COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK998949
Chemical Name: 2-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(piperidin-1-yl)naphthalene-1,4-dione
Smiles: O=C1C(=C(N2CCCCC2)C(=O)c2c1cccc2)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

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Molecular Weight: 445.6
Empirical Formula: C29H35NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.638
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 57
Number of rings: 4

     

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