COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805018
Chemical Name: 4-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)phenol
Smiles: CC1(C)C2(CN3CC1(CN(C2)[C@@H]3c1ccc(cc1)O)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 348.36
Empirical Formula: C16H20N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.712
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 118
Number of rings: 5

     

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