COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK060411
Chemical Name: (5-bromo-4-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)aceticacid
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2cc(OC)c(cc2Br)OCC(=O)O)/C1=O

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Molecular Weight: 455.29
Empirical Formula: C17H15BrN2O6S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.556
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 137
Number of rings: 2

     

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