Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003188
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article3j compound
IUPAC NameN-{3-[(6,7-dimethoxyquinazolin-4-yl)methyl]phenyl}-3-(dimethylamino)benzamide
FormulaC26H26N4O3
Mass442.5096
Exact Mass442.2004907
Composition C (70.57%), H (5.92%), N (12.66%), O (10.85%)
Atom Count59
PI7.91
Smilesc12cc(c(cc1ncnc2Cc1cc(ccc1)NC(=O)c1cc(ccc1)N(C)C)OC)OC
InChI1S/C26H26N4O3/c1-30(2)20-10-6-8-18(13-20)26(31)29-19-9-5-7-17(11-19)12-22-21-14-24(32-3)25(33-4)15-2
3(21)28-16-27-22/h5-11,13-16H,12H2,1-4H3,(H,29,31)
InChIKeyUAFGSWDDPWJHGW-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
Reference15454232
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesp38 alpha |
Pub Chem Link -
Drug Bank Link -
ChemSpider Link -
ChEMBL Link CHEMBL365830
 
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