COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148647
Chemical Name: 5-[4-(methylsulfonyl)piperazin-1-yl]-2-nitro-N-[4-(propan-2-yl)benzyl]aniline
Smiles: [O-][N+](=O)c1ccc(cc1NCc1ccc(cc1)C(C)C)N1CCN(CC1)S(=O)(=O)C

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Molecular Weight: 432.54
Empirical Formula: C21H28N4O4S

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 5.19
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 3

     

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