COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358165
Chemical Name: (5E)-5-(3-chloro-4-hydroxy-5-methoxybenzylidene)-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(/C=C\2/SC(=O)N(C2=O)Cc2ccc(cc2)[N+](=O)[O-])cc(c1O)Cl

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Molecular Weight: 420.83
Empirical Formula: C18H13ClN2O6S

Physical State: Dry powder
Available Amount: 1056 mg

Lipinsky:
logP: 3.988
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 137
Number of rings: 3

     

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