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Ligand

NameCHEMBL159447
Molecular formulaC25H26N2O4S
IUPAC name(E)-6-[3-[2-(benzenesulfonamido)ethyl]phenyl]-6-pyridin-3-ylhex-5-enoic acid
Molecular weight450.553
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.4
SynonymsBDBM50391325
Inchi KeyBXVLOKOSLGIICL-ZMOGYAJESA-N
Inchi IDInChI=1S/C25H26N2O4S/c28-25(29)14-5-4-13-24(22-10-7-16-26-19-22)21-9-6-8-20(18-21)15-17-27-32(30,31)23-11-2-1-3-12-23/h1-3,6-13,16,18-19,27H,4-5,14-15,17H2,(H,28,29)/b24-13+
PubChem CID44374895
ChEMBLCHEMBL159447
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
35505Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343
35506Thromboxane A2 receptorP34978Tbxa2rRattus norvegicus (Rat)341

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