COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374801
Chemical Name: 5-{[(2E,5Z)-5-(5-bromo-2-ethoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}-2-chlorobenzoicacid
Smiles: CCOc1ccc(cc1/C=C/1\S/C(=N/c2ccc(c(c2)C(=O)O)Cl)/N(C1=O)C)Br

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Molecular Weight: 495.78
Empirical Formula: C20H16BrClN2O4S

Physical State: Dry powder
Available Amount: 866 mg

Lipinsky:
logP: 6.199
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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