COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051755
Chemical Name: 8-{[benzyl(methyl)ammonio]methyl}-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1occ(c2=O)c1ccc2c(c1)OCCO2)Cc1ccccc1

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Molecular Weight: 429.47
Empirical Formula: C26H23NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.401
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 5

     

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