COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL296802
Chemical Name: 2-({2-chloro-4-[(Z)-(2,4-dioxo-3-propyl-1,3-thiazolidin-5-ylidene)methyl]-6-ethoxyphenoxy}methyl)benzonitrile
Smiles: CCCN1C(=O)S/C(=C\c2cc(Cl)c(c(c2)OCC)OCc2ccccc2C#N)/C1=O

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Molecular Weight: 456.95
Empirical Formula: C23H21ClN2O4S

Physical State: Dry powder
Available Amount: 1126 mg

Lipinsky:
logP: 5.701
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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