COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369738
Chemical Name: 2-({2-chloro-4-[(Z)-(1,3-dimethyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]-6-ethoxyphenoxy}methyl)benzonitrile
Smiles: CCOc1cc(/C=C\2/C(=O)N(C(=S)N2C)C)cc(c1OCc1ccccc1C#N)Cl

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Molecular Weight: 441.94
Empirical Formula: C22H20ClN3O3S

Physical State: Dry powder
Available Amount: 874 mg

Lipinsky:
logP: 4.024
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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