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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50157716   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50157716
PNG
(CHEMBL3786817)
Show SMILES CCN(CCCNC(=O)COc1ccc(\C=C\c2cc(OC)cc(OC)c2)cc1)Cc1ccccc1OC
Show InChI InChI=1S/C31H38N2O5/c1-5-33(22-26-9-6-7-10-30(26)37-4)18-8-17-32-31(34)23-38-27-15-13-24(14-16-27)11-12-25-19-28(35-2)21-29(20-25)36-3/h6-7,9-16,19-21H,5,8,17-18,22-23H2,1-4H3,(H,32,34)/b12-11+
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.69E+3n/an/an/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of Electrophorus electricus acetylcholinesterase using acetylthiocholine iodide substrate after 15 mins by spectrophotometric method

Bioorg Med Chem Lett 26: 2035-9 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.079
BindingDB Entry DOI: 10.7270/Q29C70BB
More data for this
Ligand-Target Pair