COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL427897
Chemical Name: (5E)-5-[3-(2,4-dinitrophenoxy)benzylidene]-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cccc(c2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C(=O)N1C

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Molecular Weight: 417.42
Empirical Formula: C17H11N3O6S2

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 2.921
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 178
Number of rings: 3

     

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