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BDBM50014830 6-{2-[4-(4-Fluoro-phenyl)-2,6-dimethyl-pyrimidin-5-yl]-ethyl}-4-hydroxy-tetrahydro-pyran-2-one::CHEMBL158323

SMILES: Cc1nc(C)c(CCC2C[C@@H](O)CC(=O)O2)c(n1)-c1ccc(F)cc1

InChI Key: InChIKey=ITYLRAWIKSIRJL-AAFJCEBUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50014830   
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
HMG-CoA reductase


(Rattus norvegicus (rat))		BDBM50014830
PNG
(6-{2-[4-(4-Fluoro-phenyl)-2,6-dimethyl-pyrimidin-5...)
Show SMILES Cc1nc(C)c(CCC2C[C@@H](O)CC(=O)O2)c(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C19H21FN2O3/c1-11-17(8-7-16-9-15(23)10-18(24)25-16)19(22-12(2)21-11)13-3-5-14(20)6-4-13/h3-6,15-16,23H,7-10H2,1-2H3/t15-,16?/m1/s1
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PC cid
PC sid
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PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of rat liver HMG-CoA reductase

J Med Chem 33: 52-60 (1990)


BindingDB Entry DOI: 10.7270/Q22N5177
More data for this
Ligand-Target Pair