COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051462
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-nitrophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Nc1nonc1n1nnc(c1c1ccc(cc1)[N+](=O)[O-])C(=O)N/N=C/c1c(Cl)cccc1[N+](=O)[O-]

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Molecular Weight: 498.8
Empirical Formula: C18H11ClN10O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.361
Rotatable bonds: 3
H-donors: 3
H-acceptors: 6
PSA: 228
Number of rings: 4

     

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