COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK218958
Chemical Name: 2-({5-[(2,6-dimethylphenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Smiles: CCn1c(SCC(=O)c2ccccc2)nnc1COc1c(C)cccc1C

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Molecular Weight: 381.5
Empirical Formula: C21H23N3O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 5.222
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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