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SMILES: OC(=O)[C@H]1CC[C@H](COc2cccc(c2)[C@@H](NC(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)CC1

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50595422   
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
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50595422
PNG
(CHEMBL5177499)
Show SMILES OC(=O)[C@H]1CC[C@H](COc2cccc(c2)[C@@H](NC(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)CC1 |r,wU:6.6,15.16,wD:20.20,3.2,(-9.34,-3.08,;-9.34,-1.54,;-10.67,-.77,;-8,-.77,;-6.67,-1.54,;-5.33,-.77,;-5.33,.77,;-4,1.54,;-2.67,.77,;-1.33,1.54,;-1.33,3.08,;,3.85,;1.33,3.08,;1.33,1.54,;,.77,;2.67,.77,;4,1.54,;5.33,.77,;5.33,-.77,;6.67,1.54,;8,.77,;8,-.77,;9.34,-1.54,;10.67,-.77,;10.67,.77,;9.34,1.54,;10.05,.31,;8.62,-.31,;2.67,-.77,;1.33,-1.54,;1.33,-3.08,;2.67,-3.85,;4,-3.08,;4,-1.54,;-6.67,1.54,;-8,.77,)|
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Article
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 1n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL




J Med Chem 48: 4500-3 (2005)


Article DOI: 10.1021/acs.jmedchem.2c00609
BindingDB Entry DOI: 10.7270/Q2TH8RQS
More data for this
Ligand-Target Pair