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Ligand

NameCHEMBL541517
Molecular formulaC24H28N2O4S2
IUPAC name3-[3-[[(4-tert-butylphenyl)methyl-(1,3-thiazol-2-ylsulfonyl)amino]methyl]phenyl]propanoic acid
Molecular weight472.618
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.9
SynonymsBDBM50293495
SCHEMBL5043203
3-(3-((N-(4-tert-butylbenzyl)thiazole-2-sulfonamido)methyl)phenyl)propanoic acid
Inchi KeyWVDZQCYXZZHZIL-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H28N2O4S2/c1-24(2,3)21-10-7-19(8-11-21)16-26(32(29,30)23-25-13-14-31-23)17-20-6-4-5-18(15-20)9-12-22(27)28/h4-8,10-11,13-15H,9,12,16-17H2,1-3H3,(H,27,28)
PubChem CID18376082
ChEMBLCHEMBL541517
IUPHARN/A
BindingDB50293495
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
383165Prostaglandin E2 receptor EP2 subtypeQ62928Ptger2Rattus norvegicus (Rat)357
383166Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488

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