BDBM50143298 (3aS,9bR)-1-Methyl-8-octyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinolin-8-ium; iodide::(3aS,9bR)-1-methyl-8-octyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinolin-8-ium iodide::CHEMBL301648

SMILES: CCCCCCCC[n+]1ccc2CC[C@H]3CCN(C)[C@H]3c2c1

InChI Key: InChIKey=XQKHDMICHMPMEP-AZUAARDMSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50143298   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50143298 ((3aS,9bR)-1-Methyl-8-octyl-2,3,3a,4,5,9b-hexahydro...) Show SMILES CCCCCCCC[n+]1ccc2CC[C@H]3CCN(C)[C@H]3c2c1 Show InChI InChI=1S/C20H33N2/c1-3-4-5-6-7-8-13-22-15-12-17-9-10-18-11-14-21(2)20(18)19(17)16-22/h12,15-16,18,20H,3-11,13-14H2,1-2H3/q+1/t18-,20+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Inhibitory activity of the compound against nAChR mediated nicotine-evoked [3H]-DA overflow using rat striatal slices				Bioorg Med Chem Lett 14: 1869-74 (2004) Article DOI: 10.1016/j.bmcl.2003.10.074 BindingDB Entry DOI: 10.7270/Q21N80JP
					More data for this Ligand-Target Pair