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BDBM50033965 1-(2-{3-[4,5-Bis-(4-methoxy-phenyl)-1H-imidazol-2-ylsulfanyl]-propoxy}-ethyl)-1-[2-(2-hydroxy-ethoxy)-ethyl]-3-isopropyl-urea::CHEMBL416705

SMILES: COc1ccc(cc1)-c1nc(SCCCOCCN(CCOCCO)C(=O)NC(C)C)[nH]c1-c1ccc(OC)cc1

InChI Key: InChIKey=CBGAKXALIFHFDJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033965   
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)		BDBM50033965
PNG
(1-(2-{3-[4,5-Bis-(4-methoxy-phenyl)-1H-imidazol-2-...)
Show SMILES COc1ccc(cc1)-c1nc(SCCCOCCN(CCOCCO)C(=O)NC(C)C)[nH]c1-c1ccc(OC)cc1
Show InChI InChI=1S/C30H42N4O6S/c1-22(2)31-30(36)34(15-19-40-20-16-35)14-18-39-17-5-21-41-29-32-27(23-6-10-25(37-3)11-7-23)28(33-29)24-8-12-26(38-4)13-9-24/h6-13,22,35H,5,14-21H2,1-4H3,(H,31,36)(H,32,33)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 480n/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