Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000515
Inhibitor ClassThiazolidinone
Molecule Name in Refrence Article13 compound
IUPAC Name2-[(E)-2-[(3,5-dichloro-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4,5-dihydro-1,3-thiazol-4-one
FormulaC10H7Cl2N3O2S
Mass304.152
Exact Mass302.9636026
Composition C (39.49%), H (2.32%), Cl (23.31%), N (13.82%), O (10.52%), S (10.54%)
Atom Count25
PI5.85
Smilesc1(c(cc(cc1Cl)Cl)/C=N/NC1=NC(=O)CS1)O
InChI1S/C10H7Cl2N3O2S/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+
InChIKeyBBFZNAMYBDLSGK-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 12939112
ChEMBL Link CHEMBL592481
 
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