COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035987
Chemical Name: 4-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenyl2-nitrobenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)Cc1ccccc1

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Molecular Weight: 556.64
Empirical Formula: C25H20N2O7S3

Physical State: Dry powder
Available Amount: 291 mg

Lipinsky:
logP: 4.71
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 184
Number of rings: 4

     

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