COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL061936
Chemical Name: 4-ethyl-3-[(4-methylphenoxy)methyl]-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: CCn1c(nnc1COc1ccc(cc1)C)SCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 384.46
Empirical Formula: C19H20N4O3S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 4.79
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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