COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379656
Chemical Name: (5E)-3-(1,3-benzodioxol-5-yl)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cccc(c2)[N+](=O)[O-])/C(=O)N1c1ccc2c(c1)OCO2

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Molecular Weight: 386.41
Empirical Formula: C17H10N2O5S2

Physical State: Dry powder
Available Amount: 875 mg

Lipinsky:
logP: 4.219
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 141
Number of rings: 4

     

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