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Ligand

NameCHEMBL418546
Molecular formulaC23H25ClN4O4S
IUPAC name1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]-N-[2-hydroxy-2-(6-methylpyridin-2-yl)ethyl]piperidine-4-carboxamide
Molecular weight488.987
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.0
SynonymsBDBM50111657
FR-235208
1-[2-(5-Chloro-2-oxo-benzothiazol-3-yl)-acetyl]-piperidine-4-carboxylic acid [2-hydroxy-2-(6-methyl-pyridin-2-yl)-ethyl]-amide
FR235208
Inchi KeyBRTWAQQFMHMIDO-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H25ClN4O4S/c1-14-3-2-4-17(26-14)19(29)12-25-22(31)15-7-9-27(10-8-15)21(30)13-28-18-11-16(24)5-6-20(18)33-23(28)32/h2-6,11,15,19,29H,7-10,12-13H2,1H3,(H,25,31)
PubChem CID44271208
ChEMBLCHEMBL418546
IUPHARN/A
BindingDB50111657
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
31342Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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