COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK247395
Chemical Name: 2-(4-nitrophenyl)-2-oxoethyl2-{[(2,4-dinitrophenyl)carbonyl]amino}benzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])COC(=O)c1ccccc1NC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 494.37
Empirical Formula: C22H14N4O10

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 4.547
Rotatable bonds: 5
H-donors: 1
H-acceptors: 10
PSA: 209
Number of rings: 3

     

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