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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50208255   
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


(Equus caballus (Horse))		BDBM50208255
PNG
(CHEMBL3885238)
Show SMILES O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCNC2CCN(Cc3ccccc3)C2)CC1
Show InChI InChI=1S/C31H37N5O2S/c37-39(38,28-10-5-2-6-11-28)36-18-15-29-30(12-7-13-31(29)36)35-22-20-33(21-23-35)19-16-32-27-14-17-34(25-27)24-26-8-3-1-4-9-26/h1-13,15,18,27,32H,14,16-17,19-25H2
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.39E+3n/an/an/an/an/an/a



Jagiellonian University Collegium Medicum

Curated by ChEMBL


Assay Description
Inhibition of equine serum BuChE preincubated for 5 mins followed by butyrylthiocholine iodide substrate addition measured after 5 mins by Ellman's m...

Eur J Med Chem 124: 63-81 (2016)


Article DOI: 10.1016/j.ejmech.2016.08.016
BindingDB Entry DOI: 10.7270/Q2PZ5BT8
More data for this
Ligand-Target Pair