Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002129
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP148
IUPAC Name6-{4-amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-4H-chromen-4-one
FormulaC15H11N5O2
Mass293.2801
Exact Mass293.0912746
Composition C (61.43%), H (3.78%), N (23.88%), O (10.91%)
Atom Count33
PI10.98
Smilesn1cnc2c(c1N)c(nn2C)c1cc2c(cc1)occc2=O
InChI1S/C15H11N5O2/c1-20-15-12(14(16)17-7-18-15)13(19-20)8-2-3-11-9(6-8)10(21)4-5-22-11/h2-7H,1H3,(H2,16,
17,18)
InChIKeyIXPOSFVTGQUOAI-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
Reference18849971
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 24905234
Drug Bank Link -
ChemSpider Link 24605225
ChEMBL Link CHEMBL1242117
 
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