Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002099
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP105
IUPAC Name1-(propan-2-yl)-3-(quinolin-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
FormulaC17H16N6
Mass304.3491
Exact Mass304.1436445
Composition C (67.09%), H (5.3%), N (27.61%)
Atom Count39
PI13.12
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc2c(nc1)cccc2
InChI1S/C17H16N6/c1-10(2)23-17-14(16(18)20-9-21-17)15(22-23)12-7-11-5-3-4-6-13(11)19-8-12/h3-10H,1-2H3,(H
2,18,20,21)
InChIKeyHGALDAPNHYJZAJ-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 24905200
Drug Bank Link -
ChemSpider Link 24605259
ChEMBL Link CHEMBL1242754
 
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