COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079673
Chemical Name: 4-bromo-2-(pyrrolidin-1-ylcarbonothioyl)phenyl2-nitrobenzoate
Smiles: Brc1ccc(c(c1)C(=S)N1CCCC1)OC(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 435.3
Empirical Formula: C18H15BrN2O4S

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 3.185
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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