COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417275
Chemical Name: 5-{3-methoxy-2-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cccc(c1OCc1ccc(cc1)[N+](=O)[O-])C=C1C(=O)NC(=S)NC1=O

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Molecular Weight: 413.41
Empirical Formula: C19H15N3O6S

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 3.014
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 154
Number of rings: 3

     

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