COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357874
Chemical Name: (5E)-5-(4-hydroxy-3-iodo-5-methoxybenzylidene)-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(/C=C\2/SC(=O)N(C2=O)Cc2ccccc2[N+](=O)[O-])cc(c1O)I

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Molecular Weight: 512.28
Empirical Formula: C18H13IN2O6S

Physical State: Dry powder
Available Amount: 1146 mg

Lipinsky:
logP: 4.139
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 137
Number of rings: 3

     

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