BDBM50363033 CHEMBL1945966

SMILES: COc1ccccc1-c1noc(n1)C1CCN(CC1)C(=O)CCC(F)(F)F

InChI Key: InChIKey=HMBKMRWGCDWUEY-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 = 50363033   

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)	BDBM50363033 (CHEMBL1945966) Show SMILES COc1ccccc1-c1noc(n1)C1CCN(CC1)C(=O)CCC(F)(F)F Show InChI InChI=1S/C18H20F3N3O3/c1-26-14-5-3-2-4-13(14)16-22-17(27-23-16)12-7-10-24(11-8-12)15(25)6-9-18(19,20)21/h2-5,12H,6-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	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