COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL365341
Chemical Name: 4-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl2-nitrobenzenesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)Cc1ccccc1

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Molecular Weight: 542.61
Empirical Formula: C24H18N2O7S3

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 4.179
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 184
Number of rings: 4

     

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