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SMILES: CN(CCOCCNC(=S)Nc1cccnc1)Cc1ccccc1

InChI Key: InChIKey=ANNNAAMLISZACR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50032389   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Acetylcholinesterase


(Rattus norvegicus (rat))		BDBM50032389
PNG
(1-{2-[2-(Benzyl-methyl-amino)-ethoxy]-ethyl}-3-pyr...)
Show SMILES CN(CCOCCNC(=S)Nc1cccnc1)Cc1ccccc1
Show InChI InChI=1S/C18H24N4OS/c1-22(15-16-6-3-2-4-7-16)11-13-23-12-10-20-18(24)21-17-8-5-9-19-14-17/h2-9,14H,10-13,15H2,1H3,(H2,20,21,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



Centre de Recherche Pierre Fabre

Curated by ChEMBL


Assay Description
In vitro inhibitory effect on rat Acetylcholinesterase

J Med Chem 38: 2969-73 (1995)


BindingDB Entry DOI: 10.7270/Q22B8X2S
More data for this
Ligand-Target Pair