COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418514
Chemical Name: (5E)-5-{3-ethoxy-4-[2-(4-nitrophenoxy)ethoxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1OCCOc1ccc(cc1)[N+](=O)[O-])/C=C\1/SC(=S)NC1=O

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Molecular Weight: 446.5
Empirical Formula: C20H18N2O6S2

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 3.677
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 160
Number of rings: 3

     

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