BDBM50539926 CHEMBL4648660

SMILES Cc1cc(Oc2ccc(CC(=O)N3CCOCC3C(O)=O)cc2)ccc1C#N

InChI Key InChIKey=AJUGJYIFDAVOIF-UHFFFAOYSA-N

Data  1 Kd

  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 = 50539926   

TargetThiol:disulfide interchange protein DsbA(Escherichia coli (strain K12))
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50539926(CHEMBL4648660)
Affinity DataKd:  2.90E+5nMAssay Description:Binding affinity to uniformly labeled 15N oxidized Escherichia coli DsbA by 1H-15N HSQC NMR spectroscopyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2021
Entry Details Article
PubMed