COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111925
Chemical Name: 2-({(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzonitrile
Smiles: N#Cc1ccccc1CN1C(=O)S/C(=C\c2cc3OCOc3cc2Br)/C1=O

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Molecular Weight: 443.28
Empirical Formula: C19H11BrN2O4S

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 4.694
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 104
Number of rings: 4

     

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