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SMILES: CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1cncn1

InChI Key: InChIKey=WMNWUDVVQXRJTE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50521803   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
DNA gyrase subunit A


(Escherichia coli)		BDBM50521803
PNG
(CHEMBL4568624)
Show SMILES CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1cncn1
Show InChI InChI=1S/C16H16N8O2/c1-2-19-16(26)23-14-6-13(24-10-18-9-21-24)12(8-20-14)15(25)22-11-4-3-5-17-7-11/h3-10H,2H2,1H3,(H,22,25)(H2,19,20,23,26)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 82n/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