COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK171963
Chemical Name: 5-[4-(benzylsulfonyl)piperazin-1-yl]-N-methyl-2-nitroaniline
Smiles: CNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)Cc1ccccc1

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Molecular Weight: 390.46
Empirical Formula: C18H22N4O4S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 4.094
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 3

     

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