COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507451
Chemical Name: 1,4-dimethyl-6-nitro-7-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1,4-dihydroquinoxaline-2,3-dione
Smiles: [O-][N+](=O)c1cc2c(cc1N1CCN(CC1)c1cccc(c1)C(F)(F)F)n(C)c(=O)c(=O)n2C

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Molecular Weight: 463.42
Empirical Formula: C21H20F3N5O4

Physical State: Dry powder
Available Amount: 486 mg

Lipinsky:
logP: 3.456
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 92
Number of rings: 4

     

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