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Ligand

NameCHEMBL388243
Molecular formulaC26H17BrF5NO3
IUPAC name3-[2-[5-bromo-2-[(2,4-difluorophenyl)methoxy]phenyl]-5-methylpyrrol-1-yl]-5-(trifluoromethyl)benzoic acid
Molecular weight566.322
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP7.2
SynonymsBDBM50423016
SCHEMBL5627315
Inchi KeyAEDRARUZMOPETM-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H17BrF5NO3/c1-14-2-6-23(33(14)20-9-16(25(34)35)8-17(10-20)26(30,31)32)21-11-18(27)4-7-24(21)36-13-15-3-5-19(28)12-22(15)29/h2-12H,13H2,1H3,(H,34,35)
PubChem CID44430697
ChEMBLCHEMBL388243
IUPHARN/A
BindingDB50423016
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
3369Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402

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