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Ligand

NameCHEMBL583843
Molecular formulaC29H33N3O4
IUPAC name3-[9-[[2-(2-methoxyphenoxy)phenyl]methyl]-3,9-diazaspiro[5.5]undecane-3-carbonyl]-1H-pyridin-2-one
Molecular weight487.6
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.0
SynonymsBDBM50414970
SCHEMBL2076183
Inchi KeyAQTZHUHBIRXOHR-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H33N3O4/c1-35-25-10-4-5-11-26(25)36-24-9-3-2-7-22(24)21-31-17-12-29(13-18-31)14-19-32(20-15-29)28(34)23-8-6-16-30-27(23)33/h2-11,16H,12-15,17-21H2,1H3,(H,30,33)
PubChem CID11965686
ChEMBLCHEMBL583843
IUPHARN/A
BindingDB50414970
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
12101C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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