COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL296886
Chemical Name: (5Z)-3-(2-chlorobenzyl)-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-1,3-thiazolidine-2,4-dione
Smiles: COc1cc(/C=C/2\SC(=O)N(C2=O)Cc2ccccc2Cl)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 420.83
Empirical Formula: C18H13ClN2O6S

Physical State: Dry powder
Available Amount: 619 mg

Lipinsky:
logP: 4.756
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 137
Number of rings: 3

     

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