COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444640
Chemical Name: (5E)-5-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2cc(Br)c(c(c2)OCC)O)/C1=O

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Molecular Weight: 411.28
Empirical Formula: C16H15BrN2O4S

Physical State: Dry powder
Available Amount: 412 mg

Lipinsky:
logP: 3.299
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 110
Number of rings: 2

     

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