COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388901
Chemical Name: {benzene-1,4-diylbis[oxy(3-nitrobenzene-4,1-diyl)]}bis[(4-nitrophenyl)methanone]
Smiles: [O-][N+](=O)c1cc(ccc1Oc1ccc(cc1)Oc1ccc(cc1[N+](=O)[O-])C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 650.51
Empirical Formula: C32H18N4O12

Physical State: Dry powder
Available Amount: 233 mg

Lipinsky:
logP: 7.462
Rotatable bonds: 4
H-donors: 0
H-acceptors: 12
PSA: 235
Number of rings: 5

     

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