BDBM50342780 (3S,6S,7R)-7-tert-Butyldiphenylsilyloxymethyl-4-N-(5''-(uracil-1'-yl)pentyl)-6-palmitoyloxy-3-(5-amino-5-deoxy-2,3-Oisopentylidene-beta-D-ribos-1-yl-methyl)-1,4-diazepan-2-one::CHEMBL1770415
SMILES: CCCCCCCCCCCCCCCC(=O)O[C@H]1CN(CCCCCn2ccc(=O)[nH]c2=O)[C@@H](CO[C@@H]2O[C@H](CN)[C@H]3OC(CC)(CC)O[C@@H]23)C(=O)N[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChI Key: InChIKey=SMPNHIYIMSCENN-LMLLSJGBSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Phospho-N-acetylmuramoyl-pentapeptide-transferase (Staphylococcus aureus (strain MRSA252)) | BDBM50342780 ((3S,6S,7R)-7-tert-Butyldiphenylsilyloxymethyl-4-N-...) | KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ Paris Descartes Curated by ChEMBL | Assay Description Inhibition of Staphylococcus aureus MraY after 30 mins | Eur J Med Chem 46: 1582-92 (2011) Article DOI: 10.1016/j.ejmech.2011.02.006 BindingDB Entry DOI: 10.7270/Q2FF3SPR | |||||||||||
More data for this Ligand-Target Pair |