COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416526
Chemical Name: 4-{(E)-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenylbenzenesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)c1ccccc1)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)C

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Molecular Weight: 511.64
Empirical Formula: C25H21NO5S3

Physical State: Dry powder
Available Amount: 167 mg

Lipinsky:
logP: 5.843
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 138
Number of rings: 4

     

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