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Ligand

NameCHEMBL159775
Molecular formulaC22H20IN3O5S
IUPAC name2-[(E)-[[3-[2-[(4-iodophenyl)sulfonylamino]ethyl]phenyl]-pyridin-3-ylmethylidene]amino]oxyacetic acid
Molecular weight565.382
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP3.9
SynonymsBDBM50391320
Inchi KeyDQRRRJQMMFHFRI-XTCLZLMSSA-N
Inchi IDInChI=1S/C22H20IN3O5S/c23-19-6-8-20(9-7-19)32(29,30)25-12-10-16-3-1-4-17(13-16)22(26-31-15-21(27)28)18-5-2-11-24-14-18/h1-9,11,13-14,25H,10,12,15H2,(H,27,28)/b26-22+
PubChem CID44374886
ChEMBLCHEMBL159775
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
66567Thromboxane A2 receptorP34978Tbxa2rRattus norvegicus (Rat)341
66568Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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