BDBM50010356 CHEMBL3263600

SMILES: CCNC(=O)Nc1nc2cc(-c3cccnc3)c(NCC3CCOC3)nc2s1

InChI Key: InChIKey=GEPFIWBFZDKYLW-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 = 50010356   

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 subunit B (Mycobacterium smegmatis)	BDBM50010356 (CHEMBL3263600) Show SMILES CCNC(=O)Nc1nc2cc(-c3cccnc3)c(NCC3CCOC3)nc2s1 Show InChI InChI=1S/C19H22N6O2S/c1-2-21-18(26)25-19-23-15-8-14(13-4-3-6-20-10-13)16(24-17(15)28-19)22-9-12-5-7-27-11-12/h3-4,6,8,10,12H,2,5,7,9,11H2,1H3,(H,22,24)(H2,21,23,25,26)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca India Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of Mycobacterium smegmatis DNA gyrase B ATPase activity assessed as inorganic phosphate release using ATP as substrate by colorimetric ana...				Cell Chem Biol 56: 8834-48 (2013) Article DOI: 10.1021/jm401268f BindingDB Entry DOI: 10.7270/Q2RV0Q7W
					More data for this Ligand-Target Pair