COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK827261
Chemical Name: 2-(butylsulfanyl)-4-(3,4-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(c(c1)OC)OC

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Molecular Weight: 346.45
Empirical Formula: C18H22N2O3S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.795
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 2

     

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