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BDBM50007263 CHEMBL317576::Sodium; 6-{2,4-dichloro-6-[3-(4-fluoro-phenoxy)-1-(4-fluoro-phenyl)-propyl]-phenoxy}-3,5-dihydroxy-hexanoate

SMILES: OC(COc1c(Cl)cc(Cl)cc1C(CCOc1ccc(F)cc1)c1ccc(F)cc1)C[C@@H](O)CC([O-])=O

InChI Key: InChIKey=ZAZHQOBUAOBXJC-HVIUMASTSA-M

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50007263   
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))
BDBM50007263
PNG
(CHEMBL317576 | Sodium; 6-{2,4-dichloro-6-[3-(4-flu...)
Show SMILES OC(COc1c(Cl)cc(Cl)cc1C(CCOc1ccc(F)cc1)c1ccc(F)cc1)C[C@@H](O)CC([O-])=O
Show InChI InChI=1S/C27H26Cl2F2O6/c28-17-11-24(27(25(29)12-17)37-15-21(33)13-20(32)14-26(34)35)23(16-1-3-18(30)4-2-16)9-10-36-22-7-5-19(31)6-8-22/h1-8,11-12,20-21,23,32-33H,9-10,13-15H2,(H,34,35)/p-1/t20-,21?,23?/m1/s1
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Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


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


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair