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Ligand

NameCHEMBL2030159
Molecular formulaC26H28N2O2S
IUPAC name4-[hydroxy(diphenyl)methyl]-N-(3-methoxyphenyl)piperidine-1-carbothioamide
Molecular weight432.582
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.8
SynonymsAKOS003329784
ZINC16315399
4-[hydroxy(diphenyl)methyl]-N-(3-methoxyphenyl)piperidine-1-carbothioamide
ST50856382
BDBM50384198
[ Show all ]
Inchi KeyBIKYNDCDUMNFSQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H28N2O2S/c1-30-24-14-8-13-23(19-24)27-25(31)28-17-15-22(16-18-28)26(29,20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-14,19,22,29H,15-18H2,1H3,(H,27,31)
PubChem CID17376722
ChEMBLCHEMBL2030159
IUPHARN/A
BindingDB50384198
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
24518Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381

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