BDBM50482081 CHEMBL1091179

SMILES: CC(CNC(=O)c1ccccc1O)\N=C\c1cc(I)cc(I)c1O

InChI Key: InChIKey=UAMFJBHNQCJIOH-AWQFTUOYSA-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 = 50482081   

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
Beta-ketoacyl-ACP synthase III (FabH) (Escherichia coli)	BDBM50482081 (CHEMBL1091179) Show SMILES CC(CNC(=O)c1ccccc1O)\N=C\c1cc(I)cc(I)c1O Show InChI InChI=1S/C17H16I2N2O3/c1-10(8-21-17(24)13-4-2-3-5-15(13)22)20-9-11-6-12(18)7-14(19)16(11)23/h2-7,9-10,22-23H,8H2,1H3,(H,21,24)/b20-9+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli KAS3 after 1 min assessed as incorporation of 3H signal in the final product by liquid scintillation counter				Bioorg Med Chem 18: 2447-55 (2010) Article DOI: 10.1016/j.bmc.2010.02.052 BindingDB Entry DOI: 10.7270/Q2H70JNT
					More data for this Ligand-Target Pair