COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406271
Chemical Name: 1-(1,3-dinitropropan-2-yl)-2-ethyl-3,4-dimethoxybenzene
Smiles: CCc1c(ccc(c1OC)OC)C(C[N+](=O)[O-])C[N+](=O)[O-]

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Molecular Weight: 298.3
Empirical Formula: C13H18N2O6

Physical State: Dry powder
Available Amount: 2629 mg

Lipinsky:
logP: 3.014
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 110
Number of rings: 1

     

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