Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001911
Inhibitor ClassNaphthyridine
Molecule Name in Refrence Article26 compound
IUPAC Name4-(cyclohexylamino)-6-[(pyridin-3-ylmethyl)amino]-1,7-naphthyridine-3-carbonitrile
FormulaC21H22N6
Mass358.4396
Exact Mass358.1905947
Composition C (70.37%), H (6.19%), N (23.45%)
Atom Count49
PI12.32
Smilesc1ncc(cc1)CNc1ncc2c(c1)c(c(cn2)C#N)NC1CCCCC1
InChI1S/C21H22N6/c22-10-16-13-24-19-14-26-20(25-12-15-5-4-8-23-11-15)9-18(19)21(16)27-17-6-2-1-3-7-17/h4-
5,8-9,11,13-14,17H,1-3,6-7,12H2,(H,24,27)(H,25,26)
InChIKeyYZGIQVIHULYDNX-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
Reference17664070
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesTpl2 |
Pub Chem Link 44435406
Drug Bank Link -
ChemSpider Link 23298408
ChEMBL Link CHEMBL393707
 
TOP