COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369970
Chemical Name: methyl{4-[(E)-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetate
Smiles: COC(=O)COc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 454.5
Empirical Formula: C23H22N2O6S

Physical State: Dry powder
Available Amount: 942 mg

Lipinsky:
logP: 3.717
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 127
Number of rings: 3

     

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