COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK055676
Chemical Name: 1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}butan-1-one
Smiles: CCCC(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[N+](=O)[O-]

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Molecular Weight: 332.4
Empirical Formula: C17H24N4O3

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 3.647
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 3

     

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