COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK974403
Chemical Name: 3-[(4-butoxy-3-nitrobenzyl)sulfanyl]-5-(2-ethoxyphenyl)-4H-1,2,4-triazole
Smiles: CCCCOc1ccc(cc1[N+](=O)[O-])CSc1nnc([nH]1)c1ccccc1OCC

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Molecular Weight: 428.51
Empirical Formula: C21H24N4O4S

Available Amount: 0 mg

Lipinsky:
logP: 5.888
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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