COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367364
Chemical Name: 6-[(E)-2-{4-[(4-bromobenzyl)oxy]-3-ethoxyphenyl}ethenyl]-5-nitropyrimidine-2,4-diol
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Br)/C=C/c1nc(O)nc(c1[N+](=O)[O-])O

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Molecular Weight: 488.29
Empirical Formula: C21H18BrN3O6

Physical State: Dry powder
Available Amount: 21 mg

Lipinsky:
logP: 3.646
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 3

     

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