COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358445
Chemical Name: 4-(5-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoicacid
Smiles: OC(=O)CCCn1c(=O)c2cc(cc3c2c(c1=O)ccc3)[N+](=O)[O-]

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Molecular Weight: 328.28
Empirical Formula: C16H12N2O6

Physical State: Dry powder
Available Amount: 239 mg

Lipinsky:
logP: 0.938
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 120
Number of rings: 3

     

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