BDBM50103541 CHEMBL3357990

SMILES: CC1CC(C)C2N(C1)c1c(CC22C(=O)NC(=O)NC2=O)cc2c(C)noc2c1F

InChI Key: InChIKey=ZTIMRGPSOAADPP-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50103541   

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
DNA Gyrase (Escherichia coli (strain K12))	BDBM50103541 (CHEMBL3357990) Show SMILES CC1CC(C)C2N(C1)c1c(CC22C(=O)NC(=O)NC2=O)cc2c(C)noc2c1F Show InChI InChI=1S/C20H21FN4O4/c1-8-4-9(2)16-20(17(26)22-19(28)23-18(20)27)6-11-5-12-10(3)24-29-15(12)13(21)14(11)25(16)7-8/h5,8-9,16H,4,6-7H2,1-3H3,(H2,22,23,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/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