COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419118
Chemical Name: 2-[(2-{(E)-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4,6-diiodophenoxy)methyl]benzonitrile
Smiles: N#Cc1ccccc1COc1c(cc(cc1I)I)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)C

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Molecular Weight: 708.38
Empirical Formula: C26H18I2N2O2S2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 8.419
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 110
Number of rings: 4

     

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