COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113001
Chemical Name: 2-[(4-{(E)-[3-(2,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzonitrile
Smiles: COc1cc(ccc1OCc1ccccc1C#N)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1C)C

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Molecular Weight: 486.62
Empirical Formula: C27H22N2O3S2

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.296
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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