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Ligand

NameBDBM50193383
Molecular formulaC20H26N4O
IUPAC name1-[3-(3,5-dimethylphenyl)-3-nitrosopropyl]-4-pyridin-2-ylpiperazine
Molecular weight338.455
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.2
Synonyms(E)-1-(3,5-dimethylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)-propan-1-one oxime
Inchi KeyAQJATUGTTYSWNU-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H26N4O/c1-16-13-17(2)15-18(14-16)19(22-25)6-8-23-9-11-24(12-10-23)20-5-3-4-7-21-20/h3-5,7,13-15,19H,6,8-12H2,1-2H3
PubChem CID91936226
ChEMBLN/A
IUPHARN/A
BindingDB50193383
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11813D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
11814D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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