BDBM50086743 CHEMBL358101::N-(2,5-Difluoro-phenyl)-4-{3-[(E)-(3-phenyl-acryloyl)]-thioureido}-benzenesulfonamide

SMILES: Fc1ccc(F)c(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccccc3)cc2)c1

InChI Key: InChIKey=HXZCQTGJBYQSSB-UHFFFAOYSA-N

Data: 1 KI

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 = 50086743   

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
Scytalone dehydratase (Magnaporthe grisea)	BDBM50086743 (CHEMBL358101 | N-(2,5-Difluoro-phenyl)-4-{3-[(E)-(...) Show SMILES Fc1ccc(F)c(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccccc3)cc2)c1 |w:22.22| Show InChI InChI=1S/C22H17F2N3O3S2/c23-16-7-12-19(24)20(14-16)27-32(29,30)18-10-8-17(9-11-18)25-22(31)26-21(28)13-6-15-4-2-1-3-5-15/h1-14,27H,(H2,25,26,28,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	6.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Central Research and Development Curated by ChEMBL					Assay Description Compound was evaluated for its inhibition constant against scytalone dehydratase (SD)				Bioorg Med Chem Lett 10: 491-4 (2000) BindingDB Entry DOI: 10.7270/Q2D799ND
					More data for this Ligand-Target Pair