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Ligand

Name4-(2,2-Dimethyl-propionylamino)-piperidine-1-carboxylic acid p-tolylamide
Molecular formulaC18H27N3O2
IUPAC name4-(2,2-dimethylpropanoylamino)-N-(4-methylphenyl)piperidine-1-carboxamide
Molecular weight317.433
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP2.7
SynonymsAC1MLDY7
MLS000122262
CHEMBL1567644
HMS2365O22
AKOS000768547
[ Show all ]
Inchi KeyAGSLWZLJQIESKU-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H27N3O2/c1-13-5-7-14(8-6-13)20-17(23)21-11-9-15(10-12-21)19-16(22)18(2,3)4/h5-8,15H,9-12H2,1-4H3,(H,19,22)(H,20,23)
PubChem CID3218403
ChEMBLCHEMBL1567644
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
5170Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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