COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK784487
Chemical Name: 5-bromo-1'-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC(CO2)(Br)[N+](=O)[O-]

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Molecular Weight: 521.34
Empirical Formula: C22H22BrFN4O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.551
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 91
Number of rings: 5

     

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