COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743074
Chemical Name: 4-{[(2E,5Z)-5-(5-bromo-2,4-dimethoxybenzylidene)-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoicacid
Smiles: CCN1/C(=N\c2ccc(cc2)C(=O)O)/S/C(=C\c2cc(Br)c(cc2OC)OC)/C1=O

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Molecular Weight: 491.36
Empirical Formula: C21H19BrN2O5S

Physical State: Dry powder
Available Amount: 731 mg

Lipinsky:
logP: 5.746
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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