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Ligand

NameCHEMBL326510
Molecular formulaC22H23F2N3O3
IUPAC name3-[(2R)-2-aminopropyl]-1-[(2,6-difluorophenyl)methyl]-5-(3-methoxyphenyl)-6-methylpyrimidine-2,4-dione
Molecular weight415.441
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.6
Synonyms1-(2,6-Difluorobenzyl)-3-[(R)-2-aminopropyl]-5-(3-methoxyphenyl)-6-methyluracil
BDBM50132737
3-((R)-2-Amino-propyl)-1-(2,6-difluoro-benzyl)-5-(3-methoxy-phenyl)-6-methyl-1H-pyrimidine-2,4-dione
Inchi KeyAYPFBVKPMHZLON-CYBMUJFWSA-N
Inchi IDInChI=1S/C22H23F2N3O3/c1-13(25)11-27-21(28)20(15-6-4-7-16(10-15)30-3)14(2)26(22(27)29)12-17-18(23)8-5-9-19(17)24/h4-10,13H,11-12,25H2,1-3H3/t13-/m1/s1
PubChem CID44340636
ChEMBLCHEMBL326510
IUPHARN/A
BindingDB50132737
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
17656Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328

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