COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL002115
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(4-cyanophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: N#Cc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/C

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Molecular Weight: 457.41
Empirical Formula: C21H15N9O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.796
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 179
Number of rings: 5

     

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