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SMILES: [O-][N+](=O)c1ccc2n(CCN3CCOCC3)nc(OCc3ccc4ccccc4c3)c2c1

InChI Key: InChIKey=UPOOBDMZXYSRQK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50447019   
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
Cholinesterase


(Equus caballus (Horse))		BDBM50447019
PNG
(CHEMBL3116295)
Show SMILES [O-][N+](=O)c1ccc2n(CCN3CCOCC3)nc(OCc3ccc4ccccc4c3)c2c1
Show InChI InChI=1S/C24H24N4O4/c29-28(30)21-7-8-23-22(16-21)24(25-27(23)10-9-26-11-13-31-14-12-26)32-17-18-5-6-19-3-1-2-4-20(19)15-18/h1-8,15-16H,9-14,17H2
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Instituto de Qu£mica M£dica (CSIC)

Curated by ChEMBL


Assay Description
Inhibition of horse serum BuChE using butyrylthiocholine as substrate by Ellman's method

Eur J Med Chem 73: 56-72 (2014)


Article DOI: 10.1016/j.ejmech.2013.11.026
BindingDB Entry DOI: 10.7270/Q2474CC8
More data for this
Ligand-Target Pair