BDBM50332116 1-(benzyloxy(3-(trimethylammonio)propyl)amino)-1-oxooctan-2-aminium dichloride::CHEMBL1287947

SMILES: CCCCCCC([NH3+])C(=O)N(CCC[N+](C)(C)C)OCc1ccccc1

InChI Key: InChIKey=MQTSDTBUYMEDMS-UHFFFAOYSA-O

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 = 50332116   

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
Phospholipase C (Bacillus cereus)	BDBM50332116 (1-(benzyloxy(3-(trimethylammonio)propyl)amino)-1-o...) Show SMILES CCCCCCC([NH3+])C(=O)N(CCC[N+](C)(C)C)OCc1ccccc1 Show InChI InChI=1S/C21H38N3O2/c1-5-6-7-11-15-20(22)21(25)23(16-12-17-24(2,3)4)26-18-19-13-9-8-10-14-19/h8-10,13-14,20H,5-7,11-12,15-18,22H2,1-4H3/q+1/p+1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Advance Chemistry of Catalonia (IQAC-CSIC) Curated by ChEMBL					Assay Description Inhibition of Bacillus cereus phosphatidylcholine preferred phospholipase C after 100 seconds				Bioorg Med Chem 18: 8549-55 (2010) Article DOI: 10.1016/j.bmc.2010.10.031 BindingDB Entry DOI: 10.7270/Q2VH5P32
					More data for this Ligand-Target Pair