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Ligand

NameCHEMBL24293
Molecular formulaC25H27N3
IUPAC name1-[phenyl-(4-pyridin-3-ylphenyl)methyl]-4-prop-2-enylpiperazine
Molecular weight369.512
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.5
Synonyms1-Allyl-4-[phenyl-(4-pyridin-3-yl-phenyl)-methyl]-piperazine
BDBM50077080
1-[4-(3-Pyridinyl)benzhydryl]-4-allylpiperazine
Inchi KeyAFTKXNYVOSKYEX-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H27N3/c1-2-15-27-16-18-28(19-17-27)25(22-7-4-3-5-8-22)23-12-10-21(11-13-23)24-9-6-14-26-20-24/h2-14,20,25H,1,15-19H2
PubChem CID44275536
ChEMBLCHEMBL24293
IUPHARN/A
BindingDB50077080
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
4469Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372

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