COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553512
Chemical Name: 2-[2-carboxy-1-(2-hydroxyquinolin-3-yl)ethyl]-3-hydroxy-1,4,5-trimethyl-1H-imidazol-3-ium
Smiles: OC(=O)CC(c1[n+](O)c(c(n1C)C)C)c1cc2ccccc2nc1O

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Saltdata: Cl-
Molecular Weight: 342.37
Empirical Formula: C18H20N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.16
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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