COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK191774
Chemical Name: (5E)-5-(5-bromo-2-hydroxy-3-methoxybenzylidene)-1-(3-ethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cccc(c1)N1C(=S)NC(=O)/C(=C\c2cc(Br)cc(c2O)OC)/C1=O

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Molecular Weight: 477.34
Empirical Formula: C20H17BrN2O5S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.673
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 3

     

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