COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK831241
Chemical Name: 2-(3,4-dimethoxyphenyl)-6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: COc1cc(ccc1OC)C1N2CC3(CN1CC(C2)(C3(C)C)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 392.41
Empirical Formula: C18H24N4O6

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 5.185
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 116
Number of rings: 5

     

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