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Ligand

Nametolylpiperidine, 18n
Molecular formulaC22H23NO3S
IUPAC name(2-methyl-3-piperidin-4-ylphenyl) naphthalene-2-sulfonate
Molecular weight381.49
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.7
SynonymsCHEMBL527098
BDBM28636
2-methyl-3-(piperidin-4-yl)phenyl naphthalene-2-sulfonate
Inchi KeyAAWQGWQWNPBUQQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H23NO3S/c1-16-21(18-11-13-23-14-12-18)7-4-8-22(16)26-27(24,25)20-10-9-17-5-2-3-6-19(17)15-20/h2-10,15,18,23H,11-14H2,1H3
PubChem CID25263355
ChEMBLCHEMBL527098
IUPHARN/A
BindingDB28636
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
5845-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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