Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000948
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article28 compound
IUPAC NameN-benzyl-5-methoxyquinazolin-4-amine
FormulaC16H15N3O
Mass265.3098
Exact Mass265.1215121
Composition C (72.43%), H (5.7%), N (15.84%), O (6.03%)
Atom Count35
PI11.45
Smilesc12c(cccc1OC)ncnc2NCc1ccccc1
InChI1S/C16H15N3O/c1-20-14-9-5-8-13-15(14)16(19-11-18-13)17-10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,17,18
,19)
InChIKeyWRYWVLLIKZNFQK-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
Reference7658435
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 5328026
Drug Bank Link -
ChemSpider Link 4485193
ChEMBL Link CHEMBL330882
 
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