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Ligand

NameCHEMBL30939
Molecular formulaC36H46N4O4+2
IUPAC name3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl-[6-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]hexyl]-dimethylazanium
Molecular weight598.788
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.1
SynonymsN/A
Inchi KeyCRXYGJUBYBTJCZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H46N4O4/c1-39(2,25-13-21-37-33(41)28-17-7-8-18-29(28)34(37)42)23-9-5-6-10-24-40(3,4)26-14-22-38-35(43)30-19-11-15-27-16-12-20-31(32(27)30)36(38)44/h7-8,11-12,15-20H,5-6,9-10,13-14,21-26H2,1-4H3/q+2
PubChem CID10077281
ChEMBLCHEMBL30939
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
49233Muscarinic acetylcholine receptor M2P06199CHRM2Sus scrofa (Pig)466

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