Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001144
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article14 compound
IUPAC Name1-cyclohexyl-3-[6-(2,6-dichlorophenyl)-2-{[3-(4-methylpiperazin-1-yl)propyl]amino}pyrido[2,3-d]pyrimidin-7-yl]urea
FormulaC28H36Cl2N8O
Mass571.544
Exact Mass570.2389132
Composition C (58.84%), H (6.35%), Cl (12.41%), N (19.61%), O (2.8%)
Atom Count75
PI9.97
Smilesc12c(nc(nc1)NCCCN1CCN(CC1)C)nc(c(c2)c1c(cccc1Cl)Cl)NC(=O)NC1CCCCC1
InChI1S/C28H36Cl2N8O/c1-37-13-15-38(16-14-37)12-6-11-31-27-32-18-19-17-21(24-22(29)9-5-10-23(24)30)26(34-
25(19)35-27)36-28(39)33-20-7-3-2-4-8-20/h5,9-10,17-18,20H,2-4,6-8,11-16H2,1H3,(H3,31,32,33,34,35,36,
39)
InChIKeyCLVSAAPONJRSGJ-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 enzymesPDGFr | FGFr | FGFr | ALL
Pub Chem Link 5328158
Drug Bank Link -
ChemSpider Link 4485325
ChEMBL Link CHEMBL51028
 
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