COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428591
Chemical Name: [(5E)-5-(4-{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)COc1ccc(cc1)/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: 135 mg

Lipinsky:
logP: 3.136
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 153
Number of rings: 3

     

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