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Ligand

NameMLS002158500
Molecular formulaC22H31N3O5
IUPAC nameN-[1-(3,4-diethoxyphenyl)ethyl]-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
Molecular weight417.506
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.7
SynonymsHMS3054G04
CHEMBL1314068
SMR001240970
Inchi KeyAFUIOTPVZQPKMX-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H31N3O5/c1-4-29-17-10-9-16(13-18(17)30-5-2)15(3)23-19(26)14-25-20(27)22(24-21(25)28)11-7-6-8-12-22/h9-10,13,15H,4-8,11-12,14H2,1-3H3,(H,23,26)(H,24,28)
PubChem CID25163413
ChEMBLCHEMBL1314068
IUPHARN/A
BindingDBN/A
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
463433Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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