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Ligand

NameBCB02_000134
Molecular formulaC22H25NO4S
IUPAC nameethyl 2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylate
Molecular weight399.505
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.0
SynonymsCHEMBL1903531
1-Tosyl-6-(4-methylphenyl)-1,2,5,6-tetrahydropyridine-3-carboxylic acid ethyl ester
SMR001882490
BCB03_000171
ethyl 2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylate
[ Show all ]
Inchi KeyAEHMMQMVYFIPDU-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25NO4S/c1-4-27-22(24)19-11-14-21(18-9-5-16(2)6-10-18)23(15-19)28(25,26)20-12-7-17(3)8-13-20/h5-13,21H,4,14-15H2,1-3H3
PubChem CID6610097
ChEMBLCHEMBL1903531
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
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GLASS IDNameUniProtGeneSpeciesLength
3473Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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