COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK764442
Chemical Name: 1-{4-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]piperazin-1-yl}butan-1-one
Smiles: CCCC(=O)N1CCN(CC1)c1cc(N2CCC(CC2)C)c(cc1[N+](=O)[O-])F

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Molecular Weight: 392.47
Empirical Formula: C20H29FN4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.291
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 3

     

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