COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379653
Chemical Name: (5E)-3-(1,3-benzodioxol-5-yl)-5-[4-(benzyloxy)-3-chloro-5-methoxybenzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc3c(c2)OCO3)cc(c1OCc1ccccc1)Cl

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Molecular Weight: 512.01
Empirical Formula: C25H18ClNO5S2

Physical State: Dry powder
Available Amount: 1210 mg

Lipinsky:
logP: 6.588
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 114
Number of rings: 5

     

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