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BDBM74312 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanone::2-(4-bromo-2,5-dimethylphenyl)sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone::2-[(4-bromo-2,5-dimethyl-phenyl)thio]-1-[4-(2-furoyl)piperazino]ethanone::2-[(4-bromo-2,5-dimethylphenyl)thio]-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]ethanone::MLS002182089::SMR001271119::cid_25162898

SMILES: Cc1cc(SCC(=O)N2CCN(CC2)C(=O)c2ccco2)c(C)cc1Br

InChI Key: InChIKey=DYQDVMIKHUUDTG-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 74312   
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
LANA


(Human herpesvirus 8)		BDBM74312
PNG
(2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-1-[4-(f...)
Show SMILES Cc1cc(SCC(=O)N2CCN(CC2)C(=O)c2ccco2)c(C)cc1Br
Show InChI InChI=1S/C19H21BrN2O3S/c1-13-11-17(14(2)10-15(13)20)26-12-18(23)21-5-7-22(8-6-21)19(24)16-4-3-9-25-16/h3-4,9-11H,5-8,12H2,1-2H3
PDB

KEGG

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>7.50E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Primary Collaborators: Kenneth Kaye,Brigham & Womens,Boston MA,kkaye@rics.bwh.harvard.edu,617-525-4256 Chantal Beauchemin,Brigham & Womens,Boston MA,...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2HH6HHN
More data for this
Ligand-Target Pair