COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416081
Chemical Name: 2-({4-[(E)-(1-ethyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]-2-iodo-6-methoxyphenoxy}methyl)benzonitrile
Smiles: CCN1C(=S)N/C(=C/c2cc(I)c(c(c2)OC)OCc2ccccc2C#N)/C1=O

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Molecular Weight: 519.36
Empirical Formula: C21H18IN3O3S

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 4.4
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 106
Number of rings: 3

     

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