COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194468
Chemical Name: 1-(3-bromobenzyl)-4-[(2-nitrophenyl)sulfonyl]piperazine
Smiles: Brc1cccc(c1)CN1CCN(CC1)S(=O)(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 440.32
Empirical Formula: C17H18BrN3O4S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 3.853
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 94
Number of rings: 3

     

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