COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016673
Chemical Name: 2-[3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)phenyl]-4-oxo-4H-3,1-benzoxazin-6-ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)c(=O)oc(n2)c1cccc(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-]

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Molecular Weight: 521.44
Empirical Formula: C28H15N3O8

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 2.583
Rotatable bonds: 3
H-donors: 0
H-acceptors: 8
PSA: 148
Number of rings: 6

     

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