COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL328518
Chemical Name: 2,4-diacetyl-5-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-5-methylcyclohexanone
Smiles: COc1cc(ccc1O)C1C(C(=O)C)C(=O)CC(C1C(=O)C)(C)O

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Molecular Weight: 334.37
Empirical Formula: C18H22O6

Physical State: Dry powder
Available Amount: 205 mg

Lipinsky:
logP: 1.027
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 100
Number of rings: 2

     

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