COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK292814
Chemical Name: methyl{2-bromo-4-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]-6-methoxyphenoxy}acetate
Smiles: COC(=O)COc1c(Br)cc(cc1OC)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 456.21
Empirical Formula: C16H14BrN3O8

Physical State: Dry powder
Available Amount: 545 mg

Lipinsky:
logP: 0.344
Rotatable bonds: 8
H-donors: 2
H-acceptors: 8
PSA: 152
Number of rings: 2

     

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