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Ligand

NameCHEMBL567274
Molecular formulaC26H20N2O3S2
IUPAC name(E)-3-[1-(naphthalen-2-ylmethyl)indol-7-yl]-N-thiophen-2-ylsulfonylprop-2-enamide
Molecular weight472.577
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.7
SynonymsBDBM50303698
Thiophene-2-sulfonic Acid [(E)-3-(1-Naphthalen-2-ylmethyl-1H-indol-7-yl)acryloyl]amide
Inchi KeyBEQMJPPFUNGRON-OUKQBFOZSA-N
Inchi IDInChI=1S/C26H20N2O3S2/c29-24(27-33(30,31)25-9-4-16-32-25)13-12-21-7-3-8-22-14-15-28(26(21)22)18-19-10-11-20-5-1-2-6-23(20)17-19/h1-17H,18H2,(H,27,29)/b13-12+
PubChem CID44626787
ChEMBLCHEMBL567274
IUPHARN/A
BindingDB50303698
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
21816Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390

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