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Ligand

NameCHEMBL2402575
Molecular formulaC17H16ClN3O4S
IUPAC name1-[2-(4-chlorophenoxy)-5-cyanophenyl]sulfonyl-3-propan-2-ylurea
Molecular weight393.842
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.2
SynonymsBDBM50436766
Inchi KeyACKOXVMZLWNATE-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H16ClN3O4S/c1-11(2)20-17(22)21-26(23,24)16-9-12(10-19)3-8-15(16)25-14-6-4-13(18)5-7-14/h3-9,11H,1-2H3,(H2,20,21,22)
PubChem CID71740310
ChEMBLCHEMBL2402575
IUPHARN/A
BindingDB50436766
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
1662Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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