COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023994
Chemical Name: 6-hydroxy-2-{(E)-2-[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]ethenyl}-5-nitropyrimidin-4(3H)-one
Smiles: C=CCc1cc(/C=C/c2nc(O)c(c(=O)[nH]2)[N+](=O)[O-])cc(c1O)OC

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Molecular Weight: 345.31
Empirical Formula: C16H15N3O6

Physical State: Dry powder
Available Amount: 740 mg

Lipinsky:
logP: 0.735
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 136
Number of rings: 2

     

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