COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK089920
Chemical Name: 2-{4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1ccc(cc1C(F)(F)F)[N+](=O)[O-]

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Molecular Weight: 319.28
Empirical Formula: C13H16F3N3O3

Physical State: Dry powder
Available Amount: 444 mg

Lipinsky:
logP: 3.376
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 72
Number of rings: 2

     

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