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Ligand

NameMLS000735134
Molecular formulaC24H29NO5
IUPAC nameethyl 1-(1,3-benzodioxol-4-ylmethyl)-4-[(3-methoxyphenyl)methyl]piperidine-4-carboxylate
Molecular weight411.498
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.0
SynonymsCHEMBL1560695
SMR000318117
HMS2653A19
MolPort-005-070-425
ethyl 1-(1,3-benzodioxol-4-ylmethyl)-4-(3-methoxybenzyl)-4-piperidinecarboxylate
[ Show all ]
Inchi KeyACYIFJVISTZKDH-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H29NO5/c1-3-28-23(26)24(15-18-6-4-8-20(14-18)27-2)10-12-25(13-11-24)16-19-7-5-9-21-22(19)30-17-29-21/h4-9,14H,3,10-13,15-17H2,1-2H3
PubChem CID16190554
ChEMBLCHEMBL1560695
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
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GLASS IDNameUniProtGeneSpeciesLength
2030Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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