COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416444
Chemical Name: (5Z)-3-(furan-2-ylmethyl)-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)Cc2ccco2)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 392.41
Empirical Formula: C16H12N2O6S2

Physical State: Dry powder
Available Amount: 191 mg

Lipinsky:
logP: 2.79
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 166
Number of rings: 3

     

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