COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK813459
Chemical Name: (5Z)-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-3-dodecyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccccc2)c2ccccc2)/C1=O

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Molecular Weight: 531.79
Empirical Formula: C31H37N3OS2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 9.768
Rotatable bonds: 12
H-donors: 0
H-acceptors: 1
PSA: 95
Number of rings: 4

     

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