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SMILES: CC(C)n1c(CCP(O)(=O)CC(=O)CC(O)=O)c(-c2ccc(F)cc2)c2ccccc12

InChI Key: InChIKey=YWOFVQNRTDEKOQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50406124   
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
3-hydroxy-3-methylglutaryl-coenzyme A reductase


(Rattus norvegicus (rat))		BDBM50406124
PNG
(CHEMBL330182)
Show SMILES CC(C)n1c(CCP(O)(=O)CC(=O)CC(O)=O)c(-c2ccc(F)cc2)c2ccccc12
Show InChI InChI=1S/C23H25FNO5P/c1-15(2)25-20-6-4-3-5-19(20)23(16-7-9-17(24)10-8-16)21(25)11-12-31(29,30)14-18(26)13-22(27)28/h3-10,15H,11-14H2,1-2H3,(H,27,28)(H,29,30)
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PubMed
n/an/a 26n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat microsomal HMG-CoA reductase activity by 50%

J Med Chem 33: 2952-6 (1990)


BindingDB Entry DOI: 10.7270/Q22Z16Q5
More data for this
Ligand-Target Pair