null

SMILES: CCCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1

InChI Key: InChIKey=CCLYHFAXRYLZDZ-ZQRQZVKFSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50005771   

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))	BDBM50005771 ((+/-)-Heptyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-...) Show SMILES CCCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1 Show InChI InChI=1S/C22H34N2O2/c1-3-5-6-7-8-12-23-22(25)26-18-10-9-17-15-21-19(20(17)16-18)11-14-24(21)13-4-2/h9-10,16,19,21H,3-8,11-15H2,1-2H3,(H,23,25)/t19-,21?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	629	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human AchE (Acetylcholinesterase)				J Med Chem 35: 1429-34 (1992) BindingDB Entry DOI: 10.7270/Q2RN38GQ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50005771 ((+/-)-Heptyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-...) Show SMILES CCCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1 Show InChI InChI=1S/C22H34N2O2/c1-3-5-6-7-8-12-23-22(25)26-18-10-9-17-15-21-19(20(17)16-18)11-14-24(21)13-4-2/h9-10,16,19,21H,3-8,11-15H2,1-2H3,(H,23,25)/t19-,21?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	629	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of AChE				Eur J Med Chem 45: 1167-72 (2010) Article DOI: 10.1016/j.ejmech.2009.12.038 BindingDB Entry DOI: 10.7270/Q25H7GFM
					More data for this Ligand-Target Pair