Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002157
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP325
IUPAC Name5-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenol
FormulaC15H17N5O2
Mass299.3278
Exact Mass299.1382248
Composition C (60.19%), H (5.72%), N (23.4%), O (10.69%)
Atom Count39
PI8.04
Smilesn1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)OC)O
InChI1S/C15H17N5O2/c1-8(2)20-15-12(14(16)17-7-18-15)13(19-20)9-4-5-11(22-3)10(21)6-9/h4-8,21H,1-3H3,(H2,1
6,17,18)
InChIKeyKUUKOPMICNKRGE-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 24905288
Drug Bank Link -
ChemSpider Link 24605171
ChEMBL Link CHEMBL1242114
 
TOP