COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396894
Chemical Name: diethyl2-(4-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OCC)C(=O)CC(C1C(=O)OCC)(C)O

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Molecular Weight: 392.45
Empirical Formula: C21H28O7

Physical State: Dry powder
Available Amount: 378 mg

Lipinsky:
logP: 3.36
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 99
Number of rings: 2

     

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