COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534903
Chemical Name: bis(2-methylpropyl)4-hydroxy-2-(3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: COc1cccc(c1)C1C(C(=O)OCC(C)C)C(=O)CC(C1C(=O)OCC(C)C)(C)O

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Molecular Weight: 434.53
Empirical Formula: C24H34O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.586
Rotatable bonds: 11
H-donors: 1
H-acceptors: 7
PSA: 99
Number of rings: 2

     

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