COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK103145
Chemical Name: 2-({4-[(1,3-diethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-ethoxyphenoxy}methyl)benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)C=C1C(=O)N(CC)C(=S)N(C1=O)CC

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Molecular Weight: 463.56
Empirical Formula: C25H25N3O4S

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 3.78
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 114
Number of rings: 3

     

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