COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272865
Chemical Name: 1-(4-bromophenyl)-2-[3-{[(4-methylphenyl)sulfanyl]methyl}-4-(prop-2-en-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]ethanone
Smiles: C=CCn1c(CSc2ccc(cc2)C)nn(c1=S)CC(=O)c1ccc(cc1)Br

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Molecular Weight: 474.45
Empirical Formula: C21H20BrN3OS2

Available Amount: 0 mg

Lipinsky:
logP: 4.329
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 93
Number of rings: 3

     

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