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SMILES: Cc1cccc(c1)C(=O)Nc1ccc2CC(=O)N(Cc2c1)C(=O)c1cccc(C)c1

InChI Key: InChIKey=QRHIIIKMYDTQEI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50456692   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Acetylcholinesterase


(Homo sapiens (Human))		BDBM50456692
PNG
(CHEMBL4209803)
Show SMILES Cc1cccc(c1)C(=O)Nc1ccc2CC(=O)N(Cc2c1)C(=O)c1cccc(C)c1
Show InChI InChI=1S/C25H22N2O3/c1-16-5-3-7-19(11-16)24(29)26-22-10-9-18-14-23(28)27(15-21(18)13-22)25(30)20-8-4-6-17(2)12-20/h3-13H,14-15H2,1-2H3,(H,26,29)
PDB
MMDB

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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Central South University

Curated by ChEMBL


Assay Description
Inhibition of human AChE using acetylthiocholine as substrate by Ellman's method

Eur J Med Chem 138: 738-747 (2017)


Article DOI: 10.1016/j.ejmech.2017.07.006
BindingDB Entry DOI: 10.7270/Q2HM5C2T
More data for this
Ligand-Target Pair