COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418906
Chemical Name: 2-methoxy-4-{(E)-[3-(4-nitrophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenylmethanesulfonate
Smiles: COc1cc(ccc1OS(=O)(=O)C)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 466.52
Empirical Formula: C18H14N2O7S3

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 2.843
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 184
Number of rings: 3

     

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