COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491114
Chemical Name: 5-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-2-methyl-4H-pyran-4-one
Smiles: O=C(N1CCc2c(C1)cccc2)COc1coc(cc1=O)C

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Molecular Weight: 299.33
Empirical Formula: C17H17NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.092
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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