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Ligand

NameCHEMBL139091
Molecular formulaC11H13NO3
IUPAC nameN-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)acetamide
Molecular weight207.229
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP0.8
SynonymsBDBM50408599
N-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)acetamide
SCHEMBL7522254
Acetamide, N-[(2,3-dihydro-1,4-benzodioxin-5-yl)methyl]-
214894-55-0
Inchi KeyAKXHOSGGEMFKSG-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H13NO3/c1-8(13)12-7-9-3-2-4-10-11(9)15-6-5-14-10/h2-4H,5-7H2,1H3,(H,12,13)
PubChem CID15838838
ChEMBLCHEMBL139091
IUPHARN/A
BindingDB50408599
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
8001Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350

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