COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK347240
Chemical Name: 3-methyl-1-{4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}butan-1-one
Smiles: CC(CC(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[N+](=O)[O-])C

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Molecular Weight: 374.48
Empirical Formula: C20H30N4O3

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 4.85
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 3

     

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