BDBM50475597 CHEMBL380752

SMILES: OC1=C(C(=O)O\C1=C/c1cc(ccc1Cl)C(F)(F)F)c1ccc(N2CCOCC2)c(F)c1

InChI Key: InChIKey=SLEMINBFDUIZIX-WQRHYEAKSA-N

Data: 4 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 4 hits for monomerid = 50475597   

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
MurC (S. aureus) (Staphylococcus aureus (Firmicutes))	BDBM50475597 (CHEMBL380752) Show SMILES OC1=C(C(=O)O\C1=C/c1cc(ccc1Cl)C(F)(F)F)c1ccc(N2CCOCC2)c(F)c1 |t:1| Show InChI InChI=1S/C22H16ClF4NO4/c23-15-3-2-14(22(25,26)27)9-13(15)11-18-20(29)19(21(30)32-18)12-1-4-17(16(24)10-12)28-5-7-31-8-6-28/h1-4,9-11,29H,5-8H2/b18-11-	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory activity against MurC in Staphylococcus aureus				Bioorg Med Chem Lett 16: 176-80 (2006) Article DOI: 10.1016/j.bmcl.2005.09.021 BindingDB Entry DOI: 10.7270/Q25M68G7
					More data for this Ligand-Target Pair
MurB (E. coli) (Escherichia coli K-12 (Enterobacteria))	BDBM50475597 (CHEMBL380752) Show SMILES OC1=C(C(=O)O\C1=C/c1cc(ccc1Cl)C(F)(F)F)c1ccc(N2CCOCC2)c(F)c1 |t:1| Show InChI InChI=1S/C22H16ClF4NO4/c23-15-3-2-14(22(25,26)27)9-13(15)11-18-20(29)19(21(30)32-18)12-1-4-17(16(24)10-12)28-5-7-31-8-6-28/h1-4,9-11,29H,5-8H2/b18-11-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory activity against MurB in Escherichia coli				Bioorg Med Chem Lett 16: 176-80 (2006) Article DOI: 10.1016/j.bmcl.2005.09.021 BindingDB Entry DOI: 10.7270/Q25M68G7
					More data for this Ligand-Target Pair
MurD (S. aureus) (Staphylococcus aureus (Firmicutes))	BDBM50475597 (CHEMBL380752) Show SMILES OC1=C(C(=O)O\C1=C/c1cc(ccc1Cl)C(F)(F)F)c1ccc(N2CCOCC2)c(F)c1 |t:1| Show InChI InChI=1S/C22H16ClF4NO4/c23-15-3-2-14(22(25,26)27)9-13(15)11-18-20(29)19(21(30)32-18)12-1-4-17(16(24)10-12)28-5-7-31-8-6-28/h1-4,9-11,29H,5-8H2/b18-11-	UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory activity against MurD in Staphylococcus aureus				Bioorg Med Chem Lett 16: 176-80 (2006) Article DOI: 10.1016/j.bmcl.2005.09.021 BindingDB Entry DOI: 10.7270/Q25M68G7
					More data for this Ligand-Target Pair
MurA (E. coli) (Escherichia coli K-12 (Enterobacteria))	BDBM50475597 (CHEMBL380752) Show SMILES OC1=C(C(=O)O\C1=C/c1cc(ccc1Cl)C(F)(F)F)c1ccc(N2CCOCC2)c(F)c1 |t:1| Show InChI InChI=1S/C22H16ClF4NO4/c23-15-3-2-14(22(25,26)27)9-13(15)11-18-20(29)19(21(30)32-18)12-1-4-17(16(24)10-12)28-5-7-31-8-6-28/h1-4,9-11,29H,5-8H2/b18-11-	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory activity against MurA in Escherichia coli				Bioorg Med Chem Lett 16: 176-80 (2006) Article DOI: 10.1016/j.bmcl.2005.09.021 BindingDB Entry DOI: 10.7270/Q25M68G7
					More data for this Ligand-Target Pair