Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001576
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article49 compound
IUPAC NameN-(2H-1,3-benzodioxol-5-yl)-6,7-dimethoxyquinazolin-4-amine
FormulaC17H15N3O4
Mass325.3187
Exact Mass325.106256
Composition C (62.76%), H (4.65%), N (12.92%), O (19.67%)
Atom Count39
PI10.47
Smilesc12c(cc(c(c1)OC)OC)ncnc2Nc1ccc2c(c1)OCO2
InChI1S/C17H15N3O4/c1-21-14-6-11-12(7-15(14)22-2)18-8-19-17(11)20-10-3-4-13-16(5-10)24-9-23-13/h3-8H,9H2,
1-2H3,(H,18,19,20)
InChIKeyRXCOORSCJFAIDB-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
Reference18702009
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesRICK |
Pub Chem Link 1474861
Drug Bank Link -
ChemSpider Link 1216687
ChEMBL Link CHEMBL1369868
 
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