COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388568
Chemical Name: 2-acetylbenzene-1,4-diylbis(3-nitrobenzoate)
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc(c(c1)C(=O)C)OC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 450.36
Empirical Formula: C22H14N2O9

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 4.381
Rotatable bonds: 7
H-donors: 0
H-acceptors: 9
PSA: 161
Number of rings: 3

     

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