COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151589
Chemical Name: N-nitro-1-(2,2,2-trinitroethoxy)-N-[(2,2,2-trinitroethoxy)methyl]methanamine
Smiles: [O-][N+](=O)N(COCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])COCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 448.17
Empirical Formula: C6H8N8O16

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 14.344
Rotatable bonds: 6
H-donors: 0
H-acceptors: 16
PSA: 342
Number of rings: 0

     

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