COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK371018
Chemical Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(CCN2C(=O)c3c(C2=O)cccc3[N+](=O)[O-])ccc1OC

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Molecular Weight: 356.33
Empirical Formula: C18H16N2O6

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 3.215
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 101
Number of rings: 3

     

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