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Ligand

NameCHEMBL219327
Molecular formulaC26H29N3O4S
IUPAC nameN-[4-[(1-butanoylpyrrolidin-3-yl)sulfamoyl]naphthalen-1-yl]-2-methylbenzamide
Molecular weight479.595
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.9
Synonyms((+/-)-N-(4-{[(1-butyrylpyrrolidin-3-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
BDBM50203860
SCHEMBL12129318
Inchi KeyLSBLBSMFNCZRSR-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H29N3O4S/c1-3-8-25(30)29-16-15-19(17-29)28-34(32,33)24-14-13-23(21-11-6-7-12-22(21)24)27-26(31)20-10-5-4-9-18(20)2/h4-7,9-14,19,28H,3,8,15-17H2,1-2H3,(H,27,31)
PubChem CID16105832
ChEMBLCHEMBL219327
IUPHARN/A
BindingDB50203860
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
195059C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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