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Ligand

NameCHEMBL3920347
Molecular formulaC22H30O6
IUPAC name3-[(2R,5aR,6R,7R,8aS)-7-hydroxy-6-[(E,3R)-3-hydroxy-4-phenoxybut-1-enyl]-3,4,5,5a,6,7,8,8a-octahydro-2H-cyclopenta[b]oxepin-2-yl]propanoic acid
Molecular weight390.476
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.3
SynonymsBDBM50206026
SCHEMBL3699791
Inchi KeyCYLHGVYASRLHMY-OVCPVMRKSA-N
Inchi IDInChI=1S/C22H30O6/c23-15(14-27-16-5-2-1-3-6-16)9-11-18-19-8-4-7-17(10-12-22(25)26)28-21(19)13-20(18)24/h1-3,5-6,9,11,15,17-21,23-24H,4,7-8,10,12-14H2,(H,25,26)/b11-9+/t15-,17-,18-,19-,20-,21+/m1/s1
PubChem CID68749474
ChEMBLCHEMBL3920347
IUPHARN/A
BindingDB50206026
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
537317Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
537316Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
537318Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359

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