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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameCHEMBL247762
Molecular formulaC29H29N3O3
IUPAC name5-(6-methoxyquinolin-4-yl)-3-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]-1,3-oxazolidin-2-one
Molecular weight467.569
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.0
SynonymsSCHEMBL6817231
BDBM50423263
Inchi KeyCXPWIZLGIZBSFJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H29N3O3/c1-34-24-8-9-27-26(17-24)25(10-13-30-27)28-19-32(29(33)35-28)23-11-14-31(15-12-23)18-20-6-7-21-4-2-3-5-22(21)16-20/h2-10,13,16-17,23,28H,11-12,14-15,18-19H2,1H3
PubChem CID10004785
ChEMBLCHEMBL247762
IUPHARN/A
BindingDB50423263
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
53018C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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