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Ligand

NameSCHEMBL215536
Molecular formulaC28H32N2O5S
IUPAC name(E)-3-[4-[[4,5-dimethyl-2-[2-methylpropyl(pyridin-3-ylsulfonyl)amino]phenoxy]methyl]-3-methylphenyl]prop-2-enoic acid
Molecular weight508.633
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM190571
US9181187, Compound I
CHEMBL3928704
Inchi KeyILTMQNRYNXMLNS-PKNBQFBNSA-N
Inchi IDInChI=1S/C28H32N2O5S/c1-19(2)17-30(36(33,34)25-7-6-12-29-16-25)26-14-20(3)21(4)15-27(26)35-18-24-10-8-23(13-22(24)5)9-11-28(31)32/h6-16,19H,17-18H2,1-5H3,(H,31,32)/b11-9+
PubChem CID23106360
ChEMBLCHEMBL3928704
IUPHARN/A
BindingDB190571
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
518030Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405

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