COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374806
Chemical Name: 5-({(2E,5Z)-5-[4-(carboxymethoxy)-3-methoxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)-2-chlorobenzoicacid
Smiles: COc1cc(ccc1OCC(=O)O)/C=C/1\S/C(=N/c2ccc(c(c2)C(=O)O)Cl)/N(C1=O)C

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Molecular Weight: 476.89
Empirical Formula: C21H17ClN2O7S

Physical State: Dry powder
Available Amount: 844 mg

Lipinsky:
logP: 3.604
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 151
Number of rings: 3

     

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