COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK190212
Chemical Name: 2-[(4-{(Z)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)methyl]benzonitrile
Smiles: C=CCN1C(=S)NC(=O)/C(=C/c2ccc(c(c2)OC)OCc2ccccc2C#N)/C1=O

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Molecular Weight: 433.49
Empirical Formula: C23H19N3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.289
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 123
Number of rings: 3

     

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