BDBM50061692 6-(3,5-Dimethyl-phenylsulfanyl)-5-ethyl-1-(2-hydroxy-ethoxymethyl)-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one::CHEMBL16793

SMILES: CCc1c(Sc2cc(C)cc(C)c2)n(COCCO)c(=S)[nH]c1=O

InChI Key: InChIKey=VANBLRXIQQOIJQ-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 = 50061692   

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
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50061692 (6-(3,5-Dimethyl-phenylsulfanyl)-5-ethyl-1-(2-hydro...) Show SMILES CCc1c(Sc2cc(C)cc(C)c2)n(COCCO)c(=S)[nH]c1=O Show InChI InChI=1S/C17H22N2O3S2/c1-4-14-15(21)18-17(23)19(10-22-6-5-20)16(14)24-13-8-11(2)7-12(3)9-13/h7-9,20H,4-6,10H2,1-3H3,(H,18,21,23)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.80	n/a	n/a	n/a	n/a
Université d'Orléans Curated by ChEMBL					Assay Description Inhibitory concentration against HIV-1 reverse transcriptase				J Med Chem 40: 4257-64 (1998) Article DOI: 10.1021/jm970110p BindingDB Entry DOI: 10.7270/Q2WS8SC3
					More data for this Ligand-Target Pair