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Ligand

NameCHEMBL31097
Molecular formulaC33H58N4O4+2
IUPAC name3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propyl-[7-[3-[(3aR,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propyl-dimethylazaniumyl]heptyl]-dimethylazanium
Molecular weight574.851
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.1
SynonymsN/A
Inchi KeyDNWIGZVZEVCVLT-JFKGYSMFSA-N
Inchi IDInChI=1S/C33H58N4O4/c1-36(2,24-14-20-34-30(38)26-16-8-9-17-27(26)31(34)39)22-12-6-5-7-13-23-37(3,4)25-15-21-35-32(40)28-18-10-11-19-29(28)33(35)41/h26-29H,5-25H2,1-4H3/q+2/t26-,27-,28+,29+
PubChem CID10348116
ChEMBLCHEMBL31097
IUPHARN/A
BindingDBN/A
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
64719Muscarinic acetylcholine receptor M2P06199CHRM2Sus scrofa (Pig)466

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