COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL182771
Chemical Name: 2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: COc1cc([N+](=O)[O-])c(cc1OC)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 364.27
Empirical Formula: C14H12N4O8

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 0.336
Rotatable bonds: 5
H-donors: 2
H-acceptors: 8
PSA: 171
Number of rings: 2

     

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