COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL102738
Chemical Name: 1-(1,3-benzodioxol-5-yl)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanone
Smiles: O=C(c1ccc2c(c1)OCO2)CN1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 382.42
Empirical Formula: C21H22N2O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.982
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 60
Number of rings: 5

     

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