COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428465
Chemical Name: [(5E)-5-{3-methoxy-4-[(methylsulfonyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(ccc1OS(=O)(=O)C)/C=C\1/SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 403.46
Empirical Formula: C14H13NO7S3

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 0.332
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 175
Number of rings: 2

     

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