COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083868
Chemical Name: 5-{2-[2-(4-nitrophenoxy)ethoxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)C(=Cc2ccccc2OCCOc2ccc(cc2)[N+](=O)[O-])C(=O)N1

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Molecular Weight: 413.41
Empirical Formula: C19H15N3O6S

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 3.319
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 154
Number of rings: 3

     

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