COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL307705
Chemical Name: (5E)-3-[4-chloro-3-(trifluoromethyl)phenyl]-5-[4-(octyloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C(F)(F)F)Cl

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Molecular Weight: 528.06
Empirical Formula: C25H25ClF3NO2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.428
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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