COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL364513
Chemical Name: 4-[(E)-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl3-bromobenzoate
Smiles: COc1cc(ccc1OC(=O)c1cccc(c1)Br)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 595.47
Empirical Formula: C28H23BrN2O6S

Physical State: Dry powder
Available Amount: 592 mg

Lipinsky:
logP: 6.828
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 127
Number of rings: 4

     

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