COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL232623
Chemical Name: 1-methoxypropan-2-ylcyano(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
Smiles: COCC(OC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)C(F)(F)F)C#N)C

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Molecular Weight: 513.52
Empirical Formula: C26H26F3N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.87
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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