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Ligand

NameCHEMBL88181
Molecular formulaC23H31N3O2S
IUPAC name2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylsulfanyl]-N,N-dimethylbenzamide
Molecular weight413.58
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.9
SynonymsN/A
Inchi KeyAWQSDGXLSKTXKZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H31N3O2S/c1-24(2)23(27)19-9-4-7-12-22(19)29-18-8-13-25-14-16-26(17-15-25)20-10-5-6-11-21(20)28-3/h4-7,9-12H,8,13-18H2,1-3H3
PubChem CID10693071
ChEMBLCHEMBL88181
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16276Alpha-1A adrenergic receptorO02824ADRA1AOryctolagus cuniculus (Rabbit)466
16275Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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