COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444534
Chemical Name: diethyl2-[4-(benzyloxy)-3-methoxyphenyl]-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: CCOC(=O)C1C(=O)CC(C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)OCC)(C)O

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Molecular Weight: 484.55
Empirical Formula: C27H32O8

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 4.306
Rotatable bonds: 11
H-donors: 1
H-acceptors: 8
PSA: 108
Number of rings: 3

     

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