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Ligand

NameFlufylline
Molecular formulaC21H24FN5O3
IUPAC name7-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione
Molecular weight413.453
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP1.5
Synonyms7-(2-(4-(4-fluorobenzoyl)-1-piperidinyl)ethyl)-3,7-dihydro-1,3-dimethyl-1h-purine-2,6-dione
BDBM81981
PDSP2_000825
7-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1,3-dimethylpurine-2,6-dione
CTK5E9479
[ Show all ]
Inchi KeyPMEYQPKJAPXGPS-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24FN5O3/c1-24-19-17(20(29)25(2)21(24)30)27(13-23-19)12-11-26-9-7-15(8-10-26)18(28)14-3-5-16(22)6-4-14/h3-6,13,15H,7-12H2,1-2H3
PubChem CID71255
ChEMBLN/A
IUPHARN/A
BindingDB81981
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5565035-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
263179Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
263180Alpha-2C adrenergic receptorP22086Adra2cRattus norvegicus (Rat)458

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