COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780551
Chemical Name: (1R,2R,5S)-2-{4-ethyl-3-[(5-phenyl-2H-tetrazol-2-yl)methyl]-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: CCn1c(Cn2nnc(n2)c2ccccc2)nn(c1=S)[C@@H]1CC(=O)[C@@H]2O[C@H]1CO2

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Molecular Weight: 413.46
Empirical Formula: C18H19N7O3S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 0.158
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 130
Number of rings: 5

     

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