COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725841
Chemical Name: benzyl{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: N#CC1=C(SCC(=O)OCc2ccccc2)NC(=O)CC1c1ccc(cc1)C

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Molecular Weight: 392.48
Empirical Formula: C22H20N2O3S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.34
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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