BDBM630397 US11802110, Compound 4.17

SMILES CC(C)CC(N)C(=O)NS(=O)c1cccc(c1)-c1ccccc1

InChI Key InChIKey=CZUACHZCAWTUAT-UHFFFAOYSA-N

Data  1 Kd  1 ITC

  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 = 630397   

TargetLeucine--tRNA ligase(Escherichia coli (strain K12))
Oxford Drug Design

US Patent
LigandPNGBDBM630397(US11802110, Compound 4.17)
Affinity DataKd:  4.47nMAssay Description:ITC studies were carried out using a Microcal ITC200 instrument (GE Healthcare). Protein concentration was determined by spectrophotometry by measuri...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2023
Entry Details
Go to US Patent

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 630397   

CellLeucine--tRNA ligase(Escherichia coli (strain K12))
Oxford Drug Design

US Patent
SyringePNGBDBM630397(US11802110, Compound 4.17)
ITC DataΔG°: -11.4kcal/mole −TΔS°: -1.90kcal/mole ΔH°: -9.72kcal/mole logk: 1.81E+6
pH: 7.5 T: 125.01°C 
In DepthDetails
Go to US Patent