BDBM50328686 CHEMBL1270450::S-(+)-3-hydroxynornantenine trifluoroacetate

SMILES: COc1c(O)c2CC[NH2+][C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23

InChI Key: InChIKey=VEIMKBPJMXUHHF-LBPRGKRZSA-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 = 50328686   

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
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328686 (CHEMBL1270450 | S-(+)-3-hydroxynornantenine triflu...) Show SMILES COc1c(O)c2CC[NH2+][C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23 |r| Show InChI InChI=1S/C19H19NO5/c1-22-18-16-11-7-14-13(24-8-25-14)6-9(11)5-12-15(16)10(3-4-20-12)17(21)19(18)23-2/h6-7,12,20-21H,3-5,8H2,1-2H3/p+1/t12-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair