COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051569
Chemical Name: (5E)-5-(3-bromo-4-hydroxy-5-nitrobenzylidene)-3-(3-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Fc1cccc(c1)N1C(=S)S/C(=C/c2cc(Br)c(c(c2)[N+](=O)[O-])O)/C1=O

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Molecular Weight: 455.29
Empirical Formula: C16H8BrFN2O4S2

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 5.223
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 143
Number of rings: 3

     

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