COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319500
Chemical Name: 3-hydroxy-6-methyl-2-{[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Smiles: COc1c(ccc(c1OC)OC)CN1CCN(CC1)Cc1oc(C)cc(=O)c1O

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Molecular Weight: 404.46
Empirical Formula: C21H28N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.104
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 80
Number of rings: 3

     

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