Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000516
Inhibitor ClassThiazolidinone
Molecule Name in Refrence Article14 compound
IUPAC Name2-[(E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one
FormulaC10H7Br2N3O2S
Mass393.054
Exact Mass390.8625725
Composition C (30.56%), H (1.8%), Br (40.66%), N (10.69%), O (8.14%), S (8.16%)
Atom Count25
PI5.96
Smilesc1(c(cc(cc1Br)Br)/C=N/NC1=NC(=O)CS1)O
InChI1S/C10H7Br2N3O2S/c11-6-1-5(9(17)7(12)2-6)3-13-15-10-14-8(16)4-18-10/h1-3,17H,4H2,(H,14,15,16)/b13-3+
InChIKeyXNOWWTBMMKXRCZ-QLKAYGNNSA-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 -
Drug Bank Link -
ChemSpider Link 12939113
ChEMBL Link CHEMBL590875
 
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