COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428573
Chemical Name: [(5E)-5-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethoxy}benzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: O=C(Nc1ccc(c(c1)C)C)COc1cccc(c1)/C=C\1/SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 456.54
Empirical Formula: C22H20N2O5S2

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 3.166
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 153
Number of rings: 3

     

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