Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000259
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article52 compound
IUPAC NameN-(3-bromophenyl)-8-methoxyquinazolin-4-amine
FormulaC15H12BrN3O
Mass330.179
Exact Mass329.0163747
Composition C (54.56%), H (3.66%), Br (24.2%), N (12.73%), O (4.85%)
Atom Count32
PI9.15
Smilesc12c(c(ccc1)OC)ncnc2Nc1cccc(c1)Br
InChI1S/C15H12BrN3O/c1-20-13-7-3-6-12-14(13)17-9-18-15(12)19-11-5-2-4-10(16)8-11/h2-9H,1H3,(H,17,18,19)
InChIKeyWCJIZSYSAHKAQF-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 | 9154973 |
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 5328049
Drug Bank Link -
ChemSpider Link 4485216
ChEMBL Link CHEMBL289787
 
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