COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378902
Chemical Name: N-(3,4-dimethylphenyl)-2-(4-{(E)-[3-(2,5-dimethyl-1H-pyrrol-1-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)acetamide
Smiles: COc1cc(ccc1OCC(=O)Nc1ccc(c(c1)C)C)/C=C\1/SC(=S)N(C1=O)n1c(C)ccc1C

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Molecular Weight: 521.66
Empirical Formula: C27H27N3O4S2

Physical State: Dry powder
Available Amount: 916 mg

Lipinsky:
logP: 6.259
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 130
Number of rings: 4

     

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