BDBM50443043 CHEMBL3087813
SMILES: CCN(CC)CCNS(=O)(=O)c1ccccc1F
InChI Key: InChIKey=DWACGKNOPVYPHQ-UHFFFAOYSA-N
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 |
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Acetylcholinesterase (Mus musculus (mouse)) | BDBM50443043 (CHEMBL3087813) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | 4.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Ume£ University Curated by ChEMBL | Assay Description Inhibition of mouse recombinant AChE using acetylthiocholine iodide as substrate by Ellman's method | J Med Chem 56: 7615-24 (2013) Article DOI: 10.1021/jm400990p BindingDB Entry DOI: 10.7270/Q24M95Z3 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |