COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032761
Chemical Name: 4-[(E)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl2-nitrobenzenesulfonate
Smiles: CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OS(=O)(=O)c2ccccc2[N+](=O)[O-])/C1=O

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Molecular Weight: 480.54
Empirical Formula: C19H16N2O7S3

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 2.88
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 184
Number of rings: 3

     

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