BDBM50318263 5-O-(5-Amino-5-deoxy-beta-D-ribofuranosyl)-6-deoxy-1-6-(4-octylphenylureido)(uracil-1-yl)-beta-D-glycero-L-talo-heptofuranuronicAcid Trifluoroacetic Salt::CHEMBL1095320

SMILES: CCCCCCCCc1ccc(NC(=O)N[C@@H]([C@H](O[C@@H]2O[C@H](CN)[C@@H](O)[C@H]2O)[C@@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)C(O)=O)cc1

InChI Key: InChIKey=YTDKTTWHDADJHF-XUBLHFMZSA-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 = 50318263   

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 (Bacillus subtilis)	BDBM50318263 (5-O-(5-Amino-5-deoxy-beta-D-ribofuranosyl)-6-deoxy...) Show SMILES CCCCCCCCc1ccc(NC(=O)N[C@@H]([C@H](O[C@@H]2O[C@H](CN)[C@@H](O)[C@H]2O)[C@@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)C(O)=O)cc1 |r| Show InChI InChI=1S/C31H45N5O12/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)33-30(44)35-20(28(42)43)25(48-29-24(41)21(38)18(15-32)46-29)26-22(39)23(40)27(47-26)36-14-13-19(37)34-31(36)45/h9-14,18,20-27,29,38-41H,2-8,15,32H2,1H3,(H,42,43)(H2,33,35,44)(H,34,37,45)/t18-,20+,21-,22+,23-,24-,25+,26-,27-,29+/m1/s1	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Hokkaido University Curated by ChEMBL					Assay Description Inhibition of Bacillus subtilis MraY after 30 mins using UDP-MurNAc-pentapeptide as substrate				J Med Chem 53: 3793-813 (2010) Article DOI: 10.1021/jm100243n BindingDB Entry DOI: 10.7270/Q2B8589Q
					More data for this Ligand-Target Pair