COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428710
Chemical Name: {(5Z)-5-[4-(1,3-benzodioxol-5-ylmethoxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2ccc(cc2)OCc2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 429.47
Empirical Formula: C20H15NO6S2

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 3.138
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 142
Number of rings: 4

     

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