COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL307771
Chemical Name: 2-{(5Z)-5-[(5-chloro-8-methoxyquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-3-methylbutanoicacid
Smiles: COc1ccc(c2c1nc(cc2)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)C(C)C)Cl

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Molecular Weight: 436.94
Empirical Formula: C19H17ClN2O4S2

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 3.416
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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