COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067482
Chemical Name: 3-ethoxy-1-(3-nitrophenyl)-3-oxopropyl4-nitrobenzoate
Smiles: CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 388.33
Empirical Formula: C18H16N2O8

Physical State: Dry powder
Available Amount: 254 mg

Lipinsky:
logP: 4.076
Rotatable bonds: 7
H-donors: 0
H-acceptors: 8
PSA: 144
Number of rings: 2

     

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