COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK624615
Chemical Name: 2-{(5E)-5-[(8-chloroquinolin-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}hexanoicacid
Smiles: CCCCC(N1C(=S)S/C(=C/c2ccc3c(n2)c(Cl)ccc3)/C1=O)C(=O)O

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Molecular Weight: 420.94
Empirical Formula: C19H17ClN2O3S2

Physical State: Dry powder
Available Amount: 179 mg

Lipinsky:
logP: 3.729
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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