Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002154
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP320
IUPAC Name5-{4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methylphenol
FormulaC12H11N5O
Mass241.2486
Exact Mass241.09636
Composition C (59.74%), H (4.6%), N (29.03%), O (6.63%)
Atom Count29
PI7.83
Smilesn1cnc2c(c1N)c(n[nH]2)c1cc(c(cc1)C)O
InChI1S/C12H11N5O/c1-6-2-3-7(4-8(6)18)10-9-11(13)14-5-15-12(9)17-16-10/h2-5,18H,1H3,(H3,13,14,15,16,17)
InChIKeyZTWYTYUOHYGWSG-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 24905285
Drug Bank Link -
ChemSpider Link 24605174
ChEMBL Link CHEMBL1241270
 
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