COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK324732
Chemical Name: 2-(1,3-benzodioxol-5-yl)-N-(4-ethoxybenzyl)-N-(4-nitrobenzyl)ethanamine
Smiles: CCOc1ccc(cc1)CN(Cc1ccc(cc1)[N+](=O)[O-])CCc1ccc2c(c1)OCO2

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Molecular Weight: 434.49
Empirical Formula: C25H26N2O5

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 6.02
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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