COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL359733
Chemical Name: 5-nitro-2-(2-phenylethyl)-6-(pyrrolidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=c1n(CCc2ccccc2)c(=O)c2c3c1cccc3c(c(c2)[N+](=O)[O-])N1CCCC1

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Molecular Weight: 415.45
Empirical Formula: C24H21N3O4

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 4.505
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 86
Number of rings: 5

     

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