COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK501392
Chemical Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-nitrobenzonitrile
Smiles: N#Cc1cc(ccc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

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Molecular Weight: 366.38
Empirical Formula: C19H18N4O4

Available Amount: 0 mg

Lipinsky:
logP: 2.834
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 94
Number of rings: 4

     

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