COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357914
Chemical Name: (5E)-5-(2-chloro-5-nitrobenzylidene)-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C/c2cc(ccc2Cl)[N+](=O)[O-])/C(=O)N1Cc1ccccc1[N+](=O)[O-]

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Molecular Weight: 419.8
Empirical Formula: C17H10ClN3O6S

Physical State: Dry powder
Available Amount: 880 mg

Lipinsky:
logP: 4.296
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 154
Number of rings: 3

     

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