COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705781
Chemical Name: {(5Z)-5-[(3-{3-[(2,6-dimethylmorpholin-4-yl)sulfonyl]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)S(=O)(=O)N2CC(C)OC(C2)C)c2ccccc2)/C1=O

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Molecular Weight: 598.72
Empirical Formula: C27H26N4O6S3

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 3.562
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 187
Number of rings: 5

     

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