BDBM50483795 CHEMBL1770502

SMILES: CC(C)(C)S(=O)(=O)N1CCN(CC1)c1cnn(-c2cccc(Cl)c2)c(=O)c1OC1CCCC1

InChI Key: InChIKey=QSQUIMHZWHXKRN-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 = 50483795   

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
1,3-beta-glucan synthase (Candida albicans (Yeast))	BDBM50483795 (CHEMBL1770502) Show SMILES CC(C)(C)S(=O)(=O)N1CCN(CC1)c1cnn(-c2cccc(Cl)c2)c(=O)c1OC1CCCC1 Show InChI InChI=1S/C23H31ClN4O4S/c1-23(2,3)33(30,31)27-13-11-26(12-14-27)20-16-25-28(18-8-6-7-17(24)15-18)22(29)21(20)32-19-9-4-5-10-19/h6-8,15-16,19H,4-5,9-14H2,1-3H3	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	828	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of Candida albicans BWP17 1,3-beta-glucan synthase				Bioorg Med Chem Lett 21: 2890-3 (2011) Article DOI: 10.1016/j.bmcl.2011.03.083 BindingDB Entry DOI: 10.7270/Q2SQ937S
					More data for this Ligand-Target Pair