5DYY-5hh
General
Type : Piperidine,Derivative of Donepezil,Sulfonamide,Sulfur Compound,Naphthalen
Chemical_Nomenclature : N-[[(3R)-1-benzylpiperidin-3-yl]methyl]naphthalene-2-sulfonamide
Canonical SMILES : C1CC(CN(C1)CC2=CC=CC=C2)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3
InChI : InChI=1S\/C23H26N2O2S\/c26-28(27,23-13-12-21-10-4-5-11-22(21)15-23)24-16-20-9-6-14-25(18-20)17-19-7-2-1-3-8-19\/h1-5,7-8,10-13,15,20,24H,6,9,14,16-18H2\/t20-\/m0\/s1
InChIKey : LOOROLBHYLIWTF-FQEVSTJZSA-N
Other name(s) : N-((1-benzylpiperidin-3-yl)methyl)naphthalene-2-sulfonamide,5HH
MW : 394.53
Formula : C23H26N2O2S
CAS_number :
PubChem : 123133732
UniChem : LOOROLBHYLIWTF-FQEVSTJZSA-N
IUPHAR :
Wikipedia :
Target
Families : 5DYY-5hh ligand of proteins in family: BCHE
Stucture : 5DYY Crystal structure of human butyrylcholinesterase in complex with N-((1-benzylpiperidin-3-yl)methyl)naphthalene-2-sulfonamide
Protein : human-BCHE
References (1)
| Title : Development of an in-vivo active reversible butyrylcholinesterase inhibitor - Kosak_2016_Sci.Rep_6_39495 |
| Author(s) : Kosak U , Brus B , Knez D , Sink R , Zakelj S , Trontelj J , Pislar A , Slenc J , Gobec M , Zivin M , Tratnjek L , Perse M , Salat K , Podkowa A , Filipek B , Nachon F , Brazzolotto X , Wieckowska A , Malawska B , Stojan J , Rascan IM , Kos J , Coquelle N , Colletier JP , Gobec S |
| Ref : Sci Rep , 6 :39495 , 2016 |
| Abstract : Kosak_2016_Sci.Rep_6_39495 |
| ESTHER : Kosak_2016_Sci.Rep_6_39495 |
| PubMedSearch : Kosak_2016_Sci.Rep_6_39495 |
| PubMedID: 28000737 |
| Gene_locus related to this paper: human-BCHE |