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Ligand

NameCHEMBL119774
Molecular formulaC29H34F3N3O3
IUPAC name3-[(2R)-2-cyclohexyl-2-(dimethylamino)ethyl]-1-[(2,6-difluorophenyl)methyl]-5-(2-fluoro-3-methoxyphenyl)-6-methylpyrimidine-2,4-dione
Molecular weight529.604
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP5.6
SynonymsBDBM50149262
3-((R)-2-Cyclohexyl-2-dimethylamino-ethyl)-1-(2,6-difluoro-benzyl)-5-(2-fluoro-3-methoxy-phenyl)-6-methyl-1H-pyrimidine-2,4-dione
Inchi KeyABKCSLALYYXMKC-DEOSSOPVSA-N
Inchi IDInChI=1S/C29H34F3N3O3/c1-18-26(20-12-8-15-25(38-4)27(20)32)28(36)35(17-24(33(2)3)19-10-6-5-7-11-19)29(37)34(18)16-21-22(30)13-9-14-23(21)31/h8-9,12-15,19,24H,5-7,10-11,16-17H2,1-4H3/t24-/m0/s1
PubChem CID11283954
ChEMBLCHEMBL119774
IUPHARN/A
BindingDB50149262
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
919Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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