COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK680560
Chemical Name: methyl3,3,3-trifluoro-2-[2-(4-nitrophenyl)hydrazinyl]-N-(phenylcarbonyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)NNc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 412.33
Empirical Formula: C17H15F3N4O5

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 7.246
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 125
Number of rings: 2

     

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