Inhibitor

Bibliography

Biblio print

Tree Display

AceDB Schema

XML Display

Feedback

Inhibitor Report for: 5DYT-5hb

General
Type Piperidine, Derivative of Donepezil, Sulfonamide, Sulfur Compound, Naphthalen
Chemical_Nomenclature N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-N-methylnaphthalene-2-sulfonamide
Canonical SMILES CN(CC1CCCN(C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3
InChI InChI=1S/C24H28N2O2S/c1-25(29(27,28)24-14-13-22-11-5-6-12-23(22)16-24)17-21-10-7-15-26(19-21)18-20-8-3-2-4-9-20/h2-6,8-9,11-14,16,21H,7,10,15,17-19H2,1H3/t21-/m0/s1
InChIKey BZENTEFFWGJVPW-NRFANRHFSA-N
Other name(s) 5HB ; N-((1-benzylpiperidin-3-yl)methyl)-N-methylnaphthalene-2-sulfonamide
________________________________________________________________________________________________
MW|408.56
Formula|C24H28N2O2S
CAS_number|
PubChem|122172815
UniChem|BZENTEFFWGJVPW-NRFANRHFSA-N
IUPHAR|
Wikipedia|

Target
Families | 5DYT-5hb ligand of proteins in family: BCHE
Stucture | 1 structure: 5DYW: Crystal structure of human butyrylcholinesterase in complex with N-((1-benzylpiperidin-3-yl)methyl)-N-(2-methoxyethyl)naphthalene-2-sulfonamide
Protein | human-BCHE

References:
Search PubMed for references concerning: 5DYT-5hb
    Title: Development of an in-vivo active reversible butyrylcholinesterase inhibitor
    Kosak U, Brus B, Knez D, Sink R, Zakelj S, Trontelj J, Pislar A, Slenc J, Gobec M and Gobec S <15 more author(s)>
    Ref: Sci Rep, 6:39495, 2016 : PubMed