COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295093
Chemical Name: 4-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(2-hydroxyethyl)benzenesulfonamide
Smiles: OCCNS(=O)(=O)c1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 486.42
Empirical Formula: C20H14N4O9S

Physical State: Dry powder
Available Amount: 393 mg

Lipinsky:
logP: 0.135
Rotatable bonds: 3
H-donors: 2
H-acceptors: 9
PSA: 203
Number of rings: 4

     

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