COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059270
Chemical Name: 2-(1,3-benzodioxol-5-yl)-6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: [O-][N+](=O)C12CN3CC(C2(C)C)(CN(C1)C3c1ccc2c(c1)OCO2)[N+](=O)[O-]

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Molecular Weight: 376.37
Empirical Formula: C17H20N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.31
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 116
Number of rings: 6

     

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