BDBM50224553 CHEMBL12639

SMILES: CC(COCC(C)OCC(C)OCC(C)N(CC(O)COc1ccccc1CC=C)CC(O)COc1ccccc1CC=C)NCC(O)COc1ccccc1CC=C

InChI Key: InChIKey=FEPGJGVMDYLVKX-UHFFFAOYSA-N

Data: 2 Kd

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 2 hits for monomerid = 50224553   

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
Adrenergic receptor beta (Rattus norvegicus (Rat))	BDBM50224553 (CHEMBL12639) Show SMILES CC(COCC(C)OCC(C)OCC(C)N(CC(O)COc1ccccc1CC=C)CC(O)COc1ccccc1CC=C)NCC(O)COc1ccccc1CC=C Show InChI InChI=1S/C48H70N2O9/c1-8-17-40-20-11-14-23-46(40)57-33-43(51)26-49-36(4)29-54-31-38(6)56-32-39(7)55-30-37(5)50(27-44(52)34-58-47-24-15-12-21-41(47)18-9-2)28-45(53)35-59-48-25-16-13-22-42(48)19-10-3/h8-16,20-25,36-39,43-45,49,51-53H,1-3,17-19,26-35H2,4-7H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards rat beta adrenergic receptor from heart membranes.				J Med Chem 26: 7-11 (1983) BindingDB Entry DOI: 10.7270/Q20867H8
					More data for this Ligand-Target Pair
Adrenergic receptor beta (Rattus norvegicus (Rat))	BDBM50224553 (CHEMBL12639) Show SMILES CC(COCC(C)OCC(C)OCC(C)N(CC(O)COc1ccccc1CC=C)CC(O)COc1ccccc1CC=C)NCC(O)COc1ccccc1CC=C Show InChI InChI=1S/C48H70N2O9/c1-8-17-40-20-11-14-23-46(40)57-33-43(51)26-49-36(4)29-54-31-38(6)56-32-39(7)55-30-37(5)50(27-44(52)34-58-47-24-15-12-21-41(47)18-9-2)28-45(53)35-59-48-25-16-13-22-42(48)19-10-3/h8-16,20-25,36-39,43-45,49,51-53H,1-3,17-19,26-35H2,4-7H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards rat beta adrenergic receptor from lung membranes.				J Med Chem 26: 7-11 (1983) BindingDB Entry DOI: 10.7270/Q20867H8
					More data for this Ligand-Target Pair