BDBM50445595 CHEMBL3103453

SMILES ONC(=O)CC(CCOCCc1ccc(F)cc1)c1ccc(Cl)cc1Cl

InChI Key InChIKey=XQHQHZCIBXCRJA-UHFFFAOYSA-N

Data  1 KI  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 2 hits for monomerid = 50445595   

TargetBotulinum neurotoxin type A(Clostridium botulinum)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50445595(CHEMBL3103453)
Affinity DataIC50: 970nMAssay Description:Inhibition of Clostridium botulinum BoNT/A light chain (1 to 425 amino acids) by FRET methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2014
Entry Details Article
PubMed
TargetBotulinum neurotoxin type A(Clostridium botulinum)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50445595(CHEMBL3103453)
Affinity DataKi:  2.10E+3nMAssay Description:Inhibition of Clostridium botulinum BoNT/A light chain (1 to 425 amino acids) by LC-MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/25/2014
Entry Details Article
PubMed