19914835
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 6862734
Drug Bank Link -
ChemSpider Link 5259810
ChEMBL Link CHEMBL591050
 
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