COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319630
Chemical Name: 2-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-5-(3,3-dimethyl-2-oxobutoxy)-4H-pyran-4-one
Smiles: O=C(C(C)(C)C)COc1coc(cc1=O)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 442.51
Empirical Formula: C24H30N2O6

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.125
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 77
Number of rings: 4

     

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