COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067867
Chemical Name: 2-ethoxy-4-[(E)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl4-methylbenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)/C=C\1/SC(=S)N(C1=O)CC

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Molecular Weight: 463.6
Empirical Formula: C21H21NO5S3

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 3.857
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 138
Number of rings: 3

     

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