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BDBM50011205 CHEMBL3349882::CHEMBL342975::Sodium; 6-(4''-fluoro-4'-isopropyl-4-methyl-[1,1';2',1'']terphenyl-3'-yloxy)-3,5-dihydroxy-hexanoate

SMILES: [Na+].CC(C)c1ccc(-c2ccc(C)cc2)c(-c2ccc(F)cc2)c1OC[C@@H](O)C[C@@H](O)CC([O-])=O

InChI Key: InChIKey=XFEHAFSETWBAJC-WTQRLHSKSA-M

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50011205   
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))		BDBM50011205
PNG
(CHEMBL3349882 | Sodium; 6-(4''-fluoro-4'-isopropyl...)
Show SMILES [Na+].CC(C)c1ccc(-c2ccc(C)cc2)c(-c2ccc(F)cc2)c1OC[C@@H](O)C[C@@H](O)CC([O-])=O
Show InChI InChI=1S/C28H31FO5/c1-17(2)24-12-13-25(19-6-4-18(3)5-7-19)27(20-8-10-21(29)11-9-20)28(24)34-16-23(31)14-22(30)15-26(32)33/h4-13,17,22-23,30-31H,14-16H2,1-3H3,(H,32,33)/p-1/t22-,23?/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Ability to inhibit microsomal preparation of HMG-CoA reductase in rat liver.

J Med Chem 34: 463-6 (1991)


BindingDB Entry DOI: 10.7270/Q2MS3TC4
More data for this
Ligand-Target Pair