COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358780
Chemical Name: 2-[(E)-2-(3-ethoxyphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: CCOc1cccc(c1)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 303.27
Empirical Formula: C14H13N3O5

Physical State: Dry powder
Available Amount: 698 mg

Lipinsky:
logP: 0.995
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 116
Number of rings: 2

     

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