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BDBM50079708 3-(Benzo[b]thiophen-2-ylsulfanyl)-4-hydroxy-6-phenethyl-6-phenyl-5,6-dihydro-pyran-2-one::CHEMBL62158

SMILES: O=C1CC(CCc2ccccc2)(OC(=O)C1Sc1cc2ccccc2s1)c1ccccc1

InChI Key: InChIKey=TXSJLLXFVMAZEV-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50079708   
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
Human immunodeficiency virus type 1 protease


(Human immunodeficiency virus type 1)
BDBM50079708
PNG
(3-(Benzo[b]thiophen-2-ylsulfanyl)-4-hydroxy-6-phen...)
Show SMILES O=C1CC(CCc2ccccc2)(OC(=O)C1Sc1cc2ccccc2s1)c1ccccc1
Show InChI InChI=1/C27H22O3S2/c28-22-18-27(21-12-5-2-6-13-21,16-15-19-9-3-1-4-10-19)30-26(29)25(22)32-24-17-20-11-7-8-14-23(20)31-24/h1-14,17,25H,15-16,18H2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 363n/an/an/an/a4.7n/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against human immunodeficiency virus type 1(HIV-1) protease at pH 4.7


Bioorg Med Chem Lett 9: 2019-24 (1999)


Article DOI: 10.1016/s0960-894x(99)00332-7
BindingDB Entry DOI: 10.7270/Q2PZ5814
More data for this
Ligand-Target Pair