BDBM50363014 CHEMBL1945700

SMILES: FC(F)(F)CCC(=O)N1CCC(CC1)c1nc(Cc2cccs2)no1

InChI Key: InChIKey=ZAAYQIWMYSIIMR-UHFFFAOYSA-N

Data: 1 EC50

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 = 50363014   

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
Transcriptional repressor EthR (EthR) (Mycobacterium tuberculosis)	BDBM50363014 (CHEMBL1945700) Show SMILES FC(F)(F)CCC(=O)N1CCC(CC1)c1nc(Cc2cccs2)no1 Show InChI InChI=1S/C16H18F3N3O2S/c17-16(18,19)6-3-14(23)22-7-4-11(5-8-22)15-20-13(21-24-15)10-12-2-1-9-25-12/h1-2,9,11H,3-8,10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a
Universit£ Lille Nord de France Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis H37Rv EthR in Mycobacterium tuberculosis H37Rv expressing GFP infected mouse in RAW264.7 cells assessed as p...				J Med Chem 55: 68-83 (2012) Article DOI: 10.1021/jm200825u BindingDB Entry DOI: 10.7270/Q2RX9CJW
					More data for this Ligand-Target Pair