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SMILES: NC(=O)c1cnc(s1)N1CCN(CC1)S(=O)(=O)c1ccccc1C(F)(F)F

InChI Key: InChIKey=PBXOWQOJFURGKM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50312681   
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
Acyl-CoA desaturase 1


(Rattus norvegicus (Rat))		BDBM50312681
PNG
(2-(4-(2-(trifluoromethyl)phenylsulfonyl)piperazin-...)
Show SMILES NC(=O)c1cnc(s1)N1CCN(CC1)S(=O)(=O)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C15H15F3N4O3S2/c16-15(17,18)10-3-1-2-4-12(10)27(24,25)22-7-5-21(6-8-22)14-20-9-11(26-14)13(19)23/h1-4,9H,5-8H2,(H2,19,23)
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Similars
Article
PubMed
n/an/a>3.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibition of SCD1 in Wistar rat liver microsome assessed as [3H]stearoyl-CoA to [3H]oleoyl-CoA conversion pretreated 1 hr before [3H]stearoyl-CoA ad...

Bioorg Med Chem Lett 20: 1593-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.083
BindingDB Entry DOI: 10.7270/Q2DJ5FR0
More data for this
Ligand-Target Pair