BDBM50332101 1-(benzyloxy(2-(trimethylammonio)ethyl)amino)-1-oxododecan-2-aminium dichloride::CHEMBL1288246

SMILES: CCCCCCCCCCC([NH3+])C(=O)N(CC[N+](C)(C)C)OCc1ccccc1

InChI Key: InChIKey=TXTWPAPQHKRETD-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 = 50332101   

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)	BDBM50332101 (1-(benzyloxy(2-(trimethylammonio)ethyl)amino)-1-ox...) Show SMILES CCCCCCCCCCC([NH3+])C(=O)N(CC[N+](C)(C)C)OCc1ccccc1 Show InChI InChI=1S/C24H44N3O2/c1-5-6-7-8-9-10-11-15-18-23(25)24(28)26(19-20-27(2,3)4)29-21-22-16-13-12-14-17-22/h12-14,16-17,23H,5-11,15,18-21,25H2,1-4H3/q+1/p+1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	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