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Ligand

NameCHEMBL541516
Molecular formulaC26H30N2O4S
IUPAC name3-[3-[[(4-tert-butylphenyl)methyl-pyridin-2-ylsulfonylamino]methyl]phenyl]propanoic acid
Molecular weight466.596
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.8
SynonymsBDBM50293493
SCHEMBL5043152
3-(3-((N-(4-tert-butylbenzyl)pyridine-2-sulfonamido)methyl)phenyl)propanoic acid
Inchi KeySBKAQMPPKOPHSX-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H30N2O4S/c1-26(2,3)23-13-10-21(11-14-23)18-28(33(31,32)24-9-4-5-16-27-24)19-22-8-6-7-20(17-22)12-15-25(29)30/h4-11,13-14,16-17H,12,15,18-19H2,1-3H3,(H,29,30)
PubChem CID18376196
ChEMBLCHEMBL541516
IUPHARN/A
BindingDB50293493
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
310133Prostaglandin E2 receptor EP2 subtypeQ62928Ptger2Rattus norvegicus (Rat)357
310134Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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