COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418498
Chemical Name: (5E)-5-[4-(2,4-dinitrophenoxy)-3-ethoxybenzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C\1/SC(=S)NC1=O

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Molecular Weight: 447.45
Empirical Formula: C18H13N3O7S2

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 2.1
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 196
Number of rings: 3

     

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