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Ligand

NameCHEMBL44660
Molecular formulaC24H21FN2O4S
IUPAC name3-[5-(benzenesulfonamido)-3-[(4-fluorophenyl)methyl]indol-1-yl]propanoic acid
Molecular weight452.5
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.0
SynonymsBDBM50403572
SCHEMBL8543932
Inchi KeyCRKZSWJQTBJEPC-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H21FN2O4S/c25-19-8-6-17(7-9-19)14-18-16-27(13-12-24(28)29)23-11-10-20(15-22(18)23)26-32(30,31)21-4-2-1-3-5-21/h1-11,15-16,26H,12-14H2,(H,28,29)
PubChem CID18926545
ChEMBLCHEMBL44660
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
48881Thromboxane A2 receptorP34978Tbxa2rRattus norvegicus (Rat)341

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