COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363196
Chemical Name: 7-(methylsulfanyl)-3-nitro[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(1H)-one
Smiles: CSc1nn2c(n1)[nH]nc(c2=O)[N+](=O)[O-]

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Molecular Weight: 228.19
Empirical Formula: C5H4N6O3S

Physical State: Liquid
Available Amount: 2 mg

Lipinsky:
logP: -0.32
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 2

     

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