COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383112
Chemical Name: 6-bromo-2-(2-methoxy-4-nitrophenyl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: COc1cc(ccc1n1c(=O)c2cccc3c2c(c1=O)cc(c3Br)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 472.21
Empirical Formula: C19H10BrN3O7

Physical State: Dry powder
Available Amount: 248 mg

Lipinsky:
logP: 3.188
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 138
Number of rings: 4

     

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