COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK010002
Chemical Name: 2-nitro-N-(1-phenylethyl)-5-[4-(phenylsulfonyl)piperazin-1-yl]aniline
Smiles: CC(c1ccccc1)Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccccc1

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Molecular Weight: 466.56
Empirical Formula: C24H26N4O4S

Physical State: Dry powder
Available Amount: 348 mg

Lipinsky:
logP: 5.886
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 4

     

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