Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004766
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article14
IUPAC NameN-(3-chloro-4-fluorophenyl)-7-methoxy-6-[2-(methylamino)ethoxy]quinazolin-4-amine
FormulaC18H18ClFN4O2
Mass376.813
Exact Mass376.1102318
Composition C (57.37%), H (4.81%), Cl (9.41%), F (5.04%), N (14.87%), O (8.49%)
Atom Count44
PI12.78
Smilesc1c(c(cc2c1c(ncn2)Nc1ccc(c(c1)Cl)F)OC)OCCNC
InChI1S/C18H18ClFN4O2/c1-21-5-6-26-17-8-12-15(9-16(17)25-2)22-10-23-18(12)24-11-3-4-14(20)13(19)7-11/h3-4
,7-10,21H,5-6H2,1-2H3,(H,22,23,24)
InChIKeyMCLWOTRQSAKXBH-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
Reference11459659
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 23150416
ChEMBL Link CHEMBL293090
 
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