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Ligand

NameCHEMBL195566
Molecular formulaC22H23FN2O2
IUPAC name3-[2-(3-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)-6-methyl-5-propylpyrimidin-4-one
Molecular weight366.436
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.5
SynonymsSCHEMBL3382006
BDBM50166503
3-[2-(3-Fluoro-phenyl)-ethyl]-2-(2-hydroxy-phenyl)-6-methyl-5-propyl-3H-pyrimidin-4-one
Inchi KeyABCPJAUEYWYDRS-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H23FN2O2/c1-3-7-18-15(2)24-21(19-10-4-5-11-20(19)26)25(22(18)27)13-12-16-8-6-9-17(23)14-16/h4-6,8-11,14,26H,3,7,12-13H2,1-2H3
PubChem CID135423282
ChEMBLCHEMBL195566
IUPHARN/A
BindingDB50166503
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
557328Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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