COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428036
Chemical Name: (5E)-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C/c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 412.49
Empirical Formula: C20H16N2O4S2

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 4.125
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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