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Ligand

NameCHEMBL443716
Molecular formulaC38H66O5
IUPAC name1-(3-hexadecanoyl-2,4,6-trihydroxyphenyl)hexadecan-1-one
Molecular weight602.941
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP16.0
Synonyms1,1'-(2,4,6-trihydroxy-1,3-phenylene)bis-1-hexadecanone
Inchi KeyAYQIMSFKYLNEFU-UHFFFAOYSA-N
Inchi IDInChI=1S/C38H66O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-32(39)36-34(41)31-35(42)37(38(36)43)33(40)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31,41-43H,3-30H2,1-2H3
PubChem CID44571473
ChEMBLCHEMBL443716
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
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GLASS IDNameUniProtGeneSpeciesLength
17691Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300

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