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Ligand

NameCHEMBL385654
Molecular formulaC25H35N3O4S
IUPAC nameN-[4-[(1-butanoylpiperidin-4-yl)sulfamoyl]naphthalen-1-yl]-2-ethylbutanamide
Molecular weight473.632
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.9
SynonymsBDBM50203844
N-(4-{[(1-butyrylpiperidin-4-yl)amino]sulfonyl}-1-naphthyl)-2-ethylbutanamide
Inchi KeyFQDIUMUUJRYNSD-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H35N3O4S/c1-4-9-24(29)28-16-14-19(15-17-28)27-33(31,32)23-13-12-22(20-10-7-8-11-21(20)23)26-25(30)18(5-2)6-3/h7-8,10-13,18-19,27H,4-6,9,14-17H2,1-3H3,(H,26,30)
PubChem CID16105786
ChEMBLCHEMBL385654
IUPHARN/A
BindingDB50203844
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
84597C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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