BDBM72884 2-[3-[(2-fluorophenyl)methyl]quinoxalin-2-yl]sulfanylacetic acid::2-[3-[(2-fluorophenyl)methyl]quinoxalin-2-yl]sulfanylethanoic acid::2-[[3-(2-fluorobenzyl)quinoxalin-2-yl]thio]acetic acid::2-[[3-[(2-fluorophenyl)methyl]-2-quinoxalinyl]thio]acetic acid::MLS001197933::SMR000559520::cid_22334931::{[3-(2-fluorobenzyl)quinoxalin-2-yl]thio}acetic acid

SMILES OC(=O)CSc1nc2ccccc2nc1Cc1ccccc1F

InChI Key InChIKey=XBNOFYLEZDIRLK-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 72884   

TargetHistamine H4 receptor(Human)
Faes Farma

US Patent
LigandChemical structure of BindingDB Monomer ID 72884BDBM72884(US12492199, Example 94)
Affinity DataIC50: 100nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/20/2026
Entry Details PCBioAssay
TargetHistamine H1 receptor(Human)
Faes Farma

US Patent
LigandChemical structure of BindingDB Monomer ID 72884BDBM72884(US12492199, Example 94)
Affinity DataIC50: 1.00E+3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/20/2026
Entry Details PCBioAssay