COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194869
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-nitrobenzyl)piperazine
Smiles: [O-][N+](=O)c1ccccc1CN1CCN(CC1)Cc1ccc2c(c1)OCO2

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Saltdata: C2H2O4
Molecular Weight: 355.39
Empirical Formula: C19H21N3O4

Physical State: Dry powder
Available Amount: 164 mg

Lipinsky:
logP: 2.044
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 70
Number of rings: 4

     

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