Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002070
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence Article PP15
IUPAC Name4-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenol
FormulaC15H17N5O2
Mass299.3278
Exact Mass299.1382248
Composition C (60.19%), H (5.72%), N (23.4%), O (10.69%)
Atom Count39
PI7.97
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)O)OC
InChI1S/C15H17N5O2/c1-8(2)20-15-12(14(16)17-7-18-15)13(19-20)9-4-5-10(21)11(6-9)22-3/h4-8,21H,1-3H3,(H2,1
6,17,18)
InChIKeyBZYKWEQWEPHEQZ-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 -
Drug Bank Link -
ChemSpider Link 24605120
ChEMBL Link CHEMBL1242112
 
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