COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK126736
Chemical Name: 2-(1,3-benzodioxol-5-yl)-N-(4-ethoxybenzyl)ethanamine
Smiles: CCOc1ccc(cc1)CNCCc1ccc2c(c1)OCO2

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Saltdata: C2H2O4
Molecular Weight: 299.37
Empirical Formula: C18H21NO3

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 3.885
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 39
Number of rings: 3

     

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