COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295490
Chemical Name: 2-[4-(morpholin-4-ylsulfonyl)phenyl]-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=c1n(c2ccc(cc2)S(=O)(=O)N2CCOCC2)c(=O)c2c3c1ccc(c3c(cc2)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 512.46
Empirical Formula: C22H16N4O9S

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 0.856
Rotatable bonds: 0
H-donors: 0
H-acceptors: 9
PSA: 184
Number of rings: 5

     

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