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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50521806   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
DNA gyrase subunit A


(Escherichia coli)		BDBM50521806
PNG
(CHEMBL4449908)
Show SMILES CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1cc(Br)cn1
Show InChI InChI=1S/C17H16BrN7O2/c1-2-20-17(27)24-15-6-14(25-10-11(18)7-22-25)13(9-21-15)16(26)23-12-4-3-5-19-8-12/h3-10H,2H2,1H3,(H,23,26)(H2,20,21,24,27)
PDB

UniProtKB/TrEMBL

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PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 37n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli DNA gyrase(A2B2 tetramer) preincubated for 5 mins followed by ATP addition and measured once per minute for 20 to 30 m...

Bioorg Med Chem 27: 3546-3550 (2019)


Article DOI: 10.1016/j.bmc.2019.06.015
BindingDB Entry DOI: 10.7270/Q2NK3JFZ
More data for this
Ligand-Target Pair