COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194486
Chemical Name: 4-bromo-2-({4-[(4-nitrophenyl)sulfonyl]piperazin-1-yl}methyl)phenol
Smiles: Brc1ccc(c(c1)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])O

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Molecular Weight: 456.32
Empirical Formula: C17H18BrN3O5S

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 3.538
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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