COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779930
Chemical Name: (1R,2R,5S)-2-{4-methyl-3-[(2-methyl-5-nitro-1H-imidazol-1-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)Cn1c(C)ncc1[N+](=O)[O-]

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Molecular Weight: 380.38
Empirical Formula: C14H16N6O5S

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: -1.468
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 150
Number of rings: 4

     

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