COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531317
Chemical Name: 1-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)butane-1,2,3,4-tetrol
Smiles: OCC(C(C(C1N2CC3(CN1CC(C2)(C3(C)C)[N+](=O)[O-])[N+](=O)[O-])O)O)O

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Molecular Weight: 376.37
Empirical Formula: C14H24N4O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.963
Rotatable bonds: 8
H-donors: 4
H-acceptors: 8
PSA: 179
Number of rings: 4

     

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