COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK502142
Chemical Name: {ethyl3-(amino-kappaN)-4,4,4-trifluoro-2-[1-(oxo-kappaO)ethyl]but-2-enoatato}(diphenyl)boron
Smiles: CCOC(=O)C1=C(N[B-]([O+]=C1C)(c1ccccc1)c1ccccc1)C(F)(F)F

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Molecular Weight: 389.18
Empirical Formula: C20H19BF3NO3

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 38
Number of rings: 3

     

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