BDBM50046505 6-(2,3-Dihydroxy-propylsulfanylmethyl)-4-dimethylamino-3,5,10,12,12a-pentahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydro-naphthacene-2-carboxylic acid amide::CHEMBL338852
SMILES: CN(C)[C@H]1C2[C@@H](O)C3[C@@H](CSCC(O)CO)c4cccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O
InChI Key: InChIKey=JADYMCMMHZAZBK-UVGVPCOJSA-N
Data: 1 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Multidrug translocase mdfA (Escherichia coli (strain K12)) | BDBM50046505 (6-(2,3-Dihydroxy-propylsulfanylmethyl)-4-dimethyla...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Tufts University Curated by ChEMBL | Assay Description Inhibition of [3H]tetracycline uptake into everted membrane vesicles, prepared from tetracycline resistant Escherichia coli D1-209 | J Med Chem 36: 370-7 (1993) BindingDB Entry DOI: 10.7270/Q2XW4KDW | |||||||||||
More data for this Ligand-Target Pair |