COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368543
Chemical Name: 3-({(2E,5Z)-5-[4-(carboxymethoxy)-3-chloro-5-methoxybenzylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoicacid
Smiles: COc1cc(/C=C/2\S/C(=N/c3cccc(c3)C(=O)O)/N(C2=O)C)cc(c1OCC(=O)O)Cl

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Molecular Weight: 476.89
Empirical Formula: C21H17ClN2O7S

Physical State: Dry powder
Available Amount: 547 mg

Lipinsky:
logP: 4.002
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 151
Number of rings: 3

     

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