COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK165659
Chemical Name: 3-methyl-4-(4-methylphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1C

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Molecular Weight: 340.41
Empirical Formula: C17H16N4O2S

Physical State: Dry powder
Available Amount: 73 mg

Lipinsky:
logP: 4.831
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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