COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL328581
Chemical Name: 2,4-diacetyl-3-(3,4-dimethoxyphenyl)-5-hydroxy-5-methylcyclohexanone
Smiles: COc1cc(ccc1OC)C1C(C(=O)C)C(=O)CC(C1C(=O)C)(C)O

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Molecular Weight: 348.4
Empirical Formula: C19H24O6

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 1.795
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 89
Number of rings: 2

     

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