COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL433530
Chemical Name: diethyl[1-(7-methoxy-1,3-benzodioxol-5-yl)-2-nitroethyl]propanedioate
Smiles: CCOC(=O)C(C(c1cc(OC)c2c(c1)OCO2)C[N+](=O)[O-])C(=O)OCC

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Molecular Weight: 383.36
Empirical Formula: C17H21NO9

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.456
Rotatable bonds: 10
H-donors: 0
H-acceptors: 9
PSA: 126
Number of rings: 2

     

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