Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004782
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article13
IUPAC Name6,7-dimethoxy-N-(2-methyl-1H-1,3-benzodiazol-5-yl)quinazolin-4-amine
FormulaC18H17N5O2
Mass335.3599
Exact Mass335.1382248
Composition C (64.47%), H (5.11%), N (20.88%), O (9.54%)
Atom Count42
PI10.35
SmilesCOc1c(OC)cc2c(Nc3ccc4[nH]c(nc4c3)C)ncnc2c1
InChI1S/C18H17N5O2/c1-10-21-13-5-4-11(6-15(13)22-10)23-18-12-7-16(24-2)17(25-3)8-14(12)19-9-20-18/h4-9H,1
-3H3,(H,21,22)(H,19,20,23)
InChIKeyBTBAPAQGUCZBOA-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
Reference22867529
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
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