COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK105030
Chemical Name: methyl4-{[(2E,5E)-5-{2-bromo-4-[(2-cyanobenzyl)oxy]-5-methoxybenzylidene}-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: CCN1/C(=N\c2ccc(cc2)C(=O)OC)/S/C(=C/c2cc(OC)c(cc2Br)OCc2ccccc2C#N)/C1=O

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Molecular Weight: 606.5
Empirical Formula: C29H24BrN3O5S

Physical State: Dry powder
Available Amount: 406 mg

Lipinsky:
logP: 7.394
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 126
Number of rings: 4

     

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