COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK913401
Chemical Name: 2-oxo-7-phenyl-1,3-benzoxathiol-5-yl(2-nitrophenoxy)acetate
Smiles: O=C(Oc1cc2sc(=O)oc2c(c1)c1ccccc1)COc1ccccc1[N+](=O)[O-]

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Molecular Weight: 423.4
Empirical Formula: C21H13NO7S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.637
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 132
Number of rings: 4

     

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