COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK275042
Chemical Name: 2-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl3-nitrobenzoate
Smiles: CC1C=CCC2C1C(=O)N(C2=O)c1ccccc1OC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 406.39
Empirical Formula: C22H18N2O6

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 3.171
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 109
Number of rings: 4

     

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