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Ligand

NameCHEMBL217979
Molecular formulaC25H27N3O4S
IUPAC nameN-[4-[(1-butanoylazetidin-3-yl)sulfamoyl]naphthalen-1-yl]-2-methylbenzamide
Molecular weight465.568
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.5
SynonymsBDBM50203848
N-(4-{[(1-butyrylazetidin-3-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
Inchi KeyGTSAXRXSYRUOES-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H27N3O4S/c1-3-8-24(29)28-15-18(16-28)27-33(31,32)23-14-13-22(20-11-6-7-12-21(20)23)26-25(30)19-10-5-4-9-17(19)2/h4-7,9-14,18,27H,3,8,15-16H2,1-2H3,(H,26,30)
PubChem CID16105844
ChEMBLCHEMBL217979
IUPHARN/A
BindingDB50203848
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
105123C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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