COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK151492
Chemical Name: {4-(amino-kappaN)-3-[1-(butylimino-kappaN)ethyl]-5,5,5-trifluoropent-3-en-2-onato}(diphenyl)boron
Smiles: CCCC[N+]1=C(C)C(=C(N[B-]1(c1ccccc1)c1ccccc1)C(F)(F)F)C(=O)C

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Molecular Weight: 414.28
Empirical Formula: C23H26BF3N2O

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 40
Number of rings: 3

     

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