COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295094
Chemical Name: 4-(6,7-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
Smiles: [O-][N+](=O)c1ccc2c3c1c(ccc3c(=O)n(c2=O)c1ccc(cc1)S(=O)(=O)Nc1nccs1)[N+](=O)[O-]

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Molecular Weight: 525.48
Empirical Formula: C21H11N5O8S2

Physical State: Dry powder
Available Amount: 505 mg

Lipinsky:
logP: 1.099
Rotatable bonds: 0
H-donors: 1
H-acceptors: 8
PSA: 224
Number of rings: 5

     

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