COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152693
Chemical Name: (5E)-3-(3-nitrobenzyl)-5-{2-[(3-nitrobenzyl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C/c2ccccc2OCc2cccc(c2)[N+](=O)[O-])/C(=O)N1Cc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 491.48
Empirical Formula: C24H17N3O7S

Physical State: Dry powder
Available Amount: 497 mg

Lipinsky:
logP: 5.352
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 163
Number of rings: 4

     

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