COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416602
Chemical Name: 2-[(E)-2-{3-ethoxy-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]phenyl}ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: CCOc1cc(ccc1OCC(=O)N1CCCC1)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 430.42
Empirical Formula: C20H22N4O7

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 0.226
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 146
Number of rings: 3

     

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