COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358230
Chemical Name: (5E)-5-(4-ethoxy-3-methoxybenzylidene)-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: CCOc1ccc(cc1OC)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 414.44
Empirical Formula: C20H18N2O6S

Physical State: Dry powder
Available Amount: 487 mg

Lipinsky:
logP: 4.319
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 126
Number of rings: 3

     

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