COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK697150
Chemical Name: 3-(4-tert-butylphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 444.56
Empirical Formula: C25H24N4O2S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 8.249
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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