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Ligand

NameCHEMBL352486
Molecular formulaC36H36N4O4+2
IUPAC name2-[4-[4-[2-[1-[4-(1,3-dioxoisoindol-2-yl)butyl]pyridin-1-ium-4-yl]ethyl]pyridin-1-ium-1-yl]butyl]isoindole-1,3-dione
Molecular weight588.708
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.9
Synonyms4,4'-Ethylenebis[1-(4-phthalimidylbutyl)pyridinium]
CHEMBL1184498
2-[4-(4-{1-[4-(1,3-dioxo-2,3-dihydro-1H-2-isoindolyl)butyl]-4-pyridiniumyl}-1-pyridiniumyl)butyl]-1,3-isoindolinedione; dibromide
BDBM50074554
Inchi KeyKDVNWXZIDHDOHM-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H36N4O4/c41-33-29-9-1-2-10-30(29)34(42)39(33)21-7-5-19-37-23-15-27(16-24-37)13-14-28-17-25-38(26-18-28)20-6-8-22-40-35(43)31-11-3-4-12-32(31)36(40)44/h1-4,9-12,15-18,23-26H,5-8,13-14,19-22H2/q+2
PubChem CID10461019
ChEMBLN/A
IUPHARN/A
BindingDB50074554
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
166739Muscarinic acetylcholine receptor M2P06199CHRM2Sus scrofa (Pig)466

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