COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL129487
Chemical Name: 4-[(2-carboxyethyl)sulfanyl]-6-ethoxy-2-methylquinolinium
Smiles: CCOc1ccc2c(c1)c(SCCC(=O)O)cc([nH+]2)C

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Saltdata: Cl-
Molecular Weight: 292.38
Empirical Formula: C15H18NO3S

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 3.196
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 85
Number of rings: 2

     

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