COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK066565
Chemical Name: [(5E)-5-(4-{2-[(3,4-dimethylphenyl)amino]-2-oxoethoxy}-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)/C=C\1/SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 486.57
Empirical Formula: C23H22N2O6S2

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 3.018
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 162
Number of rings: 3

     

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