BDBM50064513 CHEMBL3401233

SMILES: CCC(CC)c1cc(OC(=O)N(C)C)no1

InChI Key: InChIKey=HXAHKDNCBVIKII-UHFFFAOYSA-N

Data: 1 KI

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 = 50064513   

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 (Homo sapiens (Human))	BDBM50064513 (CHEMBL3401233) Show SMILES CCC(CC)c1cc(OC(=O)N(C)C)no1 Show InChI InChI=1S/C11H18N2O3/c1-5-8(6-2)9-7-10(12-16-9)15-11(14)13(3)4/h7-8H,5-6H2,1-4H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Tech Curated by ChEMBL					Assay Description Inhibition of recombinant human AChE				Bioorg Med Chem 23: 1321-40 (2015) Article DOI: 10.1016/j.bmc.2015.01.026 BindingDB Entry DOI: 10.7270/Q2VD715T
					More data for this Ligand-Target Pair