COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL294683
Chemical Name: 2-ethyl-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: CCn1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 315.24
Empirical Formula: C14H9N3O6

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 0.787
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 129
Number of rings: 3

     

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