COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL480764
Chemical Name: 5-(methylsulfanyl)-4-phenyl-2-[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxyhexopyranosyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Smiles: CSc1nn(c(=O)n1c1ccccc1)C1OC(COC(=O)C)C(C(C1NC(=O)C)OC(=O)C)OC(=O)C

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Molecular Weight: 536.56
Empirical Formula: C23H28N4O9S

Physical State: Dry powder
Available Amount: 39 mg

Lipinsky:
logP: 1.044
Rotatable bonds: 10
H-donors: 1
H-acceptors: 9
PSA: 178
Number of rings: 3

     

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