COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148874
Chemical Name: 2-{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[N+](=O)[O-]

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Molecular Weight: 382.46
Empirical Formula: C21H26N4O3

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 4.798
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 75
Number of rings: 4

     

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