Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002134
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP154
IUPAC Name6-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-1H-indazol-3-amine
FormulaC15H16N8
Mass308.3411
Exact Mass308.1497926
Composition C (58.43%), H (5.23%), N (36.34%)
Atom Count39
PI10.79
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc2c(cc1)c(n[nH]2)N
InChI1S/C15H16N8/c1-7(2)23-15-11(14(17)18-6-19-15)12(22-23)8-3-4-9-10(5-8)20-21-13(9)16/h3-7H,1-2H3,(H3,1
6,20,21)(H2,17,18,19)
InChIKeyQBPMDFDPUIVKQA-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 24905239
Drug Bank Link -
ChemSpider Link 24605220
ChEMBL Link CHEMBL1242476
 
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