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Ligand

NameCHEMBL218037
Molecular formulaC25H27N3O5S
IUPAC nameethyl 4-[(5-benzamidonaphthalen-1-yl)sulfonylamino]piperidine-1-carboxylate
Molecular weight481.567
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.8
SynonymsSCHEMBL1339771
BDBM50203857
ethyl 4-({[5-(benzoylamino)-1-naphthyl]sulfonyl}amino)-piperidine-1-carboxylate
Inchi KeyJFSHHWXYMOFROK-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H27N3O5S/c1-2-33-25(30)28-16-14-19(15-17-28)27-34(31,32)23-13-7-10-20-21(23)11-6-12-22(20)26-24(29)18-8-4-3-5-9-18/h3-13,19,27H,2,14-17H2,1H3,(H,26,29)
PubChem CID9982672
ChEMBLCHEMBL218037
IUPHARN/A
BindingDB50203857
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
149889C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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