COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843457
Chemical Name: butyl[(3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate
Smiles: CCCCOC(=O)CSc1nc2CC(C)(C)CC(=O)c2cc1C#N

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Molecular Weight: 346.45
Empirical Formula: C18H22N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.242
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 105
Number of rings: 2

     

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