Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002123
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP141
IUPAC Name6-{4-amino-1-cyclopentyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-1,2-dihydroquinolin-2-one
FormulaC19H18N6O
Mass346.3858
Exact Mass346.1542092
Composition C (65.88%), H (5.24%), N (24.26%), O (4.62%)
Atom Count44
PI10.08
Smilesn1cnc2c(c1N)c(nn2C1CCCC1)c1cc2c(cc1)[nH]c(=O)cc2
InChI1S/C19H18N6O/c20-18-16-17(12-5-7-14-11(9-12)6-8-15(26)23-14)24-25(13-3-1-2-4-13)19(16)22-10-21-18/h5
-10,13H,1-4H2,(H,23,26)(H2,20,21,22)
InChIKeyDSVSJEPFPNNSGX-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 24905227
Drug Bank Link -
ChemSpider Link 24605232
ChEMBL Link CHEMBL1241864
 
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