COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK010162
Chemical Name: 5-[5-(3-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzene-1,3-dicarboxylicacid
Smiles: OC(=O)c1cc(cc(c1)C(=O)O)N1C(=O)c2c(C1=O)ccc(c2)Oc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 448.35
Empirical Formula: C22H12N2O9

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.972
Rotatable bonds: 6
H-donors: 2
H-acceptors: 9
PSA: 167
Number of rings: 4

     

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