COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777023
Chemical Name: 1-{4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}-2-methylpropan-1-one
Smiles: O=C(N1CCN(CC1)c1cc(N2CCCCCC2)c(cc1[N+](=O)[O-])F)C(C)C

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Molecular Weight: 392.47
Empirical Formula: C20H29FN4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.18
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 3

     

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