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SMILES: [O-][N+](=O)c1ccc2n(Cc3ccc4ccccc4c3)nc(OCc3ccc4ccccc4c3)c2c1

InChI Key: InChIKey=JBWCNAHZWJPFEN-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50447017   
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))		BDBM50447017
PNG
(CHEMBL3116297)
Show SMILES [O-][N+](=O)c1ccc2n(Cc3ccc4ccccc4c3)nc(OCc3ccc4ccccc4c3)c2c1
Show InChI InChI=1S/C29H21N3O3/c33-32(34)26-13-14-28-27(17-26)29(35-19-21-10-12-23-6-2-4-8-25(23)16-21)30-31(28)18-20-9-11-22-5-1-3-7-24(22)15-20/h1-17H,18-19H2
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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