COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380337
Chemical Name: {4-[(E)-{3-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]-2-ethoxyphenoxy}aceticacid
Smiles: CCOc1cc(ccc1OCC(=O)O)/C=C\1/SC(=O)N(C1=O)CC(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 496.54
Empirical Formula: C25H24N2O7S

Physical State: Dry powder
Available Amount: 1503 mg

Lipinsky:
logP: 3.728
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 138
Number of rings: 4

     

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