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Ligand

NameCHEMBL169475
Molecular formulaC37H36N6O6+2
IUPAC name2-[3-[(E)-[1-[3-[4-[(E)-3-(1,3-dioxoisoindol-2-yl)propoxyiminomethyl]pyridin-1-ium-1-yl]propyl]pyridin-1-ium-4-yl]methylideneamino]oxypropyl]isoindole-1,3-dione
Molecular weight660.731
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP4.1
SynonymsBDBM50074557
CHEMBL1181392
Inchi KeyIDEOOZMYFZHAIL-FGGILOIWSA-N
Inchi IDInChI=1S/C37H36N6O6/c44-34-30-8-1-2-9-31(30)35(45)42(34)18-6-24-48-38-26-28-12-20-40(21-13-28)16-5-17-41-22-14-29(15-23-41)27-39-49-25-7-19-43-36(46)32-10-3-4-11-33(32)37(43)47/h1-4,8-15,20-23,26-27H,5-7,16-19,24-25H2/q+2/b38-26+,39-27+
PubChem CID10676884
ChEMBLN/A
IUPHARN/A
BindingDB50074557
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
130382Muscarinic acetylcholine receptor M2P06199CHRM2Sus scrofa (Pig)466

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