COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112130
Chemical Name: {(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: OC(=O)CN1C(=O)/C(=C/c2cc3OCOc3cc2Br)/SC1=O

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Molecular Weight: 386.18
Empirical Formula: C13H8BrNO6S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.234
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 118
Number of rings: 3

     

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