COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383111
Chemical Name: N-(6-bromo-5-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentanamide
Smiles: CCCCC(=O)Nn1c(=O)c2cccc3c2c(c1=O)cc(c3Br)[N+](=O)[O-]

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Molecular Weight: 420.22
Empirical Formula: C17H14BrN3O5

Physical State: Dry powder
Available Amount: 920 mg

Lipinsky:
logP: 2.518
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 3

     

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