BDBM103994 LecB Inhibitor Amides 4e

SMILES: COC1O[C@H](CNC(=O)Cc2ccccc2)[C@@H](O)C(O)[C@@H]1O

InChI Key: InChIKey=FFKQOPFXANSYLT-SYANGAHLSA-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 = 103994   

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
LecB (Pseudomonas aeruginosa)	BDBM103994 (LecB Inhibitor Amides 4e) Show SMILES COC1O[C@H](CNC(=O)Cc2ccccc2)[C@@H](O)C(O)[C@@H]1O |r| Show InChI InChI=1S/C15H21NO6/c1-21-15-14(20)13(19)12(18)10(22-15)8-16-11(17)7-9-5-3-2-4-6-9/h2-6,10,12-15,18-20H,7-8H2,1H3,(H,16,17)/t10-,12-,13?,14+,15?/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Konstanz									ACS Chem Biol 8: 1775-84 (2013) Article DOI: 10.1021/cb400371r BindingDB Entry DOI: 10.7270/Q21J98C3
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