COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542634
Chemical Name: bis(2-methylpropyl)4-hydroxy-4-methyl-6-oxo-2-(pyridin-3-yl)cyclohexane-1,3-dicarboxylate
Smiles: CC(COC(=O)C1C(=O)CC(C(C1c1cccnc1)C(=O)OCC(C)C)(C)O)C

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Molecular Weight: 405.49
Empirical Formula: C22H31NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.179
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 102
Number of rings: 2

     

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