COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK860576
Chemical Name: 4-(2,5-dimethoxyphenyl)-6-oxo-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCSC1=C(C#N)C(CC(=O)N1)c1cc(OC)ccc1OC

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Molecular Weight: 332.42
Empirical Formula: C17H20N2O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.407
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 2

     

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