COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK950610
Chemical Name: 3-[(Z)-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-ONN-azoxy]-4-[(E)-{4-[(Z)-(2,2-dimethyl-5-nitro-1,3-dioxan-5-yl)-ONN-azoxy]-1,2,5-oxadiazol-3-yl}-NNO-azoxy]-1,2,5-oxadiazole
Smiles: [O-]/[N+](=N/c1nonc1/N=[N+](/C1(COC(OC1)(C)C)[N+](=O)[O-])\[O-])/c1nonc1/N=[N+](/C1(COC(OC1)(C)C)[N+](=O)[O-])\[O-]

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Molecular Weight: 588.41
Empirical Formula: C16H20N12O13

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 4.758
Rotatable bonds: 2
H-donors: 0
H-acceptors: 13
PSA: 329
Number of rings: 4

     

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