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BDBM50011027 2-Ethyl-1-[2-(4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-4,5-diphenyl-1H-pyrrole-3-carboxylic acid ethyl ester::CHEMBL420337

SMILES: CCOC(=O)c1c(CC)n(CC[C@@H]2C[C@@H](O)CC(=O)O2)c(c1-c1ccccc1)-c1ccccc1

InChI Key: InChIKey=NSRNYHXNPLWZPI-FGZHOGPDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50011027   
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))
BDBM50011027
PNG
(2-Ethyl-1-[2-(4-hydroxy-6-oxo-tetrahydro-pyran-2-y...)
Show SMILES CCOC(=O)c1c(CC)n(CC[C@@H]2C[C@@H](O)CC(=O)O2)c(c1-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C28H31NO5/c1-3-23-26(28(32)33-4-2)25(19-11-7-5-8-12-19)27(20-13-9-6-10-14-20)29(23)16-15-22-17-21(30)18-24(31)34-22/h5-14,21-22,30H,3-4,15-18H2,1-2H3/t21-,22-/m1/s1
PDB
MMDB

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PC cid
PC sid
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Similars

PubMed
n/an/a 890n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of HMG-CoA reductase activity in partially purified rat liver


J Med Chem 34: 357-66 (1991)


BindingDB Entry DOI: 10.7270/Q2NV9H6F
More data for this
Ligand-Target Pair