Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001558
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article24 compound
IUPAC NameN-(3-bromophenyl)pyrazino[2,3-g]quinazolin-4-amine
FormulaC16H10BrN5
Mass352.188
Exact Mass351.011958
Composition C (54.56%), H (2.86%), Br (22.69%), N (19.89%)
Atom Count32
PI9.42
Smilesc12c(cc3c(c1)nccn3)ncnc2Nc1cccc(c1)Br
InChI1S/C16H10BrN5/c17-10-2-1-3-11(6-10)22-16-12-7-14-15(19-5-4-18-14)8-13(12)20-9-21-16/h1-9H,(H,20,21,2
2)
InChIKeyZZAZKOOJVIBTOP-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
Reference8632415
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 5328246
Drug Bank Link -
ChemSpider Link 4485411
ChEMBL Link CHEMBL173498
 
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