COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297457
Chemical Name: (6-nitro-1,4,8-triazabicyclo[4.3.1]decane-4,8-diyl)bis[(4-nitrophenyl)methanone]
Smiles: O=C(N1CCN2CC(C1)(CN(C2)C(=O)c1ccc(cc1)[N+](=O)[O-])[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 484.43
Empirical Formula: C21H20N6O8

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 1.632
Rotatable bonds: 0
H-donors: 0
H-acceptors: 8
PSA: 181
Number of rings: 4

     

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