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Ligand

NameSCHEMBL1939501
Molecular formulaC17H15ClN2O5S
IUPAC name2-[1-(4-chloro-3-methoxyphenyl)sulfonyl-2-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
Molecular weight394.826
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.0
SynonymsCHEMBL3947488
Inchi KeyAAOILMKPAAXMET-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H15ClN2O5S/c1-10-13(9-16(21)22)12-4-3-7-19-17(12)20(10)26(23,24)11-5-6-14(18)15(8-11)25-2/h3-8H,9H2,1-2H3,(H,21,22)
PubChem CID67218839
ChEMBLCHEMBL3947488
IUPHARN/A
BindingDBN/A
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
535909Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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