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Ligand

NameCHEMBL135295
Molecular formulaC21H22N2OS
IUPAC name3-(4-naphthalen-1-ylpiperazin-1-yl)-1-thiophen-3-ylpropan-1-one
Molecular weight350.48
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.1
SynonymsBDBM50102373
3-(4-(naphthalen-1-yl)piperazin-1-yl)-1-(thiophen-3-yl)propan-1-one
3-(4-Naphthalen-1-yl-piperazin-1-yl)-1-thiophen-3-yl-propan-1-one
Inchi KeyAEEDQVJYSPEPSO-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22N2OS/c24-21(18-9-15-25-16-18)8-10-22-11-13-23(14-12-22)20-7-3-5-17-4-1-2-6-19(17)20/h1-7,9,15-16H,8,10-14H2
PubChem CID11792177
ChEMBLCHEMBL135295
IUPHARN/A
BindingDB50102373
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
33805-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
33815-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422

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