COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887390
Chemical Name: methyl5-cyano-6-[(3-ethoxy-3-oxopropanoyl)sulfanyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)CC(=O)SC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccc(cc1)OCC

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Molecular Weight: 446.48
Empirical Formula: C21H22N2O7S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 4.346
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 157
Number of rings: 2

     

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