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Ligand

NameCHEMBL117400
Molecular formulaC29H33FN4O3S
IUPAC name2-[4-(benzenesulfonamido)piperidin-1-yl]-N-[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide
Molecular weight536.666
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.0
SynonymsBDBM50084701
2-(4-Benzenesulfonylamino-piperidin-1-yl)-N-(6-fluoro-1-pyridin-3-ylmethyl-1,2,3,4-tetrahydro-naphthalen-2-yl)-acetamide
Inchi KeyAIUQNVGODUWATC-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H33FN4O3S/c30-23-9-10-26-22(18-23)8-11-28(27(26)17-21-5-4-14-31-19-21)32-29(35)20-34-15-12-24(13-16-34)33-38(36,37)25-6-2-1-3-7-25/h1-7,9-10,14,18-19,24,27-28,33H,8,11-13,15-17,20H2,(H,32,35)
PubChem CID9850107
ChEMBLCHEMBL117400
IUPHARN/A
BindingDB50084701
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
6536Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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