COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527022
Chemical Name: 1,3-dimethyl-2,6-dioxo-5-(2,3,3-trimethyl-1,2,3,4-tetrahydroisoquinolinium-1-yl)-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: [O-]c1c(c(=O)n(c(=O)n1C)C)C1c2ccccc2CC([NH+]1C)(C)C

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Molecular Weight: 329.4
Empirical Formula: C18H23N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.151
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 68
Number of rings: 3

     

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