BDBM50271309 (2S,5S)-1-[2-(adamantan-1-yl)ethyl]-2-[(4-methoxyphenyl)methyl]-5-methyl-1H,2H,3H,5H,6H-imidazo[1,2-a]imidazolidin-7-ium

SMILES: COc1ccc(C[C@H]2CN3[C@@H](C)C[NH+]=C3N2CCC23CC4CC(CC(C4)C2)C3)cc1

InChI Key: InChIKey=WFFHFFYRKADMSL-ZEHGXIKOSA-O

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 = 50271309   

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
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50271309 ((2S,5S)-1-[2-(adamantan-1-yl)ethyl]-2-[(4-methoxyp...) Show SMILES COc1ccc(C[C@H]2CN3[C@@H](C)C[NH+]=C3N2CCC23CC4CC(CC(C4)C2)C3)cc1 |r,c:13,TLB:17:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18| Show InChI InChI=1S/C26H37N3O/c1-18-16-27-25-28(8-7-26-13-20-9-21(14-26)11-22(10-20)15-26)23(17-29(18)25)12-19-3-5-24(30-2)6-4-19/h3-6,18,20-23H,7-17H2,1-2H3/p+1/t18-,20?,21?,22?,23-,26?/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain homogenate				Bioorg Med Chem 16: 5932-8 (2008) Article DOI: 10.1016/j.bmc.2008.04.061 BindingDB Entry DOI: 10.7270/Q2BG2PW7
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