COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL317696
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc3c(c2)OCO3)c2nonc2N)ccc1OC

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Molecular Weight: 478.42
Empirical Formula: C21H18N8O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.583
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 174
Number of rings: 5

     

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