COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK603579
Chemical Name: {2-bromo-4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-6-methoxyphenoxy}aceticacid
Smiles: COc1cc(/C=C/c2nc(O)nc(c2[N+](=O)[O-])O)cc(c1OCC(=O)O)Br

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Molecular Weight: 442.18
Empirical Formula: C15H12BrN3O8

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 0.648
Rotatable bonds: 9
H-donors: 3
H-acceptors: 8
PSA: 167
Number of rings: 2

     

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