COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK885724
Chemical Name: methyl5-cyano-4-(2-methylphenyl)-2-oxo-6-(prop-2-en-1-ylsulfanyl)-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: C=CCSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccccc1C

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Molecular Weight: 342.42
Empirical Formula: C18H18N2O3S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 4.452
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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