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Ligand

NameCHEMBL125642
Molecular formulaC16H20N2O2
IUPAC nameN-[3-(2-ethyl-1,3-benzoxazol-7-yl)propyl]cyclopropanecarboxamide
Molecular weight272.348
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.0
SynonymsBDBM50149176
Cyclopropanecarboxylic acid [3-(2-ethyl-benzooxazol-7-yl)-propyl]-amide
Inchi KeyCWDUPBUCCVAMPX-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H20N2O2/c1-2-14-18-13-7-3-5-11(15(13)20-14)6-4-10-17-16(19)12-8-9-12/h3,5,7,12H,2,4,6,8-10H2,1H3,(H,17,19)
PubChem CID44348996
ChEMBLCHEMBL125642
IUPHARN/A
BindingDB50149176
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
52012Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
52011Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362

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