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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50016872'   
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))
BDBM50016872
PNG
(CHEMBL3276421)
Show SMILES [Br-].CC(=O)OCC[n+]1cc2ccccc2c2ccccc12
Show InChI InChI=1S/C17H16NO2.BrH/c1-13(19)20-11-10-18-12-14-6-2-3-7-15(14)16-8-4-5-9-17(16)18;/h2-9,12H,10-11H2,1H3;1H/q+1;/p-1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
380n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of electric eel acetylcholinesterase using acetylcholine bromide as substrate assessed as free enzyme-inhibitor com...


J Med Chem 20: 1617-23 (1978)


BindingDB Entry DOI: 10.7270/Q29025BQ
More data for this
Ligand-Target Pair