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BDBM50033970 1-(2-{[2-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-ethyl]-methyl-amino}-ethyl)-3-isopropyl-1-(2-morpholin-4-yl-ethyl)-urea::CHEMBL11110

SMILES: CC(C)NC(=O)N(CCN(C)CCSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1)CCN1CCOCC1

InChI Key: InChIKey=OZXSADUUGFAWPU-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033970   
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)		BDBM50033970
PNG
(1-(2-{[2-(4,5-Diphenyl-1H-imidazol-2-ylsulfanyl)-e...)
Show SMILES CC(C)NC(=O)N(CCN(C)CCSc1nc(c([nH]1)-c1ccccc1)-c1ccccc1)CCN1CCOCC1
Show InChI InChI=1S/C30H42N6O2S/c1-24(2)31-30(37)36(17-15-35-18-21-38-22-19-35)16-14-34(3)20-23-39-29-32-27(25-10-6-4-7-11-25)28(33-29)26-12-8-5-9-13-26/h4-13,24H,14-23H2,1-3H3,(H,31,37)(H,32,33)
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 350n/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