BDBM50188180 4-[(2S,5S,8S,11S,14S)-1-amino-14-(ethylamino)-2,5,8,11-tetrakis[(4-hydroxyphenyl)methyl]-3,6,9,12-tetraazapentadecan-15-yl]phenol::CHEMBL213319

SMILES: CCN[C@H](CN[C@H](CN[C@H](CN[C@H](CN[C@H](CN)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1

InChI Key: InChIKey=KFYOTWGNXBFSGC-FDXDWZSASA-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 = 50188180   

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
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50188180 (4-[(2S,5S,8S,11S,14S)-1-amino-14-(ethylamino)-2,5,...) Show SMILES CCN[C@H](CN[C@H](CN[C@H](CN[C@H](CN[C@H](CN)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1 Show InChI InChI=1S/C47H62N6O5/c1-2-49-39(24-34-5-15-44(55)16-6-34)29-51-41(26-36-9-19-46(57)20-10-36)31-53-42(27-37-11-21-47(58)22-12-37)32-52-40(25-35-7-17-45(56)18-8-35)30-50-38(28-48)23-33-3-13-43(54)14-4-33/h3-22,38-42,49-58H,2,23-32,48H2,1H3/t38-,39-,40-,41-,42-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	146	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in rat brain homogenate				Bioorg Med Chem Lett 16: 4331-8 (2006) Article DOI: 10.1016/j.bmcl.2006.05.053 BindingDB Entry DOI: 10.7270/Q2028R47
					More data for this Ligand-Target Pair