COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK128982
Chemical Name: 3-methyl-1-{4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}butan-1-one
Smiles: CC(CC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 319.36
Empirical Formula: C16H21N3O4

Physical State: Dry powder
Available Amount: 151 mg

Lipinsky:
logP: 1.103
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 86
Number of rings: 2

     

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