Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001147
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article21 compound
IUPAC Name1-{2-amino-6-[2-chloro-4-(3,5-dimethoxyphenyl)phenyl]pyrido[2,3-d]pyrimidin-7-yl}-3-tert-butylurea
FormulaC26H27ClN6O3
Mass506.984
Exact Mass506.1833165
Composition C (61.6%), H (5.37%), Cl (6.99%), N (16.58%), O (9.47%)
Atom Count63
PI7.97
Smilesc12c(nc(nc1)N)nc(c(c2)c1ccc(cc1Cl)c1cc(cc(c1)OC)OC)NC(=O)NC(C)(C)C
InChI1S/C26H27ClN6O3/c1-26(2,3)33-25(34)32-23-20(10-16-13-29-24(28)31-22(16)30-23)19-7-6-14(11-21(19)27)1
5-8-17(35-4)12-18(9-15)36-5/h6-13H,1-5H3,(H4,28,29,30,31,32,33,34)
InChIKeyKTGHPNIMGVYFET-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
Reference9599227
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFr | PDGFr | FGFr | ALL
Pub Chem Link 10037831
Drug Bank Link -
ChemSpider Link -
ChEMBL Link CHEMBL299763
 
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