COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK190220
Chemical Name: ethyl(2-bromo-4-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetate
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2ccc(c(c2)Br)OCC(=O)OCC)/C1=O

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Molecular Weight: 453.31
Empirical Formula: C18H17BrN2O5S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 2.755
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 2

     

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