COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK662622
Chemical Name: 5-({[3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)phenyl]carbonyl}amino)benzene-1,3-dicarboxylicacid
Smiles: O=C(c1cccc(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-])Nc1cc(cc(c1)C(=O)O)C(=O)O

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Molecular Weight: 525.43
Empirical Formula: C27H15N3O9

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 3.211
Rotatable bonds: 5
H-donors: 3
H-acceptors: 9
PSA: 186
Number of rings: 5

     

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