COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418497
Chemical Name: (5E)-5-[3-(2,4-dinitrophenoxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1NC(=O)/C(=C\c2cccc(c2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/S1

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Molecular Weight: 403.4
Empirical Formula: C16H9N3O6S2

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 2.798
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 187
Number of rings: 3

     

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