COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK448299
Chemical Name: 5-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1c(C)cc(cc1C)OCc1nnc(n1CC1CCCO1)S

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Molecular Weight: 353.87
Empirical Formula: C16H20ClN3O2S

Physical State: Dry powder
Available Amount: 680 mg

Lipinsky:
logP: 3.782
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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