COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295083
Chemical Name: 2-(5-chloropyridin-2-yl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: Clc1ccc(nc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 398.72
Empirical Formula: C17H7ClN4O6

Physical State: Dry powder
Available Amount: 682 mg

Lipinsky:
logP: 1.359
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 141
Number of rings: 4

     

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