COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018986
Chemical Name: (5E)-5-{3-ethoxy-4-[3-(3-methylphenoxy)propoxy]-5-nitrobenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(/C=C\2/SC(=S)NC2=O)cc(c1OCCCOc1cccc(c1)C)[N+](=O)[O-]

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Molecular Weight: 474.56
Empirical Formula: C22H22N2O6S2

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.761
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 160
Number of rings: 3

     

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