COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL129486
Chemical Name: 4-[(2-carboxyethyl)sulfanyl]-6-methoxy-2-methylquinolinium
Smiles: Cc1cc(SCCC(=O)O)c2c([nH+]1)ccc(c2)OC

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Saltdata: Cl-
Molecular Weight: 278.35
Empirical Formula: C14H16NO3S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 2.664
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 85
Number of rings: 2

     

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