COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL026823
Chemical Name: 2-[(E)-2-{2-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: COc1cccc(c1OCc1ccc(cc1)Cl)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 429.82
Empirical Formula: C20H16ClN3O6

Available Amount: 0 mg

Lipinsky:
logP: 2.626
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 125
Number of rings: 3

     

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