COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK136463
Chemical Name: piperazine-1,4-diylbis{[4-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]methanone}
Smiles: O=C(c1ccc(cc1)C#CC(O)(C)C)N1CCN(CC1)C(=O)c1ccc(cc1)C#CC(O)(C)C

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Molecular Weight: 458.56
Empirical Formula: C28H30N2O4

Physical State: Dry powder
Available Amount: 149 mg

Lipinsky:
logP: 2.046
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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