COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428031
Chemical Name: (5E)-3-cyclohexyl-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/C(=O)N1C1CCCCC1

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Molecular Weight: 454.57
Empirical Formula: C23H22N2O4S2

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 5.319
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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