COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK105243
Chemical Name: 2-({4-[(E)-{(2E)-2-[(3,4-dimethylphenyl)imino]-3-ethyl-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-methoxyphenoxy}methyl)benzonitrile
Smiles: CCN1/C(=N\c2ccc(c(c2)C)C)/S/C(=C/c2ccc(c(c2)OC)OCc2ccccc2C#N)/C1=O

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Molecular Weight: 497.62
Empirical Formula: C29H27N3O3S

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 6.814
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 100
Number of rings: 4

     

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