COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683577
Chemical Name: 3,3-dimethyl-4-nitro-5-(4-nitrophenyl)cyclohexanone
Smiles: O=C1CC(c2ccc(cc2)[N+](=O)[O-])C(C(C1)(C)C)[N+](=O)[O-]

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Molecular Weight: 292.29
Empirical Formula: C14H16N2O5

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 2.633
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 108
Number of rings: 2

     

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