COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL335234
Chemical Name: di-tert-butyl4-hydroxy-4-methyl-6-oxo-2-[(E)-2-phenylethenyl]cyclohexane-1,3-dicarboxylate
Smiles: O=C(C1C(=O)CC(C(C1/C=C/c1ccccc1)C(=O)OC(C)(C)C)(C)O)OC(C)(C)C

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Molecular Weight: 430.54
Empirical Formula: C25H34O6

Physical State: Dry powder
Available Amount: 275 mg

Lipinsky:
logP: 5.623
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 89
Number of rings: 2

     

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