Molecule

ID:87050

General Information
Structure
MolImage
Molecular Formula
Br₆N₃P₃
Molecular Mass
614.365383
Exact Mass
608.44052891
Charge
0
InChI
InChI=1S/Br6N3P3/c1-10(2)7-11(3,4)9-12(5,6)8-10
InChIKey
BISNZAMPUNENFV-UHFFFAOYSA-N
Canonic Smiles
BrP1(=NP(=NP(=N1)(Br)Br)(Br)Br)Br
Isomeric Smiles
P1(=NP(=NP(=N1)(Br)Br)(Br)Br)(Br)Br
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
3.0710166
LogD (pH = 7.4)
3.0710196
Log P
3.0710196
Molar Refractivity
83.0994
Polarizability
31.23927
Polar Surface Area
37.08
Rotatable Bonds
0
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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