COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL240065
Chemical Name: dipropan-2-yl4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: COc1cc(ccc1O)C1C(C(=O)OC(C)C)C(=O)CC(C1C(=O)OC(C)C)(C)O

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Molecular Weight: 422.48
Empirical Formula: C22H30O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.577
Rotatable bonds: 10
H-donors: 2
H-acceptors: 8
PSA: 119
Number of rings: 2

     

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