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BDBM50033955 CHEMBL11201::N-{5-[4,5-Bis-(4-dimethylamino-phenyl)-1H-imidazol-2-ylsulfanyl]-pentyl}-2-cyclohexyl-N-heptyl-acetamide

SMILES: CCCCCCCN(CCCCCSc1nc(c([nH]1)-c1ccc(cc1)N(C)C)-c1ccc(cc1)N(C)C)C(=O)CC1CCCCC1

InChI Key: InChIKey=MKPRLCRSDHUWNW-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033955   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Sterol O-acyltransferase, Soat


(Rattus norvegicus)		BDBM50033955
PNG
(CHEMBL11201 | N-{5-[4,5-Bis-(4-dimethylamino-pheny...)
Show SMILES CCCCCCCN(CCCCCSc1nc(c([nH]1)-c1ccc(cc1)N(C)C)-c1ccc(cc1)N(C)C)C(=O)CC1CCCCC1
Show InChI InChI=1S/C39H59N5OS/c1-6-7-8-9-14-27-44(36(45)30-31-17-12-10-13-18-31)28-15-11-16-29-46-39-40-37(32-19-23-34(24-20-32)42(2)3)38(41-39)33-21-25-35(26-22-33)43(4)5/h19-26,31H,6-18,27-30H2,1-5H3,(H,40,41)
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 50n/an/an/an/an/an/a



DuPont Merck Research Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit 50% activity of Acyl coenzyme A:cholesterol acyltransferase 1 in vitro using rat liver microsome.

J Med Chem 38: 1067-83 (1995)


BindingDB Entry DOI: 10.7270/Q28S4P0T
More data for this
Ligand-Target Pair