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SMILES: [O-][N+](=O)Nc1nccn1Cc1ccc(Cl)nc1

InChI Key: InChIKey=TYLCDJYHUVCRBH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50114766   
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
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Homo sapiens (Human))
BDBM50114766
PNG
((2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitro-1,3-...)
Show SMILES [O-][N+](=O)Nc1nccn1Cc1ccc(Cl)nc1
Show InChI InChI=1S/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)
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MMDB

NCI pathway
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Patents

PubMed
470n/an/an/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Potency to displace [3H]-Nicotine binding to Nicotinic acetylcholine receptor alpha4-beta2 immuno-isolated from M10 cells


J Med Chem 45: 2832-40 (2002)


BindingDB Entry DOI: 10.7270/Q2KD1X85
More data for this
Ligand-Target Pair