COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK534190
Chemical Name: 4-(4-methylphenyl)-2-oxo-1,3-benzoxathiol-5-yl3-[(5E)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: O=C(Oc1ccc2c(c1c1ccc(cc1)C)sc(=O)o2)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O

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Molecular Weight: 533.65
Empirical Formula: C27H19NO5S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.844
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 155
Number of rings: 5

     

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