BDBM50475583 CHEMBL372594

SMILES: OC1=C(C(=O)O\C1=C/c1ccc2ccccc2c1)c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=BXJDPNRRIXDAGP-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 = 50475583   

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
MurA (E. coli) (Escherichia coli K-12 (Enterobacteria))	BDBM50475583 (CHEMBL372594) Show SMILES OC1=C(C(=O)O\C1=C/c1ccc2ccccc2c1)c1cccc(c1)C(F)(F)F |t:1| Show InChI InChI=1S/C22H13F3O3/c23-22(24,25)17-7-3-6-16(12-17)19-20(26)18(28-21(19)27)11-13-8-9-14-4-1-2-5-15(14)10-13/h1-12,26H/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	>6.53E+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
MurD (Escherichia coli (strain K12))	BDBM50475583 (CHEMBL372594) Show SMILES OC1=C(C(=O)O\C1=C/c1ccc2ccccc2c1)c1cccc(c1)C(F)(F)F |t:1| Show InChI InChI=1S/C22H13F3O3/c23-22(24,25)17-7-3-6-16(12-17)19-20(26)18(28-21(19)27)11-13-8-9-14-4-1-2-5-15(14)10-13/h1-12,26H/b18-11-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>6.53E+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 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
MurB (E. coli) (Escherichia coli K-12 (Enterobacteria))	BDBM50475583 (CHEMBL372594) Show SMILES OC1=C(C(=O)O\C1=C/c1ccc2ccccc2c1)c1cccc(c1)C(F)(F)F |t:1| Show InChI InChI=1S/C22H13F3O3/c23-22(24,25)17-7-3-6-16(12-17)19-20(26)18(28-21(19)27)11-13-8-9-14-4-1-2-5-15(14)10-13/h1-12,26H/b18-11-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.87E+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
MurC (Escherichia coli)	BDBM50475583 (CHEMBL372594) Show SMILES OC1=C(C(=O)O\C1=C/c1ccc2ccccc2c1)c1cccc(c1)C(F)(F)F |t:1| Show InChI InChI=1S/C22H13F3O3/c23-22(24,25)17-7-3-6-16(12-17)19-20(26)18(28-21(19)27)11-13-8-9-14-4-1-2-5-15(14)10-13/h1-12,26H/b18-11-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.56E+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 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