COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358752
Chemical Name: 2-[(E)-2-{3-[(2-chloro-6-fluorobenzyl)oxy]-4-methoxyphenyl}ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: COc1ccc(cc1OCc1c(F)cccc1Cl)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 447.81
Empirical Formula: C20H15ClFN3O6

Physical State: Dry powder
Available Amount: 449 mg

Lipinsky:
logP: 2.177
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 125
Number of rings: 3

     

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