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Ligand

NameSCHEMBL1279561
Molecular formulaC24H25NO7S
IUPAC name4-[benzyl-[(2,4,6-trimethoxyphenyl)methyl]sulfamoyl]benzoic acid
Molecular weight471.524
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP3.5
SynonymsTWXMDQCPJHAYOY-UHFFFAOYSA-N
4-(N-benzyl-N-(2,4,6-trimethoxybenzyl)sulfamoyl)benzoic acid
CHEMBL3913926
US9247759, 5-15
BDBM211094
Inchi KeyTWXMDQCPJHAYOY-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H25NO7S/c1-30-19-13-22(31-2)21(23(14-19)32-3)16-25(15-17-7-5-4-6-8-17)33(28,29)20-11-9-18(10-12-20)24(26)27/h4-14H,15-16H2,1-3H3,(H,26,27)
PubChem CID57422337
ChEMBLCHEMBL3913926
IUPHARN/A
BindingDB211094
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
520982Taste receptor type 2 member 14Q9NYV8TAS2R14Homo sapiens (Human)317

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