COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK931242
Chemical Name: 2-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-5-hydroxy-4H-pyran-4-one
Smiles: Oc1coc(cc1=O)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

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Saltdata: HCl
Molecular Weight: 344.37
Empirical Formula: C18H20N2O5

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 1.255
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 71
Number of rings: 4

     

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