BDBM81626 MurF inhibitor, 5

SMILES: Clc1ccc(cc1C(=O)Nc1sc2CCCCc2c1C#N)S(=O)(=O)N1CCCCC1

InChI Key: InChIKey=LVXCLZQHYKWOQU-UHFFFAOYSA-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 = 81626   

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
UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase (MurF) (Streptococcus pneumoniae)	BDBM81626 (MurF inhibitor, 5) Show SMILES Clc1ccc(cc1C(=O)Nc1sc2CCCCc2c1C#N)S(=O)(=O)N1CCCCC1 Show InChI InChI=1S/C21H22ClN3O3S2/c22-18-9-8-14(30(27,28)25-10-4-1-5-11-25)12-16(18)20(26)24-21-17(13-23)15-6-2-3-7-19(15)29-21/h8-9,12H,1-7,10-11H2,(H,24,26)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories					Assay Description Inhibition of D-Ala-D-Ala adding enzyme (MurF) from Streptococcus pneumoniase.				Chem Biol Drug Des 67: 58-65 (2006) Article DOI: 10.1111/j.1747-0285.2005.00317.x BindingDB Entry DOI: 10.7270/Q2GF0S0Z
					More data for this Ligand-Target Pair