BDBM50436831 CHEMBL3038157

SMILES: CN1C\C(=C/c2ccc(F)cc2)C(=O)[C@]2(C1)[C@H]([C@@H]1CCCCN1[C@@]21C(=O)c2cccc3cccc1c23)c1ccc(F)cc1

InChI Key: InChIKey=LEXJTUUCZJAYIA-HUAZARHOSA-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 = 50436831   

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))	BDBM50436831 (CHEMBL3038157) Show SMILES CN1C\C(=C/c2ccc(F)cc2)C(=O)[C@]2(C1)[C@H]([C@@H]1CCCCN1[C@@]21C(=O)c2cccc3cccc1c23)c1ccc(F)cc1 |r| Show InChI InChI=1S/C37H32F2N2O2/c1-40-21-26(20-23-11-15-27(38)16-12-23)34(42)36(22-40)33(25-13-17-28(39)18-14-25)31-10-2-3-19-41(31)37(36)30-9-5-7-24-6-4-8-29(32(24)30)35(37)43/h4-9,11-18,20,31,33H,2-3,10,19,21-22H2,1H3/b26-20+/t31-,33-,36-,37-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
Madurai Kamaraj University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE after 30 mins by Ellman's method				Eur J Med Chem 65: 240-8 (2013) Article DOI: 10.1016/j.ejmech.2013.04.050 BindingDB Entry DOI: 10.7270/Q23T9JNC
					More data for this Ligand-Target Pair