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Ligand

NameCHEMBL166803
Molecular formulaC34H56N6O4
IUPAC nameN,N'-bis[6-[(4-nitrophenyl)methylamino]hexyl]octane-1,8-diamine
Molecular weight612.86
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP6.5
SynonymsBDBM50405746
Inchi KeyAGZMQFHXEWQEDZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H56N6O4/c41-39(42)33-19-15-31(16-20-33)29-37-27-13-7-5-11-25-35-23-9-3-1-2-4-10-24-36-26-12-6-8-14-28-38-30-32-17-21-34(22-18-32)40(43)44/h15-22,35-38H,1-14,23-30H2
PubChem CID44380975
ChEMBLCHEMBL166803
IUPHARN/A
BindingDB50405746
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
5355Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466

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