6o-5-HT3
rat-5-HT3 Ki = 5.6 nM; h-AChE IC50 = 4.1 nM; h-BChE IC50 = 40nM
General
Type : Multitarget,5-HT-receptor-ligand,Derivative of Tacrine,Carboxamide,Alkyl linked bis-ligand
Chemical_Nomenclature : 3-methyl-2-(4-methylpiperazin-1-yl)-N-[7-(1,2,3,4-tetrahydroacridin-9-ylamino)heptyl]quinoline-4-carboxamide
Canonical SMILES : CC1=C(C2=CC=CC=C2N=C1N3CCN(CC3)C)C(=O)NCCCCCCCNC4=C5CCCCC5=NC6=CC=CC=C64
InChI : InChI=1S\/C36H46N6O\/c1-26-33(27-14-6-9-17-30(27)40-35(26)42-24-22-41(2)23-25-42)36(43)38-21-13-5-3-4-12-20-37-34-28-15-7-10-18-31(28)39-32-19-11-8-16-29(32)34\/h6-7,9-10,14-15,17-18H,3-5,8,11-13,16,19-25H2,1-2H3,(H,37,39)(H,38,43)
InChIKey : ACKJXXOVSOCBPX-UHFFFAOYSA-N
Other name(s) : CHEMBL195241,BDBM50166984,3-Methyl-2-(4-methyl-piperazin-1-yl)-quinoline-4-carboxylic acid [7-(1,2,3,4-tetrahydro-acridin-9-ylamino)-heptyl]-amide
MW : 578.8
Formula : C36H46N6O
CAS_number :
PubChem : 11376655
UniChem : ACKJXXOVSOCBPX-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : 6o-5-HT3 ligand of proteins in family: BCHE || ACHE
Stucture :
Protein : human-BCHE || human-ACHE
References (1)
| Title : Further studies on the interaction of the 5-hydroxytryptamine3 (5-HT3) receptor with arylpiperazine ligands. development of a new 5-HT3 receptor ligand showing potent acetylcholinesterase inhibitory properties - Cappelli_2005_J.Med.Chem_48_3564 |
| Author(s) : Cappelli A , Gallelli A , Manini M , Anzini M , Mennuni L , Makovec F , Menziani MC , Alcaro S , Ortuso F , Vomero S |
| Ref : Journal of Medicinal Chemistry , 48 :3564 , 2005 |
| Abstract : Cappelli_2005_J.Med.Chem_48_3564 |
| ESTHER : Cappelli_2005_J.Med.Chem_48_3564 |
| PubMedSearch : Cappelli_2005_J.Med.Chem_48_3564 |
| PubMedID: 15887964 |