COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672535
Chemical Name: 2-(4-bromophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: Brc1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 442.18
Empirical Formula: C18H8BrN3O6

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 2.78
Rotatable bonds: 0
H-donors: 0
H-acceptors: 6
PSA: 129
Number of rings: 4

     

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