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Ligand

NameCHEMBL127875
Molecular formulaC30H56NO4S+
IUPAC name3-[6-[[2-(hexadecoxymethyl)-1,3-dioxolan-4-yl]methoxy]hexyl]-1,3-thiazol-3-ium
Molecular weight526.841
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP9.6
SynonymsBDBM50011077
Toluene-4-sulfonate3-[6-(2-hexadecyloxymethyl-[1,3]dioxolan-4-ylmethoxy)-hexyl]-thiazol-3-ium;Toluene-4-sulfonate
3-[6-(2-Hexadecyloxymethyl-1,3-dioxolan-4-ylmethoxy)hexyl]thiazolium
CHEMBL1180490
Inchi KeyALEBAPAAKCIABV-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H56NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-23-33-27-30-34-26-29(35-30)25-32-22-19-16-14-17-20-31-21-24-36-28-31/h21,24,28-30H,2-20,22-23,25-27H2,1H3/q+1
PubChem CID14785926
ChEMBLN/A
IUPHARN/A
BindingDB50011077
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
519731Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342

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