COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL388282
Chemical Name: 2-(2,3-dimethylphenyl)-5-nitro-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: [O-][N+](=O)c1cc2c(=O)n(c3cccc(c3C)C)c(=O)c3c2c(c1N1CCCCC1)ccc3

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Molecular Weight: 429.48
Empirical Formula: C25H23N3O4

Physical State: Dry powder
Available Amount: 429 mg

Lipinsky:
logP: 5.549
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 86
Number of rings: 5

     

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