COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333925
Chemical Name: 2-[(2-nitrophenyl)acetyl]cyclohexane-1,3-dione
Smiles: O=C(C1C(=O)CCCC1=O)Cc1ccccc1[N+](=O)[O-]

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Molecular Weight: 275.26
Empirical Formula: C14H13NO5

Available Amount: 0 mg

Lipinsky:
logP: 0.755
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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