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Ligand

NameCHEMBL563949
Molecular formulaC16H12F2N2O4S
IUPAC name2-[1-(3,4-difluorophenyl)sulfonyl-2-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
Molecular weight366.339
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.6
SynonymsSCHEMBL1940356
[1-(3,4-difluoro-benzenesulfonyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl]-acetic acid
BDBM50296848
HLSYGDSWXJGENX-UHFFFAOYSA-N
2-(1-(3,4-difluorophenylsulfonyl)-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)acetic acid
Inchi KeyHLSYGDSWXJGENX-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H12F2N2O4S/c1-9-12(8-15(21)22)11-3-2-6-19-16(11)20(9)25(23,24)10-4-5-13(17)14(18)7-10/h2-7H,8H2,1H3,(H,21,22)
PubChem CID11667741
ChEMBLCHEMBL563949
IUPHARN/A
BindingDB50296848
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: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
118206Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
118202Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
118198Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
118200Prostaglandin D2 receptor 2Q9Z2J6Ptgdr2Mus musculus (Mouse)382
118205Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
118201Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
118203Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488
118204Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359
118199Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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