COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685658
Chemical Name: 1-({4-methyl-1-[(1R,2R,5S)-4-oxo-6,8-dioxabicyclo[3.2.1]oct-2-yl]-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)-4-phenylpyrrolidin-2-one(non-preferredname)
Smiles: O=C1CC(CN1Cc1nn(c(=S)n1C)[C@@H]1CC(=O)[C@@H]2O[C@H]1CO2)c1ccccc1

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Molecular Weight: 414.49
Empirical Formula: C20H22N4O4S

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: -0.465
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 106
Number of rings: 5

     

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