COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL281813
Chemical Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-2-(pyridin-2-yl)pyridiniumbromide
Smiles: O=C(c1ccc2c(c1)OCCO2)C[n+]1ccccc1c1ccccn1.[Br-]

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Molecular Weight: 413.27
Empirical Formula: C20H17BrN2O3

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 52
Number of rings: 4

     

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