COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL337373
Chemical Name: ethyl{[3-cyano-4-(2,5-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cc(OC)ccc1OC

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Molecular Weight: 376.43
Empirical Formula: C18H20N2O5S

Available Amount: 0 mg

Lipinsky:
logP: 3.444
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 2

     

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