COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379960
Chemical Name: (5E)-3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[3-iodo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-1,3-thiazolidine-2,4-dione
Smiles: C#CCOc1c(I)cc(cc1OC)/C=C\1/SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl

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Molecular Weight: 583.79
Empirical Formula: C22H15ClINO6S

Physical State: Dry powder
Available Amount: 995 mg

Lipinsky:
logP: 5.611
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 99
Number of rings: 4

     

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