BDBM50221505 CHEMBL97752

SMILES: [H][C@@]1(O[C@H]([C@H](OC(=O)CCCCCCCCCCCCCCCCCCC)[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=AIMFLLIENMPXQY-UTKBUINZSA-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 = 50221505   

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))	BDBM50221505 (CHEMBL97752) Show SMILES [H][C@@]1(O[C@H]([C@H](OC(=O)CCCCCCCCCCCCCCCCCCC)[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:44| Show InChI InChI=1S/C44H71N5O13/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-33(52)60-38-35(58-3)36(61-42(38)49-26-25-32(51)48-44(49)57)37(39(45)54)62-43-34(53)30(50)27-31(59-43)41(56)47-29-23-21-22-28(2)46-40(29)55/h25-30,34-38,42-43,50,53H,4-24H2,1-3H3,(H2,45,54)(H,46,55)(H,47,56)(H,48,51,57)/t28-,29+,30+,34+,35-,36+,37-,38-,42-,43-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+4	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