COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK128052
Chemical Name: 2-(benzylsulfonyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
Smiles: O=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])CS(=O)(=O)Cc1ccccc1

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Molecular Weight: 403.46
Empirical Formula: C19H21N3O5S

Physical State: Dry powder
Available Amount: 329 mg

Lipinsky:
logP: 2.49
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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