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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50074274'   
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
Cholinesterase


(Homo sapiens (Human))
BDBM50074274
PNG
(CHEMBL1083057 | CHEMBL553187 | N-Benzyl-N-methyl-N...)
Show SMILES CN(CCCCCNc1ccc(nn1)-c1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C23H28N4/c1-27(19-20-11-5-2-6-12-20)18-10-4-9-17-24-23-16-15-22(25-26-23)21-13-7-3-8-14-21/h2-3,5-8,11-16H,4,9-10,17-19H2,1H3,(H,24,26)
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MMDB

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Article
PubMed
n/an/a 340n/an/an/an/an/an/a



Universit£ Louis Pasteur

Curated by ChEMBL


Assay Description
Inhibitory concentration against Butyrylcholinesterase (BuChE) from human serum


J Med Chem 42: 730-41 (1999)


Article DOI: 10.1021/jm981101z
BindingDB Entry DOI: 10.7270/Q26M37JW
More data for this
Ligand-Target Pair