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BDBM50011040 6-{2-[6-Fluoro-4-(4-fluoro-phenyl)-2-isopropyl-quinolin-3-yl]-vinyl}-4-hydroxy-tetrahydro-pyran-2-one::CHEMBL123082

SMILES: CC(C)c1nc2ccc(F)cc2c(-c2ccc(F)cc2)c1\C=C\[C@@H]1C[C@@H](O)CC(=O)O1

InChI Key: InChIKey=XDKQXVMPRDYWHY-TYFAACHXSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50011040   
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))
BDBM50011040
PNG
(6-{2-[6-Fluoro-4-(4-fluoro-phenyl)-2-isopropyl-qui...)
Show SMILES CC(C)c1nc2ccc(F)cc2c(-c2ccc(F)cc2)c1\C=C\[C@@H]1C[C@@H](O)CC(=O)O1
Show InChI InChI=1S/C25H23F2NO3/c1-14(2)25-20(9-8-19-12-18(29)13-23(30)31-19)24(15-3-5-16(26)6-4-15)21-11-17(27)7-10-22(21)28-25/h3-11,14,18-19,29H,12-13H2,1-2H3/b9-8+/t18-,19-/m1/s1
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of HMG-CoA reductase (COR) in rats.


J Med Chem 34: 367-73 (1991)


Article DOI: 10.1021/jm00105a057
BindingDB Entry DOI: 10.7270/Q2J38RHG
More data for this
Ligand-Target Pair