COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574132
Chemical Name: 1-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-3,3-dimethylbutan-2-one
Smiles: CCn1c(nnc1SCC(=O)C(C)(C)C)COc1ccc(cc1)C

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Molecular Weight: 347.48
Empirical Formula: C18H25N3O2S

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 4.278
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 2

     

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