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Ligand

NameCHEMBL1672755
Molecular formulaC9H8N2O3S
IUPAC name5-ethyl-2-sulfanylidene-1H-pyrano[2,3-d]pyrimidine-4,7-dione
Molecular weight224.234
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP0.2
Synonyms5-ethyl-2-mercapto-3H-pyrano[2,3-d]pyrimidine-4,7-dione
5-ethyl-2-thioxo-2,3-dihydro-1h-pyrano[2,3-d]pyrimidine-4,7-dione
AGWCOWNJAYMSIC-UHFFFAOYSA-N
BDBM50337031
SCHEMBL13179049
[ Show all ]
Inchi KeyAGWCOWNJAYMSIC-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H8N2O3S/c1-2-4-3-5(12)14-8-6(4)7(13)10-9(15)11-8/h3H,2H2,1H3,(H2,10,11,13,15)
PubChem CID53322689
ChEMBLCHEMBL1672755
IUPHARN/A
BindingDB50337031
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
5284Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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