COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805855
Chemical Name: methyl{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)C

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Molecular Weight: 316.38
Empirical Formula: C16H16N2O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.492
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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