COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188027
Chemical Name: 5-{3-bromo-4-[(3-nitrobenzyl)oxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)C(=Cc2ccc(c(c2)Br)OCc2cccc(c2)[N+](=O)[O-])C(=O)N1

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Molecular Weight: 462.28
Empirical Formula: C18H12BrN3O5S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 3.705
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 145
Number of rings: 3

     

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