COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080163
Chemical Name: (5Z)-3-methyl-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2cc3OCOc3cc2[N+](=O)[O-])/C(=O)N1C

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Molecular Weight: 324.34
Empirical Formula: C12H8N2O5S2

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 1.949
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 141
Number of rings: 3

     

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