COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK661499
Chemical Name: ethyl6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1[N+](=O)[O-])C#N)SCC(=O)N

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Molecular Weight: 404.4
Empirical Formula: C17H16N4O6S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 2.475
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 193
Number of rings: 2

     

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