COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK448354
Chemical Name: 4-(3,4-dimethoxyphenyl)-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(ccc1OC)n1c(nnc1S)COc1cccc(c1)C(F)(F)F

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Molecular Weight: 411.4
Empirical Formula: C18H16F3N3O3S

Physical State: Dry powder
Available Amount: 492 mg

Lipinsky:
logP: 5.157
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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