COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK436544
Chemical Name: 4-ethyl-5-[(3-methyl-4-nitrophenoxy)methyl]-4H-1,2,4-triazole-3-thiol
Smiles: CCn1c(COc2ccc(c(c2)C)[N+](=O)[O-])nnc1S

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Molecular Weight: 294.33
Empirical Formula: C12H14N4O3S

Physical State: Dry powder
Available Amount: 173 mg

Lipinsky:
logP: 3.057
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 2

     

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