COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK406971
Chemical Name: 2-(ethylsulfanyl)ethyl2-methyl-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Smiles: CCSCCOC(=O)C1=C(C)NC(=O)CC1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 364.42
Empirical Formula: C17H20N2O5S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 3.398
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 126
Number of rings: 2

     

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