Reaction Details Report a problem with these data
Target
Acetylcholinesterase
Ligand
BDBM50016845
Substrate
n/a
Meas. Tech.
ChEMBL_1355049 (CHEMBL3280463)
Ki
1300±n/a nM
Citation
 Chen, WS; Cocolas, GH; Cavallito, CJ; Chai, KJ Potent reversible anticholinesterase agents. Bis- and mono-N-substituted benzoquinolinium halides. J Med Chem 20:1617-23 (1978) [PubMed]  Article 
Target
Name:
Acetylcholinesterase
Synonyms:
ACES_ELEEL | Acetylcholinesterase (AChE) | Acetylcholinesterase (EeAChE) | ache
Type:
Enzyme
Mol. Mass.:
71812.79
Organism:
Electrophorus electricus (Electric eel)
Description:
n/a
Residue:
633
Sequence:
MKILDALLFPVIFIMFFIHLSIAQTDPELTIMTRLGQVQGTRLPVPDRSHVIAFLGIPFAEPPLGKMRFKPPEPKKPWNDVFDARDYPSACYQYVDTSYPGFSGTEMWNPNRMMSEDCLYLNVWVPATPRPHNLTVMVWIYGGGFYSGSSSLDVYDGRYLAHSEKVVVVSMNYRVSAFGFLALNGSAEAPGNVGLLDQRLALQWVQDNIHFFGGNPKQVTIFGESAGAASVGMHLLSPDSRPKFTRAILQSGVPNGPWRTVSFDEARRRAIKLGRLVGCPDGNDTDLIDCLRSKQPQDLIDQEWLVLPFSGLFRFSFVPVIDGVVFPDTPEAMLNSGNFKDTQILLGVNQNEGSYFLIYGAPGFSKDNESLITREDFLQGVKMSVPHANEIGLEAVILQYTDWMDEDNPIKNREAMDDIVGDHNVVCPLQHFAKMYAQYSILQGQTGTASQGNLGWGNSGSASNSGNSQVSVYLYMFDHRASNLVWPEWMGVIHGYEIEFVFGLPLEKRLNYTLEEEKLSRRMMKYWANFARTGNPNINVDGSIDSRRRWPVFTSTEQKHVGLNTDSLKVHKGLKSQFCALWNRFLPRLLNVTENIDDAERQWKAEFHRWSSYMMHWKNQFDHYSKQERCTNL
  
Inhibitor
Name:
BDBM50016845
Synonyms:
HEXAFLUORENIUM BROMIDE | Hexaflurone Bromide | Hexafluronium Bromide | Mylaxen
Type:
Small organic molecule
Emp. Form.:
C36H42Br2N2
Mol. Mass.:
662.54
SMILES:
[Br-].[Br-].C[N+](C)(CCCCCC[N+](C)(C)C1c2ccccc2-c2ccccc12)C1c2ccccc2-c2ccccc12
Structure:
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