BDBM50143303 (3aS,9bR)-1-Methyl-8-undecyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinolin-8-ium; iodide::(3aS,9bR)-1-methyl-8-undecyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-h]isoquinolin-8-ium iodide::CHEMBL52983

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

InChI Key: InChIKey=CHKKAPUNVLHQPC-JTHBVZDNSA-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 = 50143303   

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))	BDBM50143303 ((3aS,9bR)-1-Methyl-8-undecyl-2,3,3a,4,5,9b-hexahyd...) Show SMILES CCCCCCCCCCC[n+]1ccc2CC[C@H]3CCN(C)[C@H]3c2c1 Show InChI InChI=1S/C23H39N2/c1-3-4-5-6-7-8-9-10-11-16-25-18-15-20-12-13-21-14-17-24(2)23(21)22(20)19-25/h15,18-19,21,23H,3-14,16-17H2,1-2H3/q+1/t21-,23+/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	40	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Inhibition of [3H]-nicotine binding to Nicotinic acetylcholine receptor alpha4-beta2 in rat brain				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