COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367261
Chemical Name: 6-[(E)-2-{4-[(4-chlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)phenyl}ethenyl]-5-nitropyrimidine-2,4-diol
Smiles: CCOc1cc(/C=C/c2nc(O)nc(c2[N+](=O)[O-])O)cc(c1OCc1ccc(cc1)Cl)CC=C

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Molecular Weight: 483.91
Empirical Formula: C24H22ClN3O6

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 4.487
Rotatable bonds: 10
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 3

     

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