COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295307
Chemical Name: 4-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(2-methylphenyl)benzenesulfonamide
Smiles: Cc1ccccc1NS(=O)(=O)c1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 532.49
Empirical Formula: C25H16N4O8S

Physical State: Dry powder
Available Amount: 520 mg

Lipinsky:
logP: 2.83
Rotatable bonds: 0
H-donors: 1
H-acceptors: 8
PSA: 183
Number of rings: 5

     

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