COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006765
Chemical Name: (5E)-5-{4-[3-(4-chlorophenoxy)propoxy]-3-ethoxy-5-nitrobenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(/C=C\2/SC(=S)NC2=O)cc(c1OCCCOc1ccc(cc1)Cl)[N+](=O)[O-]

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Molecular Weight: 494.98
Empirical Formula: C21H19ClN2O6S2

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 4.987
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 160
Number of rings: 3

     

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