COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK122754
Chemical Name: heptyl2-(4-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Smiles: CCCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 410.43
Empirical Formula: C22H22N2O6

Physical State: Dry powder
Available Amount: 281 mg

Lipinsky:
logP: 5.296
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 109
Number of rings: 3

     

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