COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK770852
Chemical Name: 3-benzyl-1,5-dinitro-9-(2-oxo-2-phenylethyl)-3-azabicyclo[3.3.1]non-7-en-6-one
Smiles: O=C(c1ccccc1)CC1C2(C=CC(=O)C1(CN(C2)Cc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 435.44
Empirical Formula: C23H21N3O6

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 5.505
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 129
Number of rings: 4

     

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