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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50161791'   
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))
BDBM50161791
PNG
(CHEMBL178294 | o-Tolyl-carbamic acid 1-methyl-8,10...)
Show SMILES Cc1ccccc1NC(=O)Oc1ccc2OC3CC(C)(CO3)c2c1
Show InChI InChI=1S/C19H19NO4/c1-12-5-3-4-6-15(12)20-18(21)23-13-7-8-16-14(9-13)19(2)10-17(24-16)22-11-19/h3-9,17H,10-11H2,1-2H3,(H,20,21)
PDB
MMDB

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Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



National Institute on Aging

Curated by ChEMBL


Assay Description
Inhibitory concentration against human plasma Butyrylcholinesterase


J Med Chem 48: 986-94 (2005)


Article DOI: 10.1021/jm049309+
BindingDB Entry DOI: 10.7270/Q2TM7BWQ
More data for this
Ligand-Target Pair