COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295492
Chemical Name: N-(3,4-dimethylphenyl)-4-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzenesulfonamide
Smiles: [O-][N+](=O)c1ccc2c3c1c(ccc3c(=O)n(c2=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(c(c1)C)C)[N+](=O)[O-]

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Molecular Weight: 546.52
Empirical Formula: C26H18N4O8S

Physical State: Dry powder
Available Amount: 620 mg

Lipinsky:
logP: 3.29
Rotatable bonds: 0
H-donors: 1
H-acceptors: 8
PSA: 183
Number of rings: 5

     

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