COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK862770
Chemical Name: 2-[(2-chlorobenzyl)sulfanyl]-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1)C1CC(=O)NC(=C1C#N)SCc1ccccc1Cl

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Molecular Weight: 398.91
Empirical Formula: C21H19ClN2O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.431
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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