COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL102512
Chemical Name: (2E)-5-(2-nitrobenzyl)-2-[(2E)-(3-nitrobenzylidene)hydrazinylidene]-1,3-thiazolidin-4-one
Smiles: O=C1N/C(=N\N=C\c2cccc(c2)[N+](=O)[O-])/SC1Cc1ccccc1[N+](=O)[O-]

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Molecular Weight: 399.39
Empirical Formula: C17H13N5O5S

Physical State: Dry powder
Available Amount: 28 mg

Lipinsky:
logP: 3.967
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 170
Number of rings: 3

     

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