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Ligand

NameCHEMBL1644237
Molecular formulaC20H21N3O3
IUPAC name2-[2-methoxy-6-[2-(4-methoxyphenyl)ethylamino]pyrimidin-4-yl]phenol
Molecular weight351.406
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50417742
SCHEMBL4494350
Inchi KeyAAYUCSUEYKDIEG-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21N3O3/c1-25-15-9-7-14(8-10-15)11-12-21-19-13-17(22-20(23-19)26-2)16-5-3-4-6-18(16)24/h3-10,13,24H,11-12H2,1-2H3,(H,21,22,23)
PubChem CID135509970
ChEMBLCHEMBL1644237
IUPHARN/A
BindingDB50417742
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
557323Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359

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