Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001998
Inhibitor ClassPyrimidine
Molecule Name in Refrence Article1 compound
IUPAC Name1-(2,6-dichlorophenyl)-3-[6-({4-[2-(diethylamino)ethoxy]phenyl}amino)pyrimidin-4-yl]urea
FormulaC23H26Cl2N6O2
Mass489.398
Exact Mass488.1494295
Composition C (56.45%), H (5.35%), Cl (14.49%), N (17.17%), O (6.54%)
Atom Count59
PI9.73
Smilesn1c(cc(nc1)NC(=O)Nc1c(cccc1Cl)Cl)Nc1ccc(cc1)OCCN(CC)CC
InChI1S/C23H26Cl2N6O2/c1-3-31(4-2)12-13-33-17-10-8-16(9-11-17)28-20-14-21(27-15-26-20)29-23(32)30-22-18(2
4)6-5-7-19(22)25/h5-11,14-15H,3-4,12-13H2,1-2H3,(H3,26,27,28,29,30,32)
InChIKeyFOMAIMPXVLHOCI-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
Reference18248988
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesAxl | CDK2 | c-Met | FLT3 | IGF1R | JAK2 | PKA | PKB | PDGFR beta | BRAF | c-Abl | TIE2 | P38 | EphB4 | FGFR1 | c-Src | c-Kit | KDR | ALL
Pub Chem Link 24882503
Drug Bank Link -
ChemSpider Link 23312432
ChEMBL Link CHEMBL253292
 
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