COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158030
Chemical Name: 1-{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}ethanone
Smiles: CC(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[N+](=O)[O-]

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Molecular Weight: 380.45
Empirical Formula: C21H24N4O3

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 4.192
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 4

     

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