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Ligand

NameCHEMBL495625
Molecular formulaC24H22N4O4
IUPAC nameN-[5-(3-methoxyphenyl)pyrimidin-2-yl]-3-oxospiro[2-benzofuran-1,4'-piperidine]-1'-carboxamide
Molecular weight430.464
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.8
SynonymsBDBM50268595
N-(5-(3-methoxyphenyl)pyrimidin-2-yl)-3-oxo-3H-spiro[isobenzofuran-1,4''-piperidine]-1''-carboxamide
Inchi KeyAHOCDNAVZUWHDJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22N4O4/c1-31-18-6-4-5-16(13-18)17-14-25-22(26-15-17)27-23(30)28-11-9-24(10-12-28)20-8-3-2-7-19(20)21(29)32-24/h2-8,13-15H,9-12H2,1H3,(H,25,26,27,30)
PubChem CID44583436
ChEMBLCHEMBL495625
IUPHARN/A
BindingDB50268595
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
5728Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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