COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK200305
Chemical Name: 2-[(E)-{[4-(4-ethylpiperazin-1-yl)phenyl]imino}methyl]-4-nitrophenol
Smiles: CCN1CCN(CC1)c1ccc(cc1)/N=C/c1cc(ccc1O)[N+](=O)[O-]

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Saltdata: HCl
Molecular Weight: 354.41
Empirical Formula: C19H22N4O3

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 3.475
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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