COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL221187
Chemical Name: 3-{(5E)-5-[4-(carboxymethoxy)-3-ethoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoicacid
Smiles: CCOc1cc(ccc1OCC(=O)O)/C=C\1/SC(=S)N(C1=O)CCC(=O)O

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Molecular Weight: 411.46
Empirical Formula: C17H17NO7S2

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 1.24
Rotatable bonds: 11
H-donors: 2
H-acceptors: 7
PSA: 170
Number of rings: 2

     

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