null

SMILES: CC(C)c1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(CCc5ccc(Cl)cc5)CC[C@@]4(C)c3c2)cc1

InChI Key: InChIKey=LIDZZTBAUPHQIJ-JDXGNMNLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50312808   

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 (Mus musculus (mouse))	BDBM50312808 ((3aS,8aR)-1-(4-chlorophenethyl)-3a,8-dimethyl-1,2,...) Show SMILES CC(C)c1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(CCc5ccc(Cl)cc5)CC[C@@]4(C)c3c2)cc1 |r| Show InChI InChI=1S/C30H34ClN3O2/c1-20(2)22-7-11-24(12-8-22)32-29(35)36-25-13-14-27-26(19-25)30(3)16-18-34(28(30)33(27)4)17-15-21-5-9-23(31)10-6-21/h5-14,19-20,28H,15-18H2,1-4H3,(H,32,35)/t28-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of mouse brain AChE after 1 hr by modified Ellman's colorimetric method				Bioorg Med Chem Lett 20: 1718-20 (2010) Article DOI: 10.1016/j.bmcl.2010.01.057 BindingDB Entry DOI: 10.7270/Q2RV0NV4
					More data for this Ligand-Target Pair
Cholinesterase (Mus musculus (Mouse))	BDBM50312808 ((3aS,8aR)-1-(4-chlorophenethyl)-3a,8-dimethyl-1,2,...) Show SMILES CC(C)c1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(CCc5ccc(Cl)cc5)CC[C@@]4(C)c3c2)cc1 |r| Show InChI InChI=1S/C30H34ClN3O2/c1-20(2)22-7-11-24(12-8-22)32-29(35)36-25-13-14-27-26(19-25)30(3)16-18-34(28(30)33(27)4)17-15-21-5-9-23(31)10-6-21/h5-14,19-20,28H,15-18H2,1-4H3,(H,32,35)/t28-,30-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of mouse serum BChE after 1 hr by modified Ellman's colorimetric method				Bioorg Med Chem Lett 20: 1718-20 (2010) Article DOI: 10.1016/j.bmcl.2010.01.057 BindingDB Entry DOI: 10.7270/Q2RV0NV4
					More data for this Ligand-Target Pair