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Ligand

NameCHEMBL8004
Molecular formulaC18H20N2O2
IUPAC nameN-[4-(2,3-dihydro-1-benzofuran-4-ylamino)phenyl]butanamide
Molecular weight296.37
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.5
SynonymsBDBM50142212
N-[4-(2,3-Dihydro-benzofuran-4-ylamino)-phenyl]-butyramide
Inchi KeyBJAAWFITTQOGQA-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20N2O2/c1-2-4-18(21)20-14-9-7-13(8-10-14)19-16-5-3-6-17-15(16)11-12-22-17/h3,5-10,19H,2,4,11-12H2,1H3,(H,20,21)
PubChem CID44264983
ChEMBLCHEMBL8004
IUPHARN/A
BindingDB50142212
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
24901Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
24902Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362

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