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SMILES: CC1CN2C(C(C)O1)C1(Cc3cc4c(noc4c(F)c23)C(C)(C)C)C(=O)NC(=O)NC1=O

InChI Key: InChIKey=QSLVDRVWWJPQIM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50103542   
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/B


(Escherichia coli (strain K12))		BDBM50103542
PNG
(CHEMBL3357989)
Show SMILES CC1CN2C(C(C)O1)C1(Cc3cc4c(noc4c(F)c23)C(C)(C)C)C(=O)NC(=O)NC1=O
Show InChI InChI=1S/C22H25FN4O5/c1-9-8-27-14-11(6-12-15(13(14)23)32-26-16(12)21(3,4)5)7-22(17(27)10(2)31-9)18(28)24-20(30)25-19(22)29/h6,9-10,17H,7-8H2,1-5H3,(H2,24,25,28,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli DNA gyrase using fluorescence-tagged DNA by fluorescenct polarization assay

J Med Chem 57: 9078-95 (2014)


BindingDB Entry DOI: 10.7270/Q2F76FB6
More data for this
Ligand-Target Pair