COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525288
Chemical Name: 2,2-bis(3,5-di-tert-butyl-4-hydroxybenzyl)-5,5-dimethylcyclohexane-1,3-dione
Smiles: CC(c1cc(CC2(Cc3cc(c(c(c3)C(C)(C)C)O)C(C)(C)C)C(=O)CC(CC2=O)(C)C)cc(c1O)C(C)(C)C)(C)C

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Molecular Weight: 576.86
Empirical Formula: C38H56O4

Physical State: Dry powder
Available Amount: 275 mg

Lipinsky:
logP: 9.878
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 74
Number of rings: 3

     

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