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Ligand

NameCHEMBL255527
Molecular formulaC32H32N2O6S
IUPAC nameN-[[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)-3-methylphenyl]methylsulfonyl]-2-phenylacetamide
Molecular weight572.676
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.1
SynonymsBDBM50372054
Inchi KeyBHXKXWYQXVARLG-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H32N2O6S/c1-4-39-30-24-13-9-10-14-25(24)31(40-5-2)29-26(30)19-34(32(29)36)27-16-15-23(17-21(27)3)20-41(37,38)33-28(35)18-22-11-7-6-8-12-22/h6-17H,4-5,18-20H2,1-3H3,(H,33,35)
PubChem CID44453376
ChEMBLCHEMBL255527
IUPHARN/A
BindingDB50372054
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
24172Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488

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