Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004646
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article10a
IUPAC Name4-amino-2,7-bis[(2-hydroxyethyl)amino]pyrido[2,3-d]pyrimidine-6-carbonitrile
FormulaC12H15N7O2
Mass289.2932
Exact Mass289.1287228
Composition C (49.82%), H (5.23%), N (33.89%), O (11.06%)
Atom Count36
PI9.09
Smilesc1(nc(nc2c1cc(c(n2)NCCO)C#N)NCCO)N
InChI1S/C12H15N7O2/c13-6-7-5-8-9(14)17-12(16-2-4-21)19-11(8)18-10(7)15-1-3-20/h5,20-21H,1-4H2,(H4,14,15,1
6,17,18,19)
InChIKeyOHOHOXQKGIAPQS-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
Reference22000924
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesCDK4/D | CDK2/A | ALL
Pub Chem Link 56935468
Drug Bank Link -
ChemSpider Link 28486010
ChEMBL Link CHEMBL1910274
 
TOP