COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172006
Chemical Name: N-(2,2-dimethylpropyl)-2-nitro-5-[4-(phenylsulfonyl)piperazin-1-yl]aniline
Smiles: [O-][N+](=O)c1ccc(cc1NCC(C)(C)C)N1CCN(CC1)S(=O)(=O)c1ccccc1

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Molecular Weight: 432.54
Empirical Formula: C21H28N4O4S

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 5.764
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 3

     

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