COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK813341
Chemical Name: (5Z)-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-octyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)/C1=O

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Molecular Weight: 507.7
Empirical Formula: C28H30FN3OS2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.125
Rotatable bonds: 9
H-donors: 0
H-acceptors: 1
PSA: 95
Number of rings: 4

     

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