COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333929
Chemical Name: benzyl{[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl}acetate
Smiles: N#Cc1ccc(nc1SCC(=O)OCc1ccccc1)c1ccc2c(c1)OCO2

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Molecular Weight: 404.45
Empirical Formula: C22H16N2O4S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 4.327
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 106
Number of rings: 4

     

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