BDBM10209 5-[(5-{[(2S)-1-carboxy-4-{[(2-chlorophenyl)methyl]sulfanyl}-3-oxobutan-2-yl]carbamoyl}-5-phenylpentyl)sulfamoyl]-2-hydroxybenzoic acid::sulfonamide analog 31

SMILES OC(=O)C[C@H](NC(=O)C(CCCCNS(=O)(=O)c1ccc(O)c(c1)C(O)=O)c1ccccc1)C(=O)CSCc1ccccc1Cl

InChI Key InChIKey=GFLRQFSYBSQZCX-UHFFFAOYSA-N

Data  1 KI

  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 = 10209   

TargetCaspase-3(Human)
Sunesis Pharmaceuticals

LigandPNGBDBM10209(5-[(5-{[(2S)-1-carboxy-4-{[(2-chlorophenyl)methyl]...)
Affinity DataKi:  300nM ΔG°:  -8.89kcal/moleT: 2°CAssay Description:The effectiveness of compounds against the activity of human recombinant caspase-1-8 was measured using fluorometric assays. Assays were carried out ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2006
Entry Details Article
PubMed