COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780292
Chemical Name: (1S,2S,5R)-2-{4-methyl-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: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(n(c1=S)C)Cn1nnc(n1)c1ccccc1

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Molecular Weight: 399.43
Empirical Formula: C17H17N7O3S

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: -0.373
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 130
Number of rings: 5

     

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