BDBM50485325 CHEMBL2046744

SMILES: CC1(CO\C(C(=O)Nc2cccc(Cl)c2)=C(\C=N)N2CCN(CC2)S(=O)(=O)NCc2ccnc(N)c2)CC1

InChI Key: InChIKey=RPGYKKMLMMHOJA-RVUSSSHYSA-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 = 50485325   

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)	BDBM50485325 (CHEMBL2046744) Show SMILES CC1(CO\C(C(=O)Nc2cccc(Cl)c2)=C(\C=N)N2CCN(CC2)S(=O)(=O)NCc2ccnc(N)c2)CC1 Show InChI InChI=1S/C25H32ClN7O4S/c1-25(6-7-25)17-37-23(24(34)31-20-4-2-3-19(26)14-20)21(15-27)32-9-11-33(12-10-32)38(35,36)30-16-18-5-8-29-22(28)13-18/h2-5,8,13-15,27,30H,6-7,9-12,16-17H2,1H3,(H2,28,29)(H,31,34)/b23-21-,27-15?	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	409	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research, Inc. (AMRI) Curated by ChEMBL					Assay Description Inhibition of glucan synthase in Candida albicans BWP17 membrane				Bioorg Med Chem Lett 22: 4896-9 (2012) Article DOI: 10.1016/j.bmcl.2012.04.127 BindingDB Entry DOI: 10.7270/Q2NC6424
					More data for this Ligand-Target Pair