Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002082
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence Article PP358
IUPAC Name5-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-chlorophenol
FormulaC14H14ClN5O
Mass303.747
Exact Mass303.0886878
Composition C (55.36%), H (4.65%), Cl (11.67%), N (23.06%), O (5.27%)
Atom Count35
PI7.03
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)Cl)O
InChI1S/C14H14ClN5O/c1-7(2)20-14-11(13(16)17-6-18-14)12(19-20)8-3-4-9(15)10(21)5-8/h3-7,21H,1-2H3,(H2,16,
17,18)
InChIKeyZBTLTVIYBHYEHL-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
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 24905295
Drug Bank Link -
ChemSpider Link 24605163
ChEMBL Link CHEMBL1241484
 
TOP