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Ligand

NameCHEMBL349486
Molecular formulaC27H30ClN3O5S
IUPAC name1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]-N-[(1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalen-1-yl)methyl]piperidine-4-carboxamide
Molecular weight544.063
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.2
Synonyms1-[2-(5-Chloro-2-oxo-benzothiazol-3-yl)-acetyl]-piperidine-4-carboxylic acid (1-hydroxy-7-methoxy-1,2,3,4-tetrahydro-naphthalen-1-ylmethyl)-amide
BDBM50110567
N-(1-Hydroxy-7-methoxytetralin-1-ylmethyl)-1-(2-oxo-5-chloro-2,3-dihydrobenzothiazole-3-ylacetyl)-4-piperidinecarboxamide
Inchi KeyAWRSRAVGHHYUAZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H30ClN3O5S/c1-36-20-6-4-17-3-2-10-27(35,21(17)14-20)16-29-25(33)18-8-11-30(12-9-18)24(32)15-31-22-13-19(28)5-7-23(22)37-26(31)34/h4-7,13-14,18,35H,2-3,8-12,15-16H2,1H3,(H,29,33)
PubChem CID44379101
ChEMBLCHEMBL349486
IUPHARN/A
BindingDB50110567
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
16306Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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