COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038674
Chemical Name: (5Z)-6-hydroxy-5-{4-[(4-nitrobenzyl)oxy]benzylidene}-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2ccc(cc2)OCc2ccc(cc2)[N+](=O)[O-])/C(=N1)O

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Molecular Weight: 383.38
Empirical Formula: C18H13N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.528
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 3

     

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