COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK156014
Chemical Name: 2-(3-acetylphenyl)-5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(c2cccc(c2)C(=O)C)C(=O)c2c1cc(cc2)Oc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 402.36
Empirical Formula: C22H14N2O6

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 3.977
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 109
Number of rings: 4

     

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