Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001941
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article2a compound
IUPAC Name6,7-dimethoxy-4-(2-phenylethynyl)quinazoline
FormulaC18H14N2O2
Mass290.316
Exact Mass290.1055277
Composition C (74.47%), H (4.86%), N (9.65%), O (11.02%)
Atom Count36
PINo isoelectric point.
Smilesc1(c(cc2c(c1)c(ncn2)C#Cc1ccccc1)OC)OC
InChI1S/C18H14N2O2/c1-21-17-10-14-15(9-8-13-6-4-3-5-7-13)19-12-20-16(14)11-18(17)22-2/h3-7,10-12H,1-2H3
InChIKeyASHKAXPHUUQQTC-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 18770812
Drug Bank Link -
ChemSpider Link 11675280
ChEMBL Link CHEMBL250315
 
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