BDBM630390 US11802110, Compound 4.7

SMILES CC(C)CC(C)(N)C(=O)NS(=O)c1ccccc1

InChI Key InChIKey=ZWUMLHFEILRMGJ-UHFFFAOYSA-N

Data  1 Kd  1 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 630390   

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

US Patent
LigandPNGBDBM630390(US11802110, Compound 4.7)
Affinity DataKd:  1.82E+3nMAssay 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
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Date in BDB:
12/13/2023
Entry Details
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Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 630390   

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

US Patent
SyringePNGBDBM630390(US11802110, Compound 4.7)
ITC DataΔG°: -7.83kcal/mole −TΔS°: -5.71kcal/mole ΔH°: -1.66kcal/mole logk: 2.01E+4
pH: 7.5 T: 125.01°C 
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