COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037929
Chemical Name: 5-{[4,6-dihydroxy-1-(prop-2-en-1-yl)-2-thioxo-1,2-dihydropyrimidin-5-yl](4-methylphenyl)methyl}-6-hydroxy-3-(prop-2-en-1-yl)-2-sulfanylpyrimidin-4(3H)-one
Smiles: C=CCn1c(=S)nc(c(c1O)C(c1c(O)nc(n(c1=O)CC=C)S)c1ccc(cc1)C)O

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Molecular Weight: 470.57
Empirical Formula: C22H22N4O4S2

Physical State: Dry powder
Available Amount: 233 mg

Lipinsky:
logP: 3.624
Rotatable bonds: 10
H-donors: 3
H-acceptors: 4
PSA: 179
Number of rings: 3

     

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