COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358712
Chemical Name: 2-[(E)-2-(3-chloro-4-hydroxy-5-methoxyphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: COc1cc(/C=C/c2nc(O)c(c(=O)[nH]2)[N+](=O)[O-])cc(c1O)Cl

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Molecular Weight: 339.69
Empirical Formula: C13H10ClN3O6

Physical State: Dry powder
Available Amount: 649 mg

Lipinsky:
logP: 0.515
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 136
Number of rings: 2

     

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