COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838870
Chemical Name: 2-(benzylsulfanyl)-4-(4-ethoxy-3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1OC)C1CC(=O)NC(=C1C#N)SCc1ccccc1

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Molecular Weight: 394.49
Empirical Formula: C22H22N2O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.658
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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