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Ligand

NameMLS000778612
Molecular formulaC18H16N2O5S3
IUPAC nameN-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylbenzenesulfonamide
Molecular weight436.515
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP3.8
SynonymsCHEMBL1392012
N-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylbenzenesulfonamide
5-[(4-hydroxy-3-methoxyphenyl)methylene]-3-{[(4-methylphenyl)sulfonyl]amino}-2 -thioxo-1,3-thiazolidin-4-one
SMR000415406
BDBM54096
[ Show all ]
Inchi KeyDJRZIPLCKFJXHA-YBEGLDIGSA-N
Inchi IDInChI=1S/C18H16N2O5S3/c1-11-3-6-13(7-4-11)28(23,24)19-20-17(22)16(27-18(20)26)10-12-5-8-14(21)15(9-12)25-2/h3-10,19,21H,1-2H3/b16-10-
PubChem CID2047042
ChEMBLCHEMBL1392012
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
61772Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
61771Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
470545Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
61770Thyrotropin-releasing hormone receptorP34981TRHRHomo sapiens (Human)398

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