COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815060
Chemical Name: (5Z)-3-(2-ethylhexyl)-5-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCC(CN1C(=S)S/C(=C\c2c[nH]nc2c2ccccc2)/C1=O)CC

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Molecular Weight: 399.58
Empirical Formula: C21H25N3OS2

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 5.41
Rotatable bonds: 7
H-donors: 1
H-acceptors: 1
PSA: 106
Number of rings: 3

     

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