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SMILES: OC(=O)c1ccc(COc2cccc(c2)[C@@H](NC(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)o1

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50595411   
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))		BDBM50595411
PNG
(CHEMBL5170720)
Show SMILES OC(=O)c1ccc(COc2cccc(c2)[C@@H](NC(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)o1 |r,wU:15.16,wD:20.20,(-9.99,-2.42,;-8.45,-2.42,;-7.68,-3.75,;-7.68,-1.08,;-8.45,.25,;-7.42,1.4,;-6.01,.77,;-4.68,1.54,;-3.35,.77,;-2.01,1.54,;-2.01,3.08,;-.68,3.85,;.66,3.08,;.66,1.54,;-.68,.77,;1.99,.77,;3.32,1.54,;4.66,.77,;4.66,-.77,;5.99,1.54,;7.32,.77,;7.32,-.77,;8.66,-1.54,;9.99,-.77,;9.99,.77,;8.66,1.54,;9.37,.31,;7.95,-.31,;1.99,-.77,;.66,-1.54,;.66,-3.08,;1.99,-3.85,;3.32,-3.08,;3.32,-1.54,;-6.17,-.76,)|
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 25n/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