COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367787
Chemical Name: (5E)-5-{4-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethoxy]-3-methoxybenzylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(ccc1OCC(=O)N1CCCc2c1cccc2)/C=C\1/SC(=S)N(C1=O)C

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Molecular Weight: 454.57
Empirical Formula: C23H22N2O4S2

Physical State: Dry powder
Available Amount: 1398 mg

Lipinsky:
logP: 3.014
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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