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Ligand

NameCHEMBL126981
Molecular formulaC33H57N2O5+
IUPAC name[4-(hexadecoxymethyl)oxolan-2-yl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate
Molecular weight561.828
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP8.7
Synonyms2-{[Acetyl-(4-hexadecyloxymethyl-tetrahydro-furan-2-ylmethoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; chloride
BDBM50011055
SCHEMBL10516239
2-{[Acetyl-(4-hexadecyloxymethyl-tetrahydro-furan-2-ylmethoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; iodide
CHEMBL1180435
[ Show all ]
Inchi KeyADBZQEHOWMTDKJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H57N2O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-23-38-26-30-24-32(39-27-30)28-40-33(37)35(29(3)36)25-31-21-18-19-22-34(31)5-2/h18-19,21-22,30,32H,4-17,20,23-28H2,1-3H3/q+1
PubChem CID14785973
ChEMBLN/A
IUPHARN/A
BindingDB50011055
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
519710Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342

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