Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004778
Inhibitor ClassUnknown
Molecule Name in Refrence Article13
IUPAC NameN-(2-chlorophenyl)-2-{[5,6-dimethyl-3-(4-methylphenyl)-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
FormulaC23H20ClN3O2S2
Mass470.007
Exact Mass469.068546
Composition C (58.77%), H (4.29%), Cl (7.54%), N (8.94%), O (6.81%), S (13.64%)
Atom Count51
PI7.13
Smilesc1c(ccc(c1)n1c(=O)c2c(c(sc2nc1SCC(=O)Nc1ccccc1Cl)C)C)C
InChI1S/C23H20ClN3O2S2/c1-13-8-10-16(11-9-13)27-22(29)20-14(2)15(3)31-21(20)26-23(27)30-12-19(28)25-18-7-
5-4-6-17(18)24/h4-11H,12H2,1-3H3,(H,25,28)
InChIKeyFJGPPKWMLNVLAK-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
Reference22227214
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 3138425
Drug Bank Link -
ChemSpider Link 2390939
ChEMBL Link CHEMBL1944641
 
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