COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL289919
Chemical Name: 1,4-diethyl-2,3,5-trinitrobenzene
Smiles: CCc1c(cc(c(c1[N+](=O)[O-])[N+](=O)[O-])CC)[N+](=O)[O-]

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Molecular Weight: 269.21
Empirical Formula: C10H11N3O6

Physical State: Dry powder
Available Amount: 3000 mg

Lipinsky:
logP: 3.176
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 137
Number of rings: 1

     

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