Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002114
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP132
IUPAC Name1-(propan-2-yl)-3-(quinoxalin-6-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
FormulaC16H15N7
Mass305.3372
Exact Mass305.1388935
Composition C (62.94%), H (4.95%), N (32.11%)
Atom Count38
PI13.13
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc2c(cc1)nccn2
InChI1S/C16H15N7/c1-9(2)23-16-13(15(17)20-8-21-16)14(22-23)10-3-4-11-12(7-10)19-6-5-18-11/h3-9H,1-2H3,(H2
,17,20,21)
InChIKeyAGEIBLLCZVGHLI-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 24905218
Drug Bank Link -
ChemSpider Link 24605241
ChEMBL Link CHEMBL1241774
 
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