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Ligand

NameMLS000556999
Molecular formulaC18H21N3O
IUPAC name(E,Z)-3-(furan-2-yl)-2-methyl-N-(4-phenylpiperazin-1-yl)prop-2-en-1-imine
Molecular weight295.386
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.6
SynonymsCHEMBL3194192
MolPort-002-589-981
STL337963
AKOS022095848
SMR000148116
[ Show all ]
Inchi KeyAICSVHKDXCXLGP-UOHONPKESA-N
Inchi IDInChI=1S/C18H21N3O/c1-16(14-18-8-5-13-22-18)15-19-21-11-9-20(10-12-21)17-6-3-2-4-7-17/h2-8,13-15H,9-12H2,1H3/b16-14-,19-15+
PubChem CID9579635
ChEMBLCHEMBL3194192
IUPHARN/A
BindingDBN/A
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
463614Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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