COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK764241
Chemical Name: methyl({4-[3-(benzyloxy)-4-methoxyphenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(c(c1)OCc1ccccc1)OC

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Molecular Weight: 438.5
Empirical Formula: C23H22N2O5S

Physical State: Dry powder
Available Amount: 385 mg

Lipinsky:
logP: 4.424
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 3

     

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