Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001955
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article2m compound
IUPAC Name6,7-dimethoxy-4-[2-(2-phenylphenyl)ethynyl]quinazoline
FormulaC24H18N2O2
Mass366.4119
Exact Mass366.1368278
Composition C (78.67%), H (4.95%), N (7.65%), O (8.73%)
Atom Count46
PINo isoelectric point.
Smilesc1(c(cc2c(c1)c(ncn2)C#Cc1c(cccc1)c1ccccc1)OC)OC
InChI1S/C24H18N2O2/c1-27-23-14-20-21(25-16-26-22(20)15-24(23)28-2)13-12-18-10-6-7-11-19(18)17-8-4-3-5-9-1
7/h3-11,14-16H,1-2H3
InChIKeyZUBUFJOEYHKFCQ-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
Reference17869510
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 23306768
ChEMBL Link CHEMBL250924
 
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