COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL479443
Chemical Name: 2-({4-ethyl-5-[(phenylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-nitrophenyl)ethanone
Smiles: CCn1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nnc1CSc1ccccc1

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Molecular Weight: 414.51
Empirical Formula: C19H18N4O3S2

Available Amount: 0 mg

Lipinsky:
logP: 4.627
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 144
Number of rings: 3

     

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