BDBM50660222 CHEMBL6168386

SMILES O=C1CCC(N2C(=O)c3cccc(NC4CCC(NC(=O)CCCCn5cc(CCC(=O)Oc6ccccc6C(=O)O)nn5)CC4)c3C2=O)C(=O)N1

InChI Key InChIKey=RQCHROSBEWTPMH-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50660222   

TargetProstaglandin G/H synthase 2(Human)
Yunnan University of Chinese Medicine

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50660222BDBM50660222(CHEMBL6168386)
Affinity DataIC50: 5.40E+4nMAssay Description:Inhibition of human recombinant COX-2 using S0168-2 as substrate preincubated for 10 mins followed by substrate addition and measured after 10 mins b...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed