COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374821
Chemical Name: 5-{[(2E,5Z)-5-(3-bromo-4-methoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}-2-chlorobenzoicacid
Smiles: COc1ccc(cc1Br)/C=C/1\S/C(=N/c2ccc(c(c2)C(=O)O)Cl)/N(C1=O)C

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Molecular Weight: 481.75
Empirical Formula: C19H14BrClN2O4S

Physical State: Dry powder
Available Amount: 615 mg

Lipinsky:
logP: 5.147
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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