COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023982
Chemical Name: 2-[(Z)-2-{3-bromo-4-[(2-chlorobenzyl)oxy]phenyl}ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: Brc1cc(ccc1OCc1ccccc1Cl)/C=C\c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 478.69
Empirical Formula: C19H13BrClN3O5

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 3.317
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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