BDBM50221489 CHEMBL406780

SMILES: [H][C@@]1(O[C@H]([C@H](OC(=O)OCCCCCCCCC)[C@@H]1OC)n1ccc(=O)[nH]c1=O)[C@@H](O[C@H]1OC(=C[C@H](O)[C@@H]1O)C(=O)N[C@H]1CCC[C@@H](C)NC1=O)C(N)=O

InChI Key: InChIKey=IKJUPYRQZLYLFQ-ZQEMRQPDSA-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 = 50221489   

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/UDP-N-acetylglucosamine--N-acetylmuramyl-(pentapeptide) pyrophosphoryl-undecaprenol N-acetylglucosamine transferase (Escherichia coli (strain K12))	BDBM50221489 (CHEMBL406780) Show SMILES [H][C@@]1(O[C@H]([C@H](OC(=O)OCCCCCCCCC)[C@@H]1OC)n1ccc(=O)[nH]c1=O)[C@@H](O[C@H]1OC(=C[C@H](O)[C@@H]1O)C(=O)N[C@H]1CCC[C@@H](C)NC1=O)C(N)=O |c:35| Show InChI InChI=1S/C34H51N5O14/c1-4-5-6-7-8-9-10-16-49-34(47)53-27-24(48-3)25(51-31(27)39-15-14-22(41)38-33(39)46)26(28(35)43)52-32-23(42)20(40)17-21(50-32)30(45)37-19-13-11-12-18(2)36-29(19)44/h14-15,17-20,23-27,31-32,40,42H,4-13,16H2,1-3H3,(H2,35,43)(H,36,44)(H,37,45)(H,38,41,46)/t18-,19+,20+,23+,24-,25+,26-,27-,31-,32-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sankyo Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory concentration required against Translocase I				Bioorg Med Chem Lett 13: 2833-6 (2003) BindingDB Entry DOI: 10.7270/Q2VX0JP8
					More data for this Ligand-Target Pair