Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000260
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article20 compound
IUPAC NameN-(3-bromophenyl)-1H-pyrazolo[4,3-g]quinazolin-5-amine
FormulaC15H10BrN5
Mass340.177
Exact Mass339.011958
Composition C (52.96%), H (2.96%), Br (23.49%), N (20.59%)
Atom Count31
PI8.12
Smilesc12c(cc3c(c1)cn[nH]3)ncnc2Nc1cccc(c1)Br
InChI1S/C15H10BrN5/c16-10-2-1-3-11(5-10)20-15-12-4-9-7-19-21-13(9)6-14(12)17-8-18-15/h1-8H,(H,19,21)(H,17
,18,20)
InChIKeyORCWMSOZENFEDR-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 | 9154973 | 10639288 |
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 5328242
Drug Bank Link -
ChemSpider Link 4485407
ChEMBL Link CHEMBL39337
 
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