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Ligand

NameMLS000699016
Molecular formulaC11H12N2O3S3
IUPAC name2-[(5Z)-5-[(2E)-2-(3-methyl-1,3-thiazolidin-2-ylidene)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Molecular weight316.408
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.0
SynonymsAE-848/32742054
NCGC00247169-01
2-[(5Z)-5-[(2E)-2-(3-methyl-1,3-thiazolidin-2-ylidene)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
CHEMBL1586687
ZINC4013581
[ Show all ]
Inchi KeyAMSAICQWZZDCEM-LHRDSYOJSA-N
Inchi IDInChI=1S/C11H12N2O3S3/c1-12-4-5-18-8(12)3-2-7-10(16)13(6-9(14)15)11(17)19-7/h2-3H,4-6H2,1H3,(H,14,15)/b7-2-,8-3+
PubChem CID7072146
ChEMBLCHEMBL1586687
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9188Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
9189Thyrotropin-releasing hormone receptorP34981TRHRHomo sapiens (Human)398

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