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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL371828
Molecular formulaC20H20N2O2
IUPAC name2-(2-hydroxyphenyl)-5,6-dimethyl-3-(2-phenylethyl)pyrimidin-4-one
Molecular weight320.392
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.5
Synonyms2-(2-Hydroxy-phenyl)-5,6-dimethyl-3-phenethyl-3H-pyrimidin-4-one
BXGMPNJZRYPCBV-UHFFFAOYSA-N
SCHEMBL3379098
BDBM50166514
Inchi KeyBXGMPNJZRYPCBV-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H20N2O2/c1-14-15(2)21-19(17-10-6-7-11-18(17)23)22(20(14)24)13-12-16-8-4-3-5-9-16/h3-11,23H,12-13H2,1-2H3
PubChem CID135422953
ChEMBLCHEMBL371828
IUPHARN/A
BindingDB50166514
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
558353Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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