COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321715
Chemical Name: 4-methoxy-3-(3,4,5-trinitrophenyl)-1,2,5-oxadiazole2-oxide
Smiles: COc1no[n+](c1c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])[N+](=O)[O-])[O-]

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Molecular Weight: 327.17
Empirical Formula: C9H5N5O9

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 0.769
Rotatable bonds: 1
H-donors: 0
H-acceptors: 9
PSA: 198
Number of rings: 2

     

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