COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170711
Chemical Name: 2-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl4-nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCCN1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

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Molecular Weight: 385.29
Empirical Formula: C17H11N3O8

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.176
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 155
Number of rings: 3

     

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