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Ligand

NameAC1LTR2R
Molecular formulaC19H16N2O6S2
IUPAC name4-hydroxy-N-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methoxybenzamide
Molecular weight432.465
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP3.4
Synonyms4-hydroxy-N-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methoxybenzamide
BDBM48102
SMR000540319
ST50055240
(4-hydroxy-3-methoxyphenyl)-N-{5-[(4-hydroxy-3-methoxyphenyl)methylene]-4-oxo- 2-thioxo(1,3-thiazolidin-3-yl)}carboxamide
[ Show all ]
Inchi KeyHBMGNBUJVFZDIY-PXNMLYILSA-N
Inchi IDInChI=1S/C19H16N2O6S2/c1-26-14-7-10(3-5-12(14)22)8-16-18(25)21(19(28)29-16)20-17(24)11-4-6-13(23)15(9-11)27-2/h3-9,22-23H,1-2H3,(H,20,24)/b16-8-
PubChem CID1567094
ChEMBLCHEMBL1606916
IUPHARN/A
BindingDB48102
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
110665Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
110667Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
110666Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
110668Thyrotropin-releasing hormone receptorP34981TRHRHomo sapiens (Human)398

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