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Ligand

NameCHEMBL39794
Molecular formulaC30H40O6S
IUPAC name4-[(Z,4S,5R)-1-carboxy-4-hydroxy-16-phenoxyhexadec-6-en-5-yl]sulfanylbenzoic acid
Molecular weight528.704
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP7.4
SynonymsN/A
Inchi KeyDHWKLIPYLQPPOH-SIWYVFQGSA-N
Inchi IDInChI=1S/C30H40O6S/c31-27(16-13-18-29(32)33)28(37-26-21-19-24(20-22-26)30(34)35)17-11-6-4-2-1-3-5-7-12-23-36-25-14-9-8-10-15-25/h8-11,14-15,17,19-22,27-28,31H,1-7,12-13,16,18,23H2,(H,32,33)(H,34,35)/b17-11-/t27-,28+/m0/s1
PubChem CID44285563
ChEMBLCHEMBL39794
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
60426Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340

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