COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK225845
Chemical Name: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-nitrophenoxy)ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)COc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 312.33
Empirical Formula: C17H16N2O4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.893
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 75
Number of rings: 3

     

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