COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428655
Chemical Name: N-(2-bromo-4,5-dimethylphenyl)-2-(2-methoxy-4-{(E)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetamide
Smiles: C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OCC(=O)Nc2cc(C)c(cc2Br)C)/C1=O

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Molecular Weight: 547.49
Empirical Formula: C24H23BrN2O4S2

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 4.329
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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