COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838226
Chemical Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: [O-][N+](=O)c1ccc2c3c1cccc3c(=O)n(c2=O)c1c(C)[nH]nc1C

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Molecular Weight: 336.31
Empirical Formula: C17H12N4O4

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 1.686
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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