COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK010921
Chemical Name: ethyl3-(1,3-benzodioxol-5-yl)-2-cyano-3-(2-methoxyphenyl)propanoate
Smiles: CCOC(=O)C(C(c1ccccc1OC)c1ccc2c(c1)OCO2)C#N

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Molecular Weight: 353.37
Empirical Formula: C20H19NO5

Physical State: Liquid
Available Amount: 490 mg

Lipinsky:
logP: 3.726
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 3

     

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