COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725774
Chemical Name: methyl6-{[2-(benzyloxy)-2-oxoethyl]sulfanyl}-5-cyano-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccccc1[N+](=O)[O-])C#N)SCC(=O)OCc1ccccc1

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Molecular Weight: 481.49
Empirical Formula: C23H19N3O7S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.204
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 176
Number of rings: 3

     

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