COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055983
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-N'-[(2E)-4-phenylbutan-2-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)/CCc1ccccc1

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Molecular Weight: 461.44
Empirical Formula: C21H19N9O4

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 1.337
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 182
Number of rings: 4

     

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