Molecule

ID:134461

General Information
Structure
MolImage
Molecular Formula
C₆H₂₀BF₄N₄P
Molecular Mass
266.0281738
Exact Mass
266.14547657
Charge
0
InChI
InChI=1S/C6H20N4P.BF4/c1-8(2)11(7,9(3)4)10(5)6;2-1(3,4)5/h7H2,1-6H3;/q+1;-1
InChIKey
SRBMXBQBEFNXDX-UHFFFAOYSA-N
Canonic Smiles
F[B-](F)(F)F.CN([P+](N(C)C)(N(C)C)N)C
Isomeric Smiles
[B-](F)(F)(F)F.CN(C)[P+](N)(N(C)C)N(C)C
Calculated Properties
JChem
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
-2.126977
LogD (pH = 7.4)
-2.1266742
Log P
-2.1266701
Molar Refractivity
52.4795
Polarizability
20.974169
Polar Surface Area
35.74
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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