COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505709
Chemical Name: (2E,5Z)-3-benzyl-2-(benzylimino)-5-[5-bromo-3-methoxy-2-(prop-2-yn-1-yloxy)benzylidene]-1,3-thiazolidin-4-one
Smiles: C#CCOc1c(cc(cc1OC)Br)/C=C/1\S/C(=N/Cc2ccccc2)/N(C1=O)Cc1ccccc1

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Molecular Weight: 547.47
Empirical Formula: C28H23BrN2O3S

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 6.104
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 76
Number of rings: 4

     

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