COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK750934
Chemical Name: 4-(5,8-dinitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N,N-diethylbenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)[N+](=O)[O-])[N+](=O)[O-])CC

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Molecular Weight: 498.47
Empirical Formula: C22H18N4O8S

Physical State: Dry powder
Available Amount: 83 mg

Lipinsky:
logP: 2.592
Rotatable bonds: 2
H-donors: 0
H-acceptors: 8
PSA: 174
Number of rings: 4

     

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