COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373562
Chemical Name: dimethyl4-hydroxy-2-(3-methoxy-4-propoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: CCCOc1ccc(cc1OC)C1C(C(=O)OC)C(=O)CC(C1C(=O)OC)(C)O

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Molecular Weight: 408.45
Empirical Formula: C21H28O8

Physical State: Dry powder
Available Amount: 336 mg

Lipinsky:
logP: 2.65
Rotatable bonds: 10
H-donors: 1
H-acceptors: 8
PSA: 108
Number of rings: 2

     

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