COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK601501
Chemical Name: 6,6-dimethyl-5,7-dinitro-2-[4-(propan-2-yl)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: [O-][N+](=O)C12CN3CC(C2(C)C)(CN(C1)C3c1ccc(cc1)C(C)C)[N+](=O)[O-]

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Molecular Weight: 374.44
Empirical Formula: C19H26N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.787
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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