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Ligand

NameCHEMBL164109
Molecular formulaC25H25N3O6S
IUPAC name(E)-6-[3-[2-[(2-nitrophenyl)sulfonylamino]ethyl]phenyl]-6-pyridin-3-ylhex-5-enoic acid
Molecular weight495.55
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP4.2
SynonymsBDBM50391319
Inchi KeyDJPVNHLABTYAMF-LSHDLFTRSA-N
Inchi IDInChI=1S/C25H25N3O6S/c29-25(30)13-4-1-10-22(21-9-6-15-26-18-21)20-8-5-7-19(17-20)14-16-27-35(33,34)24-12-3-2-11-23(24)28(31)32/h2-3,5-12,15,17-18,27H,1,4,13-14,16H2,(H,29,30)/b22-10+
PubChem CID15684009
ChEMBLCHEMBL164109
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
61711Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343
61712Thromboxane A2 receptorP34978Tbxa2rRattus norvegicus (Rat)341

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