COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029966
Chemical Name: 7,7-dimethyl-2-(methylsulfanyl)-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CSc1nc2CC(C)(C)CC(=O)c2cc1C#N

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Molecular Weight: 246.33
Empirical Formula: C13H14N2OS

Physical State: Dry powder
Available Amount: 273 mg

Lipinsky:
logP: 3.471
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 79
Number of rings: 2

     

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