COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK247532
Chemical Name: 2-(3-nitrophenyl)-2-oxoethyl3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
Smiles: O=C(c1cccc(c1)N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])OCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 475.37
Empirical Formula: C23H13N3O9

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 3.411
Rotatable bonds: 5
H-donors: 0
H-acceptors: 9
PSA: 172
Number of rings: 4

     

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