BDBM199153 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)-ethyl-1-(4-chlorophenyl)-5-(3-fluorophenyl)-1H-pyrazole-3-carboxylate (4y)
SMILES: Cc1ncc(n1CCOC(=O)c1cc(-c2cccc(F)c2)n(n1)-c1ccc(Cl)cc1)[N+]([O-])=O
InChI Key: InChIKey=HPKLODMOUYMZKL-UHFFFAOYSA-N
Data: 1 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tyrosyl-tRNA synthetase (TryRS) (Staphylococcus aureus (Firmicutes)) | BDBM199153 (2-(2-Methyl-5-nitro-1H-imidazol-1-yl)-ethyl-1-(4-c...) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 6.01E+4 | n/a | n/a | n/a | n/a | 7.9 | n/a |
Nanjing University | Assay Description The assays were conducted at 37 °C in a mixture containing 100 mM Tris/Cl pH 7.9, 50 mM KCl, 16 mM MgCl2, 5 mM ATP, 3 mM DTT, 4 mg/ml E. coli MRE600 ... | Chem Biol Drug Des 88: 592-8 (2016) Article DOI: 10.1111/cbdd.12793 BindingDB Entry DOI: 10.7270/Q2V69HDF | |||||||||||
More data for this Ligand-Target Pair |