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Ligand

NameCHEMBL3968443
Molecular formulaC28H35F2NO4S
IUPAC name5-[3-[(5R)-3,3-difluoro-5-[(E,3S,4S)-3-hydroxy-4-methyl-9-phenylnon-1-enyl]-2-oxopyrrolidin-1-yl]propyl]thiophene-2-carboxylic acid
Molecular weight519.648
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP6.8
SynonymsBDBM190296
SCHEMBL15587094
US9180116, 39C
Inchi KeyAGGYHZMNJSBHQQ-WWTZYMIRSA-N
Inchi IDInChI=1S/C28H35F2NO4S/c1-20(9-4-2-5-10-21-11-6-3-7-12-21)24(32)16-14-22-19-28(29,30)27(35)31(22)18-8-13-23-15-17-25(36-23)26(33)34/h3,6-7,11-12,14-17,20,22,24,32H,2,4-5,8-10,13,18-19H2,1H3,(H,33,34)/b16-14+/t20-,22-,24+/m0/s1
PubChem CID90054490
ChEMBLCHEMBL3968443
IUPHARN/A
BindingDB190296
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
517346Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
517347Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488

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