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Ligand

NameCHEMBL387969
Molecular formulaC27H21BrF2N2O4
IUPAC name2-acetamido-5-[2-[5-bromo-2-[(2,4-difluorophenyl)methoxy]phenyl]-5-methylpyrrol-1-yl]benzoic acid
Molecular weight555.376
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP6.0
SynonymsBDBM50422961
SCHEMBL5628901
Inchi KeyALQXIMZVQPKRND-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H21BrF2N2O4/c1-15-3-9-25(32(15)20-7-8-24(31-16(2)33)21(13-20)27(34)35)22-11-18(28)5-10-26(22)36-14-17-4-6-19(29)12-23(17)30/h3-13H,14H2,1-2H3,(H,31,33)(H,34,35)
PubChem CID44426669
ChEMBLCHEMBL387969
IUPHARN/A
BindingDB50422961
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
8520Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402

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