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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Acetylcholinesterase | ||
| Ligand | BDBM50117576 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_70883 (CHEMBL684541) | ||
| EC50 | 530±n/a nM | ||
| Citation |  Clark, JK; Cowley, P; Muir, AW; Palin, R; Pow, E; Prosser, AB; Taylor, R; Zhang, MQ Quaternary salts of E2020 analogues as acetylcholinesterase inhibitors for the reversal of neuromuscular block. Bioorg Med Chem Lett12:2565-8 (2002) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Acetylcholinesterase | |||
| Name: | Acetylcholinesterase | ||
| Synonyms: | ACES_HUMAN | ACHE | Acetylcholinesterase (AChE) | Acetylcholinesterase (human AChE) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 67792.70 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P22303 | ||
| Residue: | 614 | ||
| Sequence: |
| ||
| BDBM50117576 | |||
| n/a | |||
| Name | BDBM50117576 | ||
| Synonyms: | 1-Benzyl-4-[3-(6-methoxy-naphthalen-2-yl)-3-oxo-propyl]-1-methyl-piperidinium | CHEMBL87823 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H32NO2 | ||
| Mol. Mass. | 402.5479 | ||
| SMILES | COc1ccc2cc(ccc2c1)C(=O)CCC1CC[N+](C)(Cc2ccccc2)CC1 |(-3.21,-6.68,;-1.98,-7.59,;-.58,-6.98,;-.39,-5.42,;1.03,-4.81,;2.27,-5.74,;3.67,-5.12,;4.91,-6.03,;4.76,-7.54,;3.36,-8.17,;2.08,-7.28,;.68,-7.89,;6.32,-5.4,;6.49,-3.86,;7.57,-6.3,;8.98,-5.68,;10.24,-6.32,;11.58,-5.56,;12.9,-6.33,;12.89,-7.87,;13.98,-6.77,;14.22,-8.64,;15.56,-7.87,;16.89,-8.64,;18.22,-7.87,;18.22,-6.33,;16.88,-5.56,;15.55,-6.33,;11.56,-8.64,;10.23,-7.86,)| | ||
| Structure | 
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