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Ligand

NameCHEMBL46683
Molecular formulaC22H22FN3O4
IUPAC name3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-7-hydroxy-1H-quinazoline-2,4-dione
Molecular weight411.433
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.2
SynonymsBDBM50025124
3-{2-[4-(4-Fluoro-benzoyl)-piperidin-1-yl]-ethyl}-7-hydroxy-1H-quinazoline-2,4-dione
Inchi KeyKUQJDAMRVKQSPB-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22FN3O4/c23-16-3-1-14(2-4-16)20(28)15-7-9-25(10-8-15)11-12-26-21(29)18-6-5-17(27)13-19(18)24-22(26)30/h1-6,13,15,27H,7-12H2,(H,24,30)
PubChem CID44290349
ChEMBLCHEMBL46683
IUPHARN/A
BindingDB50025124
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
178706D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
178705Histamine H1 receptorP31390Hrh1Rattus norvegicus (Rat)486

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