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Ligand

NameCHEMBL331636
Molecular formulaC17H24N2O2
IUPAC name2-methyl-N-[3-(2-propyl-1,3-benzoxazol-7-yl)propyl]propanamide
Molecular weight288.391
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.9
SynonymsSCHEMBL6781523
BDBM50149171
N-[3-(2-Propyl-benzooxazol-7-yl)-propyl]-isobutyramide
Inchi KeyBEQGDFNQWJVWGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H24N2O2/c1-4-7-15-19-14-10-5-8-13(16(14)21-15)9-6-11-18-17(20)12(2)3/h5,8,10,12H,4,6-7,9,11H2,1-3H3,(H,18,20)
PubChem CID22718654
ChEMBLCHEMBL331636
IUPHARN/A
BindingDB50149171
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
21810Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
21809Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362

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