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Ligand

NameSCHEMBL1278916
Molecular formulaC22H21NO6S
IUPAC name4-[[(4-hydroxyphenyl)sulfonyl-[(2-methoxyphenyl)methyl]amino]methyl]benzoic acid
Molecular weight427.471
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.2
SynonymsUS9247759, 5-42
BDBM211118
SAOZWYAIVLBQRF-UHFFFAOYSA-N
4-((4-hydroxy-N-(2-methoxybenzyl)phenylsulfonamido)methyl)-benzoic acid
CHEMBL3929937
Inchi KeySAOZWYAIVLBQRF-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H21NO6S/c1-29-21-5-3-2-4-18(21)15-23(14-16-6-8-17(9-7-16)22(25)26)30(27,28)20-12-10-19(24)11-13-20/h2-13,24H,14-15H2,1H3,(H,25,26)
PubChem CID25207289
ChEMBLCHEMBL3929937
IUPHARN/A
BindingDB211118
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
520906Taste receptor type 2 member 14Q9NYV8TAS2R14Homo sapiens (Human)317

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