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Ligand

NameMelatonin
Molecular formulaC13H16N2O2
IUPAC nameN-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Molecular weight232.283
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP0.8
Synonyms73-31-4
Melatonine
N-Acetyl-5-methoxytryptamine
Circadin
5-Methoxy-N-acetyltryptamine
[ Show all ]
Inchi KeyDRLFMBDRBRZALE-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
PubChem CID896
ChEMBLCHEMBL45
IUPHAR1357, 224
BindingDB9019
DrugBankDB01065

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 15
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
670885-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5557375-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
670965-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
671005-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
670925-hydroxytryptamine receptor 5AP35364Htr5aRattus norvegicus (Rat)357
670995-hydroxytryptamine receptor 5BP35365Htr5bRattus norvegicus (Rat)370
5557385-hydroxytryptamine receptor 7P32305Htr7Rattus norvegicus (Rat)448
67091Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
67093Melatonin receptor type 1AO02781MTNR1ASus scrofa (Pig)154
67095Melatonin receptor type 1AP48040MTNR1AOvis aries (Sheep)366
67090Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362
67094Melatonin receptor type 1BP51050Gallus gallus (Chicken)289
67089Melatonin receptor type 1CP49219mtnr1cXenopus laevis (African clawed frog)420
67098Melatonin receptor type 1CP49288Gallus gallus (Chicken)346
67097Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460

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