COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK970810
Chemical Name: ethyl({5-[(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Smiles: CCOC(=O)CSc1nnc(n1c1ccccc1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 472.52
Empirical Formula: C25H20N4O4S

Available Amount: 0 mg

Lipinsky:
logP: 4.604
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 5

     

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