COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806212
Chemical Name: 2-(3-bromophenyl)-6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: Brc1cccc(c1)C1N2CC3(CN1CC(C2)(C3(C)C)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 411.26
Empirical Formula: C16H19BrN4O4

Physical State: Dry powder
Available Amount: 271 mg

Lipinsky:
logP: 6.22
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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