COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL308491
Chemical Name: 4-({3-bromo-4-[(4-fluorobenzyl)oxy]-5-methoxybenzyl}amino)-5-methyl-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(CNn2c(C)nnc2S)cc(c1OCc1ccc(cc1)F)Br

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Molecular Weight: 453.34
Empirical Formula: C18H18BrFN4O2S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.285
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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