Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003756
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article30 compound
IUPAC Name6-(2,6-dichlorophenyl)-8-methyl-2-{[3-(morpholin-4-yl)propyl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
FormulaC21H23Cl2N5O2
Mass448.346
Exact Mass447.1228804
Composition C (56.26%), H (5.17%), Cl (15.82%), N (15.62%), O (7.14%)
Atom Count53
PI11.29
Smilesn1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)NCCCN1CCOCC1)C
InChI1S/C21H23Cl2N5O2/c1-27-19-14(12-15(20(27)29)18-16(22)4-2-5-17(18)23)13-25-21(26-19)24-6-3-7-28-8-10-
30-11-9-28/h2,4-5,12-13H,3,6-11H2,1H3,(H,24,25,26)
InChIKeyCSLJSOAIJCEXMF-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
Reference9703473
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFr | c-Src | PDGFr | ALL
Pub Chem Link 5327877
Drug Bank Link -
ChemSpider Link 4485047
ChEMBL Link CHEMBL48172
 
TOP