COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367292
Chemical Name: 6-{(E)-2-[3-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Smiles: C#CCOc1c(Br)cc(cc1OCC)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

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Molecular Weight: 436.22
Empirical Formula: C17H14BrN3O6

Physical State: Dry powder
Available Amount: 456 mg

Lipinsky:
logP: 2.009
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 2

     

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