BDBM50342779 (3S,6S,7R)-7-tert-Butyldiphenylsilyloxymethyl-4-N-(5''-(uracil-1'-yl)pentyl)-6-palmitoyloxy-3-(5-azido-5-deoxy-2,3-Oisopentylidene-beta-D-ribos-1-yl-methyl)-1,4-diazepan-2-one::CHEMBL1770414

SMILES: CCCCCCCCCCCCCCCC(=O)O[C@H]1CN(CCCCCn2ccc(=O)[nH]c2=O)[C@@H](CO[C@@H]2O[C@H](CN=[N+]=[N-])[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=KGCNZIDTUVEZOY-LMLLSJGBSA-N

Data: 1 IC50

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 = 50342779   

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))	BDBM50342779 ((3S,6S,7R)-7-tert-Butyldiphenylsilyloxymethyl-4-N-...) Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@H]1CN(CCCCCn2ccc(=O)[nH]c2=O)[C@@H](CO[C@@H]2O[C@H](CN=[N+]=[N-])[C@H]3OC(CC)(CC)O[C@@H]23)C(=O)N[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C |r| Show InChI InChI=1S/C58H89N7O10Si/c1-7-10-11-12-13-14-15-16-17-18-19-20-28-35-51(67)72-49-41-65(38-30-23-29-37-64-39-36-50(66)62-56(64)69)47(43-70-55-53-52(48(73-55)40-60-63-59)74-58(8-2,9-3)75-53)54(68)61-46(49)42-71-76(57(4,5)6,44-31-24-21-25-32-44)45-33-26-22-27-34-45/h21-22,24-27,31-34,36,39,46-49,52-53,55H,7-20,23,28-30,35,37-38,40-43H2,1-6H3,(H,61,68)(H,62,66,69)/t46-,47+,48-,49+,52-,53-,55-/m1/s1	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+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