BDBM50539932 CHEMBL4641638

SMILES Oc1ccc(Oc2ccc(cc2)C#N)cc1

InChI Key InChIKey=VAOVNHCRRUOGON-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50539932   

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

Curated by ChEMBL
LigandPNGBDBM50539932(CHEMBL4641638)
Affinity DataKd: >1.00E+6nMAssay 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