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Ligand

NameCHEMBL124914
Molecular formulaC14H18N2O2
IUPAC nameN-[3-(1,3-benzoxazol-7-yl)propyl]butanamide
Molecular weight246.31
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.5
SynonymsD03AJW
N-(3-Benzooxazol-7-yl-propyl)-butyramide
BDBM50149178
Inchi KeyADFZAUSXPZLXMN-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H18N2O2/c1-2-5-13(17)15-9-4-7-11-6-3-8-12-14(11)18-10-16-12/h3,6,8,10H,2,4-5,7,9H2,1H3,(H,15,17)
PubChem CID44349108
ChEMBLCHEMBL124914
IUPHARN/A
BindingDB50149178
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
2244Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
2245Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362

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