COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK722549
Chemical Name: 4-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)benzene-1,2-diol
Smiles: [O-][N+](=O)C12CN3CC(C2(C)C)(CN(C1)C3c1ccc(c(c1)O)O)[N+](=O)[O-]

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Molecular Weight: 364.36
Empirical Formula: C16H20N4O6

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 4.11
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 138
Number of rings: 5

     

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