COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK758484
Chemical Name: 4-bromo-2-(piperidin-1-ylcarbonothioyl)phenyl4-nitrobenzoate
Smiles: Brc1ccc(c(c1)C(=S)N1CCCCC1)OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 449.33
Empirical Formula: C19H17BrN2O4S

Physical State: Dry powder
Available Amount: 172 mg

Lipinsky:
logP: 4.213
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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