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Ligand

NameSCHEMBL1279325
Molecular formulaC22H20FNO4S
IUPAC name4-[[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]methyl]benzoic acid
Molecular weight413.463
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.0
SynonymsCHEMBL3907785
US9247759, 5-37
BDBM211114
IJOKPNMGSRYULE-UHFFFAOYSA-N
4-((N-(4-fluorobenzyl)-4-methylphenylsulfonamido)methyl)benzoic acid
Inchi KeyIJOKPNMGSRYULE-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20FNO4S/c1-16-2-12-21(13-3-16)29(27,28)24(15-18-6-10-20(23)11-7-18)14-17-4-8-19(9-5-17)22(25)26/h2-13H,14-15H2,1H3,(H,25,26)
PubChem CID57422343
ChEMBLCHEMBL3907785
IUPHARN/A
BindingDB211114
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
520272Taste receptor type 2 member 14Q9NYV8TAS2R14Homo sapiens (Human)317

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