Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002301
Inhibitor ClassThiazolo-pyrimidine
Molecule Name in Refrence Article6e compound
IUPAC Name4-({7-[(3-chloro-4-fluorophenyl)amino]-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}amino)benzene-1-sulfonamide
FormulaC17H12ClFN6O2S2
Mass450.898
Exact Mass450.013571
Composition C (45.28%), H (2.68%), Cl (7.86%), F (4.21%), N (18.64%), O (7.1%), S (14.22%)
Atom Count41
PI7.05
Smilesn1c(sc2c1ncnc2Nc1cc(c(cc1)F)Cl)Nc1ccc(cc1)S(=O)(=O)N
InChI1S/C17H12ClFN6O2S2/c18-12-7-10(3-6-13(12)19)23-15-14-16(22-8-21-15)25-17(28-14)24-9-1-4-11(5-2-9)29(
20,26)27/h1-8H,(H2,20,26,27)(H2,21,22,23,24,25)
InChIKeyQMAYPCNOXVCKRW-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
Reference19286381
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 44592212
Drug Bank Link -
ChemSpider Link 24694399
ChEMBL Link CHEMBL469355
 
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