COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK703663
Chemical Name: (5E)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-5-[4-(heptyloxy)-3-methoxybenzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCOc1ccc(cc1OC)/C=C\1/SC(=S)N(C1=O)C1CCS(=O)(=O)C1

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Molecular Weight: 483.67
Empirical Formula: C22H29NO5S3

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.77
Rotatable bonds: 10
H-donors: 0
H-acceptors: 5
PSA: 138
Number of rings: 3

     

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