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BDBM50194795 CHEMBL3945505

SMILES: NC(=N)NCCCCCCCCCNc1c2CCCCc2nc2ccccc12

InChI Key: InChIKey=UVRCMRBQQUPCKC-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50194795   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50194795
PNG
(CHEMBL3945505)
Show SMILES NC(=N)NCCCCCCCCCNc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C23H35N5/c24-23(25)27-17-11-5-3-1-2-4-10-16-26-22-18-12-6-8-14-20(18)28-21-15-9-7-13-19(21)22/h6,8,12,14H,1-5,7,9-11,13,15-17H2,(H,26,28)(H4,24,25,27)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 31n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measured after 5 ...


Bioorg Med Chem 24: 5162-5171 (2016)


Article DOI: 10.1016/j.bmc.2016.08.036
BindingDB Entry DOI: 10.7270/Q2V98B0N
More data for this
Ligand-Target Pair