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BDBM50040214 CHEMBL3359471

SMILES: Cl.COc1cccc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)c1

InChI Key: InChIKey=AMTYCQPCZIHCBB-YNYSCKANSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50040214   
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
Acetylcholinesterase


(Mus musculus (mouse))
BDBM50040214
PNG
(CHEMBL3359471)
Show SMILES Cl.COc1cccc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)c1
Show InChI InChI=1S/C23H25NO4.ClH/c1-26-18-7-5-6-17(14-18)15-22-23(25)20-9-8-19(16-21(20)28-22)27-13-12-24-10-3-2-4-11-24;/h5-9,14-16H,2-4,10-13H2,1H3;1H/b22-15-;
PDB
MMDB

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Similars

Article
PubMed
n/an/a 1.15E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of ICR mouse brain AChE using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition by modified Ellman'...


Bioorg Med Chem 23: 231-40 (2014)


Article DOI: 10.1016/j.bmc.2014.11.004
BindingDB Entry DOI: 10.7270/Q2V126FS
More data for this
Ligand-Target Pair