BDBM50143297 (3aS,9bR)-8-Dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinolin-8-ium; iodide::(3aS,9bR)-8-dodecyl-1-methyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinolin-8-ium iodide::CHEMBL300598

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

InChI Key: InChIKey=UJGPYZTZIBKMHJ-LADGPHEKSA-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 = 50143297   

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))	BDBM50143297 ((3aS,9bR)-8-Dodecyl-1-methyl-2,3,3a,4,5,9b-hexahyd...) Show SMILES CCCCCCCCCCCC[n+]1ccc2CC[C@H]3CCN(C)[C@H]3c2c1 Show InChI InChI=1S/C24H41N2/c1-3-4-5-6-7-8-9-10-11-12-17-26-19-16-21-13-14-22-15-18-25(2)24(22)23(21)20-26/h16,19-20,22,24H,3-15,17-18H2,1-2H3/q+1/t22-,24+/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	220	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