Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002071
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence Article PP202
IUPAC Name3-(4-amino-3-methoxyphenyl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
FormulaC15H18N6O
Mass298.343
Exact Mass298.1542092
Composition C (60.39%), H (6.08%), N (28.17%), O (5.36%)
Atom Count40
PI13.11
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)N)OC
InChI1S/C15H18N6O/c1-8(2)21-15-12(14(17)18-7-19-15)13(20-21)9-4-5-10(16)11(6-9)22-3/h4-8H,16H2,1-3H3,(H2,
17,18,19)
InChIKeyJDOVRLNHIYWZKZ-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 24905251
Drug Bank Link -
ChemSpider Link 24605208
ChEMBL Link CHEMBL1241485
 
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