COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194132
Chemical Name: 3-cyclopentyl-1-[4-(4-nitrobenzyl)piperazin-1-yl]propan-1-one
Smiles: O=C(N1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-])CCC1CCCC1

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Saltdata: C2H2O4
Molecular Weight: 345.44
Empirical Formula: C19H27N3O3

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 3.444
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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