COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK421857
Chemical Name: 5-(3,4-diethoxybenzyl)-4-(2-ethylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1cc(ccc1OCC)Cc1nnc(n1c1ccccc1CC)S

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Molecular Weight: 383.51
Empirical Formula: C21H25N3O2S

Physical State: Dry powder
Available Amount: 265 mg

Lipinsky:
logP: 6.309
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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