BDBM50483451 CHEMBL1684735

SMILES: O=c1c(OC2CCCC2)c(cnn1-c1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccccn1

InChI Key: InChIKey=FQMWXJLWLYJZCP-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 = 50483451   

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-1,3-glucan synthase (Candida albicans)	BDBM50483451 (CHEMBL1684735) Show SMILES O=c1c(OC2CCCC2)c(cnn1-c1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccccn1 Show InChI InChI=1S/C24H27N5O4S/c30-24-23(33-20-10-4-5-11-20)21(18-26-29(24)19-8-2-1-3-9-19)27-14-16-28(17-15-27)34(31,32)22-12-6-7-13-25-22/h1-3,6-9,12-13,18,20H,4-5,10-11,14-17H2	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.69E+3	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-D-glucan synthase				Bioorg Med Chem Lett 21: 1819-22 (2011) Article DOI: 10.1016/j.bmcl.2011.01.058 BindingDB Entry DOI: 10.7270/Q2P55RCG
					More data for this Ligand-Target Pair