COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051053
Chemical Name: 3-(3-methoxyphenyl)-4-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccc(c1)OC

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Molecular Weight: 448.5
Empirical Formula: C23H20N4O4S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 6.641
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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