COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147149
Chemical Name: 3-methyl-2-(2-oxopropyl)isoquinolinium
Smiles: CC(=O)C[n+]1cc2ccccc2cc1C

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Saltdata: Cl-
Molecular Weight: 200.26
Empirical Formula: C13H14NO

Physical State: Dry powder
Available Amount: 216 mg

Lipinsky:
logP: -2.134
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 20
Number of rings: 2

     

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