COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK439800
Chemical Name: ethyl2-(3-methyl-4-nitrophenoxy)butanoate
Smiles: CCOC(=O)C(Oc1ccc(c(c1)C)[N+](=O)[O-])CC

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Molecular Weight: 267.28
Empirical Formula: C13H17NO5

Physical State: Liquid
Available Amount: 1098 mg

Lipinsky:
logP: 3.176
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 1

     

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