COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157482
Chemical Name: 2-nitro-5-{4-[(2-nitrophenyl)sulfonyl]piperazin-1-yl}-N-(tetrahydrofuran-2-ylmethyl)aniline
Smiles: [O-][N+](=O)c1ccc(cc1NCC1CCCO1)N1CCN(CC1)S(=O)(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 491.52
Empirical Formula: C21H25N5O7S

Physical State: Dry powder
Available Amount: 182 mg

Lipinsky:
logP: 3.852
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 161
Number of rings: 4

     

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