COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492341
Chemical Name: 2,2'-[(5-nitrofuran-2-yl)methanediyl]bis(5,5-dimethylcyclohexane-1,3-dione)
Smiles: O=C1CC(C)(C)CC(=O)C1C(C1C(=O)CC(CC1=O)(C)C)c1ccc(o1)[N+](=O)[O-]

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Molecular Weight: 403.43
Empirical Formula: C21H25NO7

Physical State: Dry powder
Available Amount: 193 mg

Lipinsky:
logP: 1.557
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 127
Number of rings: 3

     

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