COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL408792
Chemical Name: 2-(azepan-1-ylmethyl)-5-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-4H-pyran-4-one
Smiles: O=C(N1CCc2c(C1)cccc2)COc1coc(cc1=O)CN1CCCCCC1

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Molecular Weight: 396.49
Empirical Formula: C23H28N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.741
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 4

     

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