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Ligand

NameAC1MNWJ1
Molecular formulaC12H20N6O2
IUPAC name6-(azepan-1-yl)-2-N,2-N-dimethyl-5-nitropyrimidine-2,4-diamine
Molecular weight280.332
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.4
SynonymsMLS001213283
CHEMBL1718308
MolPort-000-753-848
HMS2874P08
ZINC5163574
[ Show all ]
Inchi KeyACHYNKZFCPNNGR-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H20N6O2/c1-16(2)12-14-10(13)9(18(19)20)11(15-12)17-7-5-3-4-6-8-17/h3-8H2,1-2H3,(H2,13,14,15)
PubChem CID3310867
ChEMBLCHEMBL1718308
IUPHARN/A
BindingDBN/A
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
1587Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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