COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671049
Chemical Name: (2Z,5Z)-2-[(2E)-benzylidenehydrazinylidene]-5-(2-hydroxy-3,5-dinitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: O=C1N/C(=N/N=C/c2ccccc2)/S/C/1=C\c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 413.37
Empirical Formula: C17H11N5O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.63
Rotatable bonds: 2
H-donors: 2
H-acceptors: 6
PSA: 190
Number of rings: 3

     

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