COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375648
Chemical Name: 4-(3,4-dimethylphenyl)-3-[(4-nitrobenzyl)sulfanyl]-5-phenyl-4H-1,2,4-triazole
Smiles: [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1c1ccc(c(c1)C)C)c1ccccc1

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Molecular Weight: 416.5
Empirical Formula: C23H20N4O2S

Physical State: Dry powder
Available Amount: 917 mg

Lipinsky:
logP: 7.481
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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