lipoicacid-donepezil-cpd5

IC50 AChE 7.63+/-1.35 BChE 1.48+/-0.15 nM

General

Type : Multitarget, Sulfur Compound, Alkyl linked bis-ligand, Derivative of Donepezil

Chemical_Nomenclature : 2-((1-Benzylpiperidin-4-yl)methyl)-5-lipoic-oxy,6-methoxy-2,3-dihydro-1H-inden-1-one

Canonical SMILES : C1=CC=CC(=C1)CN2CCC(CC2)CC4CC3=CC(=C(C=C3C4=O)OCCCCC5CCSS5)OC

InChI : InChI=1S\/C30H39NO3S2\/c1-33-28-19-24-18-25(17-22-10-13-31(14-11-22)21-23-7-3-2-4-8-23)30(32)27(24)20-29(28)34-15-6-5-9-26-12-16-35-36-26\/h2-4,7-8,19-20,22,25-26H,5-6,9-18,21H2,1H3

InChIKey : MDLAFFSFUOWBNI-UHFFFAOYSA-N

Other name(s) : Compound 5


MW : 525.76

Formula : C30H39NO3S2

CAS_number :

PubChem :

UniChem : MDLAFFSFUOWBNI-UHFFFAOYSA-N

Target

Families : lipoicacid-donepezil-cpd5 ligand of proteins in family
ACHE BCHE

Protein :
human-ACHE human-BCHE

References

No reference