BDBM50319381 8-(4-((diethylamino)methyl)phenoxy)-N,N-dipropyloctan-1-amine::CHEMBL1086100

SMILES: CCCN(CCC)CCCCCCCCOc1ccc(CN(CC)CC)cc1

InChI Key: InChIKey=FVHPNAPOIIIEBJ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50319381   

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
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50319381 (8-(4-((diethylamino)methyl)phenoxy)-N,N-dipropyloc...) Show SMILES CCCN(CCC)CCCCCCCCOc1ccc(CN(CC)CC)cc1 Show InChI InChI=1S/C25H46N2O/c1-5-19-27(20-6-2)21-13-11-9-10-12-14-22-28-25-17-15-24(16-18-25)23-26(7-3)8-4/h15-18H,5-14,19-23H2,1-4H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE after 15 mins by Ellman's method				Bioorg Med Chem Lett 20: 3254-8 (2010) Article DOI: 10.1016/j.bmcl.2010.04.059 BindingDB Entry DOI: 10.7270/Q2QC03P4
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50319381 (8-(4-((diethylamino)methyl)phenoxy)-N,N-dipropyloc...) Show SMILES CCCN(CCC)CCCCCCCCOc1ccc(CN(CC)CC)cc1 Show InChI InChI=1S/C25H46N2O/c1-5-19-27(20-6-2)21-13-11-9-10-12-14-22-28-25-17-15-24(16-18-25)23-26(7-3)8-4/h15-18H,5-14,19-23H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE after 15 mins by Ellman's method				Bioorg Med Chem Lett 20: 3254-8 (2010) Article DOI: 10.1016/j.bmcl.2010.04.059 BindingDB Entry DOI: 10.7270/Q2QC03P4
					More data for this Ligand-Target Pair