COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297796
Chemical Name: 6-chloro-2-oxo-1,3-benzoxathiol-5-yl4-nitrobenzenesulfonate
Smiles: O=c1oc2c(s1)cc(c(c2)Cl)OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 387.78
Empirical Formula: C13H6ClNO7S2

Physical State: Dry powder
Available Amount: 213 mg

Lipinsky:
logP: 4.063
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 149
Number of rings: 3

     

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