COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009457
Chemical Name: (5E)-5-{2-[2-(2-methylphenoxy)ethoxy]-5-nitrobenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1NC(=O)/C(=C\c2cc(ccc2OCCOc2ccccc2C)[N+](=O)[O-])/S1

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Molecular Weight: 416.48
Empirical Formula: C19H16N2O5S2

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 3.955
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 150
Number of rings: 3

     

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