COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK969780
Chemical Name: 2-methyl-N-{(5E)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Smiles: S=C1S/C(=C/c2cc3OCOc3cc2[N+](=O)[O-])/C(=O)N1NC(=O)c1ccccc1C

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Molecular Weight: 443.46
Empirical Formula: C19H13N3O6S2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 4.434
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 171
Number of rings: 4

     

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