Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 442.6 BDBM50110524

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50110524 (4-Cyclohexyl-1-[4-(4-methoxy-benzenesulfonyl)-benz...) Show SMILES COc1ccc(cc1)S(=O)(=O)c1ccc(CN2CCN(C[C@H]2C)C2CCCCC2)cc1 Show InChI InChI=1S/C25H34N2O3S/c1-20-18-27(22-6-4-3-5-7-22)17-16-26(20)19-21-8-12-24(13-9-21)31(28,29)25-14-10-23(30-2)11-15-25/h8-15,20,22H,3-7,16-19H2,1-2H3/t20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Binding affinity against human cloned Muscarinic acetylcholine receptor M2.				Bioorg Med Chem Lett 12: 791-4 (2002) BindingDB Entry DOI: 10.7270/Q2VH5N5J
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