COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL454683
Chemical Name: 1,1-dioxidotetrahydrothiene-3,4-diylbis(3-nitrobenzenesulfonate)
Smiles: [O-][N+](=O)c1cccc(c1)S(=O)(=O)OC1CS(=O)(=O)CC1OS(=O)(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 522.49
Empirical Formula: C16H14N2O12S3

Available Amount: 0 mg

Lipinsky:
logP: 1.143
Rotatable bonds: 6
H-donors: 0
H-acceptors: 12
PSA: 237
Number of rings: 3

     

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