COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006961
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc2c(c1)OCO2)\C

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Molecular Weight: 492.52
Empirical Formula: C22H20N8O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.273
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 180
Number of rings: 5

     

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