COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374647
Chemical Name: (5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-(4-fluorobenzyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Fc1ccc(cc1)CN1C(=S)S/C(=C\c2cc3OCOc3cc2Br)/C1=O

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Molecular Weight: 452.32
Empirical Formula: C18H11BrFNO3S2

Physical State: Dry powder
Available Amount: 510 mg

Lipinsky:
logP: 4.776
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 4

     

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