Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004773
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article14
IUPAC Name5-[(6,7-dimethoxyquinazolin-4-yl)amino]quinolin-8-ol
FormulaC19H16N4O3
Mass348.3553
Exact Mass348.1222404
Composition C (65.51%), H (4.63%), N (16.08%), O (13.78%)
Atom Count42
PI6.99
SmilesCOc1c(OC)cc2c(Nc3ccc(c4c3cccn4)O)ncnc2c1
InChI1S/C19H16N4O3/c1-25-16-8-12-14(9-17(16)26-2)21-10-22-19(12)23-13-5-6-15(24)18-11(13)4-3-7-20-18/h3-1
0,24H,1-2H3,(H,21,22,23)
InChIKeyDSPJVVIDMZGAPA-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
Pub Chem Link 15908166
Drug Bank Link -
ChemSpider Link -
ChEMBL Link -
 
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